*HEADER    STRUCTURAL PROTEIN                      25-JUL-09   2KMA              
*TITLE     NMR STRUCTURE OF THE F0F1 DOUBLE DOMAIN (RESIDUES 1-202) OF           
*TITLE    2 THE TALIN FERM DOMAIN                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TALIN 1;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 1-138, RESIDUES 169-202;                      
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   4 ORGANISM_TAXID: 10090;                                               
*SOURCE   5 GENE: RP23-195K8.11-001, TLN, TLN1;                                  
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PET-151                                    
*KEYWDS    TALIN, FERM, F0, N-TERMINAL, F1, ADHESION, CYTOPLASM,                 
*KEYWDS   2 CYTOSKELETON, MEMBRANE, STRUCTURAL PROTEIN                           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    B.T.GOULT, P.R.ELLIOTT, N.BATE, G.C.ROBERTS, D.R.CRITCHLEY,           
*AUTHOR   2 I.L.BARSUKOV                                                         
*REVDAT   1   02-MAR-10 2KMA    0                                                


 ASSI {    9}
   (( segid "    " and resid 202  and name HG3 ))
   (( segid "    " and resid 202  and name HA  ))
      2.900     1.000     1.000 peak     9 spectrum    1 weight  0.10000E+01 volume  0.49017E-02 ppm1      2.209 ppm2      4.066 CV     1
 OR {    9}
   (( segid "    " and resid 202  and name HG2 ))
   (( segid "    " and resid 202  and name HA  ))
 ASSI {   11}
   (( segid "    " and resid 202  and name HA  ))
   (( segid "    " and resid 202  and name HB2 ))
      2.400     0.700     0.700 peak    11 spectrum    1 weight  0.10000E+01 volume  0.89976E-02 ppm1      4.068 ppm2      2.042 CV     1
 ASSI {   12}
   (( segid "    " and resid 202  and name HA  ))
   (( segid "    " and resid 202  and name HB3 ))
      2.700     0.900     0.900 peak    12 spectrum    1 weight  0.10000E+01 volume  0.66787E-02 ppm1      4.069 ppm2      1.836 CV     1
 ASSI {   15}
   (( segid "    " and resid 202  and name HB2 ))
   (( segid "    " and resid 202  and name HB3 ))
      1.600     0.300     0.600 peak    15 spectrum    1 weight  0.10000E+01 volume  0.30056E-01 ppm1      2.050 ppm2      1.835 CV     1
 ASSI {   17}
   (( segid "    " and resid 202  and name HG2 ))
   (( segid "    " and resid 202  and name HB2 ))
      1.900     0.500     0.500 peak    17 spectrum    1 weight  0.10000E+01 volume  0.43712E-01 ppm1      2.213 ppm2      2.043 CV     1
 OR {   17}
   (( segid "    " and resid 202  and name HG3 ))
   (( segid "    " and resid 202  and name HB2 ))
 ASSI {   18}
   (( segid "    " and resid 202  and name HG3 ))
   (( segid "    " and resid 202  and name HB3 ))
      2.400     0.700     0.700 peak    18 spectrum    1 weight  0.10000E+01 volume  0.10792E-01 ppm1      2.208 ppm2      1.835 CV     1
 OR {   18}
   (( segid "    " and resid 202  and name HG2 ))
   (( segid "    " and resid 202  and name HB3 ))
 ASSI {   19}
   (( segid "    " and resid 201  and name HA  ))
   (( segid "    " and resid 201  and name HB3 ))
      2.600     0.800     0.800 peak    19 spectrum    1 weight  0.10000E+01 volume  0.13175E-01 ppm1      4.583 ppm2      2.674 CV     1
 ASSI {   20}
   (( segid "    " and resid 201  and name HA  ))
   (( segid "    " and resid 201  and name HB2 ))
      2.300     0.600     0.600 peak    20 spectrum    1 weight  0.10000E+01 volume  0.10558E-01 ppm1      4.583 ppm2      2.607 CV     1
 ASSI {   21}
   (( segid "    " and resid 197  and name HB3 ))
   (( segid "    " and resid 126  and name HB3 ))
      3.800     1.800     1.800 peak    21 spectrum    1 weight  0.10000E+01 volume  0.23730E-02 ppm1      2.663 ppm2      2.090 CV     1
 ASSI {   22}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 85   and name HG3 ))
      2.300     0.700     0.700 peak    22 spectrum    1 weight  0.10000E+01 volume  0.25524E-02 ppm1      2.601 ppm2      2.038 CV     1
 ASSI {   26}
   (( segid "    " and resid 27   and name HB3 ))
   (  segid "    " and resid 23   and name HG2%)
      2.500     0.800     0.800 peak    26 spectrum    1 weight  0.10000E+01 volume  0.42856E-02 ppm1      2.604 ppm2      1.358 CV     1
 OR {   26}
   (( segid "    " and resid 27   and name HB2 ))
   (  segid "    " and resid 23   and name HG2%)
 ASSI {   27}
   (( segid "    " and resid 110  and name HB2 ))
   (  segid "    " and resid 109  and name HG2%)
      4.400     2.400     1.600 peak    27 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      2.665 ppm2      1.209 CV     1
 ASSI {   33}
   (( segid "    " and resid 197  and name HB3 ))
   (( segid "    " and resid 197  and name H   ))
      3.600     1.600     1.600 peak    33 spectrum    1 weight  0.10000E+01 volume  0.18550E-02 ppm1      2.687 ppm2      7.544 CV     1
 ASSI {   36}
   (( segid "    " and resid 201  and name HA  ))
   (( segid "    " and resid 202  and name H   ))
      2.700     0.900     0.900 peak    36 spectrum    1 weight  0.10000E+01 volume  0.76029E-02 ppm1      4.583 ppm2      7.716 CV     1
 ASSI {   37}
   (( segid "    " and resid 197  and name HB3 ))
   (( segid "    " and resid 198  and name H   ))
      2.200     0.600     0.600 peak    37 spectrum    1 weight  0.10000E+01 volume  0.75455E-02 ppm1      2.676 ppm2      8.164 CV     1
 ASSI {   42}
   (( segid "    " and resid 200  and name HA  ))
   (( segid "    " and resid 201  and name H   ))
      2.200     0.600     0.600 peak    42 spectrum    1 weight  0.10000E+01 volume  0.89842E-02 ppm1      4.347 ppm2      8.166 CV     1
 ASSI {   44}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name H   ))
      2.200     0.600     0.600 peak    44 spectrum    1 weight  0.10000E+01 volume  0.93972E-02 ppm1      3.709 ppm2      8.143 CV     1
 ASSI {   45}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 53   and name H   ))
      3.000     1.200     1.200 peak    45 spectrum    1 weight  0.10000E+01 volume  0.80802E-02 ppm1      3.708 ppm2      8.037 CV     1
 ASSI {   49}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 184  and name H   ))
      3.100     1.200     1.200 peak    49 spectrum    1 weight  0.10000E+01 volume  0.19803E-02 ppm1      4.347 ppm2      7.715 CV     1
 ASSI {   50}
   (( segid "    " and resid 200  and name HB2 ))
   (  segid "    " and resid 199  and name HD% )
      4.400     2.400     1.600 peak    50 spectrum    1 weight  0.10000E+01 volume  0.64994E-03 ppm1      3.819 ppm2      6.972 CV     1
 ASSI {   51}
   (( segid "    " and resid 200  and name HB3 ))
   (  segid "    " and resid 199  and name HD% )
      4.300     2.300     1.700 peak    51 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      3.713 ppm2      6.970 CV     1
 ASSI {   52}
   (( segid "    " and resid 200  and name HA  ))
   (  segid "    " and resid 199  and name HD% )
      4.100     2.100     1.900 peak    52 spectrum    1 weight  0.10000E+01 volume  0.14184E-02 ppm1      4.348 ppm2      6.968 CV     1
 ASSI {   53}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 50   and name HD% )
      3.600     1.600     1.600 peak    53 spectrum    1 weight  0.10000E+01 volume  0.22105E-02 ppm1      3.708 ppm2      5.502 CV     1
 ASSI {   54}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 50   and name HE% )
      3.100     1.200     1.200 peak    54 spectrum    1 weight  0.10000E+01 volume  0.45495E-02 ppm1      3.708 ppm2      6.501 CV     1
 OR {   54}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 50   and name HE% )
 ASSI {   55}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 173  and name HZ3 ))
      3.400     1.500     1.500 peak    55 spectrum    1 weight  0.10000E+01 volume  0.14048E-02 ppm1      3.703 ppm2      6.730 CV     1
 OR {   55}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 173  and name HZ3 ))
 ASSI {   56}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 61   and name HD1 ))
      3.900     1.900     1.900 peak    56 spectrum    1 weight  0.10000E+01 volume  0.87335E-03 ppm1      3.713 ppm2      7.324 CV     1
 ASSI {   58}
   (( segid "    " and resid 200  and name HB2 ))
   (( segid "    " and resid 200  and name HA  ))
      2.300     0.600     0.600 peak    58 spectrum    1 weight  0.10000E+01 volume  0.11784E-01 ppm1      3.821 ppm2      4.346 CV     1
 ASSI {   59}
   (( segid "    " and resid 200  and name HB3 ))
   (( segid "    " and resid 200  and name HA  ))
      2.300     0.700     0.700 peak    59 spectrum    1 weight  0.10000E+01 volume  0.10958E-01 ppm1      3.710 ppm2      4.346 CV     1
 ASSI {   63}
   (( segid "    " and resid 200  and name HB3 ))
   (( segid "    " and resid 200  and name HB2 ))
      1.600     0.300     0.600 peak    63 spectrum    1 weight  0.10000E+01 volume  0.33635E-01 ppm1      3.710 ppm2      3.819 CV     1
 ASSI {   65}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 52   and name HA  ))
      2.300     0.700     0.700 peak    65 spectrum    1 weight  0.10000E+01 volume  0.87268E-02 ppm1      3.708 ppm2      3.951 CV     1
 OR {   65}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI {   66}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HB3 ))
      2.400     0.700     0.700 peak    66 spectrum    1 weight  0.10000E+01 volume  0.21597E-02 ppm1      3.709 ppm2      2.408 CV     1
 ASSI {   67}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 61   and name HB3 ))
      4.100     2.100     1.900 peak    67 spectrum    1 weight  0.10000E+01 volume  0.58223E-03 ppm1      3.717 ppm2      3.137 CV     1
 ASSI {   68}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 182  and name HB3 ))
      3.200     1.300     1.300 peak    68 spectrum    1 weight  0.10000E+01 volume  0.22579E-02 ppm1      4.389 ppm2      2.314 CV     1
 ASSI {   70}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 194  and name HB3 ))
      4.600     2.700     1.400 peak    70 spectrum    1 weight  0.10000E+01 volume  0.78874E-03 ppm1      3.695 ppm2      1.702 CV     1
 ASSI {   71}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 194  and name HB2 ))
      3.400     1.400     1.400 peak    71 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      3.703 ppm2      1.501 CV     1
 OR {   71}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 194  and name HB2 ))
 ASSI {   72}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 78   and name HG2%)
      3.500     1.500     1.500 peak    72 spectrum    1 weight  0.10000E+01 volume  0.16384E-02 ppm1      3.710 ppm2      0.997 CV     1
 OR {   72}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 78   and name HG2%)
 ASSI {   73}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 51   and name HD2%)
      3.700     1.800     1.800 peak    73 spectrum    1 weight  0.10000E+01 volume  0.22172E-02 ppm1      3.703 ppm2      0.774 CV     1
 OR {   73}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI {   74}
   (( segid "    " and resid 199  and name HA  ))
   (( segid "    " and resid 199  and name HB2 ))
      2.300     0.700     0.700 peak    74 spectrum    1 weight  0.10000E+01 volume  0.10802E-01 ppm1      4.474 ppm2      2.965 CV     1
 ASSI {   75}
   (( segid "    " and resid 199  and name HA  ))
   (( segid "    " and resid 199  and name HB3 ))
      2.500     0.800     0.800 peak    75 spectrum    1 weight  0.10000E+01 volume  0.78365E-02 ppm1      4.474 ppm2      2.789 CV     1
 ASSI {   77}
   (( segid "    " and resid 199  and name HB2 ))
   (( segid "    " and resid 199  and name HB3 ))
      1.600     0.300     0.600 peak    77 spectrum    1 weight  0.10000E+01 volume  0.23103E-01 ppm1      2.967 ppm2      2.790 CV     1
 ASSI {   81}
   (( segid "    " and resid 199  and name HA  ))
   (  segid "    " and resid 199  and name HD% )
      3.100     1.200     1.200 peak    81 spectrum    1 weight  0.10000E+01 volume  0.10264E-01 ppm1      4.474 ppm2      6.968 CV     1
 ASSI {   82}
   (( segid "    " and resid 199  and name HA  ))
   (  segid "    " and resid 199  and name HE% )
      5.000     3.200     1.000 peak    82 spectrum    1 weight  0.10000E+01 volume  0.11848E-02 ppm1      4.475 ppm2      6.616 CV     1
 ASSI {   84}
   (( segid "    " and resid 199  and name HB2 ))
   (  segid "    " and resid 199  and name HE% )
      4.700     2.700     1.300 peak    84 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      2.967 ppm2      6.606 CV     1
 ASSI {   86}
   (( segid "    " and resid 199  and name HB3 ))
   (  segid "    " and resid 199  and name HE% )
      4.900     3.000     1.100 peak    86 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      2.786 ppm2      6.613 CV     1
 ASSI {   87}
   (( segid "    " and resid 199  and name HA  ))
   (( segid "    " and resid 199  and name H   ))
      2.600     0.800     0.800 peak    87 spectrum    1 weight  0.10000E+01 volume  0.52232E-02 ppm1      4.474 ppm2      7.829 CV     1
 ASSI {   91}
   (( segid "    " and resid 199  and name HA  ))
   (( segid "    " and resid 198  and name H   ))
      4.100     2.100     1.900 peak    91 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      4.478 ppm2      8.152 CV     1
 ASSI {   94}
   (( segid "    " and resid 198  and name HA  ))
   (( segid "    " and resid 198  and name H   ))
      2.800     1.000     1.000 peak    94 spectrum    1 weight  0.10000E+01 volume  0.29756E-02 ppm1      4.408 ppm2      8.154 CV     1
 ASSI {   95}
   (( segid "    " and resid 198  and name HB2 ))
   (( segid "    " and resid 198  and name H   ))
      2.600     0.800     0.800 peak    95 spectrum    1 weight  0.10000E+01 volume  0.34460E-02 ppm1      2.682 ppm2      8.155 CV     1
 ASSI {   96}
   (( segid "    " and resid 198  and name HB3 ))
   (( segid "    " and resid 199  and name H   ))
      4.000     2.000     2.000 peak    96 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      2.954 ppm2      7.830 CV     1
 ASSI {   97}
   (( segid "    " and resid 198  and name HB2 ))
   (( segid "    " and resid 199  and name H   ))
      3.900     1.900     1.900 peak    97 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      2.669 ppm2      7.827 CV     1
 ASSI {   98}
   (( segid "    " and resid 198  and name HA  ))
   (( segid "    " and resid 199  and name H   ))
      2.400     0.700     0.700 peak    98 spectrum    1 weight  0.10000E+01 volume  0.53248E-02 ppm1      4.410 ppm2      7.829 CV     1
 ASSI {   99}
   (( segid "    " and resid 198  and name HB3 ))
   (( segid "    " and resid 198  and name H   ))
      3.600     1.600     1.600 peak    99 spectrum    1 weight  0.10000E+01 volume  0.31278E-02 ppm1      2.958 ppm2      8.153 CV     1
 ASSI {  100}
   (( segid "    " and resid 198  and name HB3 ))
   (  segid "    " and resid 198  and name HE% )
      5.000     3.100     1.000 peak   100 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1      2.960 ppm2      7.105 CV     1
 ASSI {  101}
   (( segid "    " and resid 198  and name HB3 ))
   (  segid "    " and resid 198  and name HD% )
      2.700     0.900     0.900 peak   101 spectrum    1 weight  0.10000E+01 volume  0.54364E-02 ppm1      2.951 ppm2      6.965 CV     1
 ASSI {  102}
   (( segid "    " and resid 198  and name HB2 ))
   (  segid "    " and resid 198  and name HE% )
      5.100     3.200     0.900 peak   102 spectrum    1 weight  0.10000E+01 volume  0.76166E-03 ppm1      2.678 ppm2      7.096 CV     1
 ASSI {  103}
   (( segid "    " and resid 198  and name HB2 ))
   (  segid "    " and resid 198  and name HD% )
      2.600     0.900     0.900 peak   103 spectrum    1 weight  0.10000E+01 volume  0.48947E-02 ppm1      2.680 ppm2      6.965 CV     1
 ASSI {  106}
   (( segid "    " and resid 198  and name HB2 ))
   (( segid "    " and resid 198  and name HA  ))
      3.000     1.200     1.200 peak   106 spectrum    1 weight  0.10000E+01 volume  0.40587E-02 ppm1      2.680 ppm2      4.410 CV     1
 ASSI {  107}
   (( segid "    " and resid 198  and name HB2 ))
   (( segid "    " and resid 198  and name HB3 ))
      1.700     0.400     0.500 peak   107 spectrum    1 weight  0.10000E+01 volume  0.16570E-01 ppm1      2.680 ppm2      2.951 CV     1
 ASSI {  108}
   (( segid "    " and resid 198  and name HA  ))
   (( segid "    " and resid 198  and name HB3 ))
      2.400     0.700     0.700 peak   108 spectrum    1 weight  0.10000E+01 volume  0.65399E-02 ppm1      4.408 ppm2      2.952 CV     1
 ASSI {  111}
   (( segid "    " and resid 110  and name HA  ))
   (  segid "    " and resid 109  and name HG2%)
      3.300     1.400     1.400 peak   111 spectrum    1 weight  0.10000E+01 volume  0.19329E-02 ppm1      4.382 ppm2      1.204 CV     1
 ASSI {  112}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 113  and name HB3 ))
      3.600     1.600     1.600 peak   112 spectrum    1 weight  0.10000E+01 volume  0.10528E-02 ppm1      4.379 ppm2      1.750 CV     1
 OR {  112}
   (( segid "    " and resid 110  and name HA  ))
   (  segid "    " and resid 113  and name HE% )
 ASSI {  114}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 196  and name H   ))
      3.000     1.100     1.100 peak   114 spectrum    1 weight  0.10000E+01 volume  0.19498E-02 ppm1      3.774 ppm2      8.347 CV     1
 ASSI {  115}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 197  and name H   ))
      3.100     1.200     1.200 peak   115 spectrum    1 weight  0.10000E+01 volume  0.35002E-02 ppm1      3.771 ppm2      7.549 CV     1
 ASSI {  116}
   (( segid "    " and resid 196  and name HB2 ))
   (( segid "    " and resid 197  and name H   ))
      4.600     2.600     1.400 peak   116 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      0.902 ppm2      7.546 CV     1
 ASSI {  120}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 194  and name HE  ))
      2.400     2.400     3.600 peak   120 spectrum    1 weight  0.10000E+01 volume  0.14048E-02 ppm1      3.769 ppm2      7.336 CV     1
 ASSI {  121}
   (( segid "    " and resid 196  and name HD2 ))
   (  segid "    " and resid 197  and name HE% )
      4.300     2.300     1.700 peak   121 spectrum    1 weight  0.10000E+01 volume  0.11577E-02 ppm1      0.885 ppm2      7.112 CV     1
 ASSI {  122}
   (( segid "    " and resid 196  and name HE2 ))
   (  segid "    " and resid 197  and name HE% )
      3.700     1.700     1.700 peak   122 spectrum    1 weight  0.10000E+01 volume  0.80567E-03 ppm1      1.959 ppm2      7.095 CV     1
 ASSI {  123}
   (( segid "    " and resid 196  and name HE3 ))
   (  segid "    " and resid 197  and name HE% )
      3.300     1.400     1.400 peak   123 spectrum    1 weight  0.10000E+01 volume  0.19160E-02 ppm1      2.215 ppm2      7.103 CV     1
 ASSI {  124}
   (( segid "    " and resid 196  and name HB2 ))
   (  segid "    " and resid 197  and name HD% )
      5.100     3.300     0.900 peak   124 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      0.898 ppm2      7.008 CV     1
 ASSI {  133}
   (( segid "    " and resid 196  and name HE3 ))
   (( segid "    " and resid 196  and name HE2 ))
      1.800     0.400     0.400 peak   133 spectrum    1 weight  0.10000E+01 volume  0.11035E-01 ppm1      2.215 ppm2      1.954 CV     1
 ASSI {  138}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 196  and name HD3 ))
      4.900     3.000     1.100 peak   138 spectrum    1 weight  0.10000E+01 volume  0.95122E-03 ppm1      3.768 ppm2      0.540 CV     1
 ASSI {  139}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 196  and name HB2 ))
      2.600     0.800     0.800 peak   139 spectrum    1 weight  0.10000E+01 volume  0.37000E-02 ppm1      3.775 ppm2      0.892 CV     1
 ASSI {  140}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 196  and name HB3 ))
      3.100     1.200     1.200 peak   140 spectrum    1 weight  0.10000E+01 volume  0.32090E-02 ppm1      3.773 ppm2      0.826 CV     1
 ASSI {  141}
   (( segid "    " and resid 196  and name HB3 ))
   (( segid "    " and resid 196  and name HB2 ))
      2.200     0.600     0.600 peak   141 spectrum    1 weight  0.10000E+01 volume  0.26471E-02 ppm1      0.821 ppm2      0.890 CV     1
 OR {  141}
   (( segid "    " and resid 196  and name HB3 ))
   (( segid "    " and resid 196  and name HD2 ))
 ASSI {  142}
   (( segid "    " and resid 196  and name HD3 ))
   (( segid "    " and resid 196  and name HD2 ))
      2.100     0.500     0.500 peak   142 spectrum    1 weight  0.10000E+01 volume  0.42145E-02 ppm1      0.545 ppm2      0.882 CV     1
 OR {  142}
   (( segid "    " and resid 196  and name HD3 ))
   (( segid "    " and resid 196  and name HB2 ))
 ASSI {  143}
   (( segid "    " and resid 196  and name HD2 ))
   (( segid "    " and resid 196  and name HD3 ))
      2.000     0.500     0.500 peak   143 spectrum    1 weight  0.10000E+01 volume  0.37982E-02 ppm1      0.884 ppm2      0.540 CV     1
 ASSI {  144}
   (( segid "    " and resid 196  and name HE2 ))
   (( segid "    " and resid 196  and name HD3 ))
      2.800     1.000     1.000 peak   144 spectrum    1 weight  0.10000E+01 volume  0.20040E-02 ppm1      1.951 ppm2      0.543 CV     1
 ASSI {  145}
   (( segid "    " and resid 196  and name HE2 ))
   (( segid "    " and resid 196  and name HD2 ))
      3.000     1.100     1.100 peak   145 spectrum    1 weight  0.10000E+01 volume  0.24474E-02 ppm1      1.957 ppm2      0.882 CV     1
 ASSI {  146}
   (( segid "    " and resid 196  and name HE3 ))
   (( segid "    " and resid 196  and name HD3 ))
      3.000     1.100     1.100 peak   146 spectrum    1 weight  0.10000E+01 volume  0.23357E-02 ppm1      2.215 ppm2      0.540 CV     1
 ASSI {  147}
   (( segid "    " and resid 196  and name HE3 ))
   (( segid "    " and resid 196  and name HD2 ))
      2.700     0.900     0.900 peak   147 spectrum    1 weight  0.10000E+01 volume  0.36933E-02 ppm1      2.216 ppm2      0.884 CV     1
 ASSI {  150}
   (( segid "    " and resid 196  and name HG3 ))
   (( segid "    " and resid 196  and name HD2 ))
      2.900     1.000     1.000 peak   150 spectrum    1 weight  0.10000E+01 volume  0.16113E-02 ppm1      0.179 ppm2      0.882 CV     1
 OR {  150}
   (( segid "    " and resid 196  and name HG3 ))
   (( segid "    " and resid 196  and name HB2 ))
 ASSI {  151}
   (( segid "    " and resid 196  and name HG2 ))
   (( segid "    " and resid 196  and name HB2 ))
      3.400     1.400     1.400 peak   151 spectrum    1 weight  0.10000E+01 volume  0.17061E-02 ppm1      0.104 ppm2      0.886 CV     1
 OR {  151}
   (( segid "    " and resid 196  and name HG2 ))
   (( segid "    " and resid 196  and name HD2 ))
 ASSI {  152}
   (( segid "    " and resid 196  and name HG2 ))
   (( segid "    " and resid 196  and name HB3 ))
      2.700     0.900     0.900 peak   152 spectrum    1 weight  0.10000E+01 volume  0.19701E-02 ppm1      0.112 ppm2      0.830 CV     1
 ASSI {  153}
   (( segid "    " and resid 196  and name HG3 ))
   (( segid "    " and resid 196  and name HG2 ))
      2.100     0.600     0.600 peak   153 spectrum    1 weight  0.10000E+01 volume  0.28198E-02 ppm1      0.178 ppm2      0.113 CV     1
 ASSI {  155}
   (( segid "    " and resid 196  and name HE3 ))
   (( segid "    " and resid 196  and name HG3 ))
      3.100     1.200     1.200 peak   155 spectrum    1 weight  0.10000E+01 volume  0.23831E-02 ppm1      2.213 ppm2      0.175 CV     1
 ASSI {  156}
   (( segid "    " and resid 196  and name HE3 ))
   (( segid "    " and resid 196  and name HG2 ))
      2.900     1.000     1.000 peak   156 spectrum    1 weight  0.10000E+01 volume  0.26877E-02 ppm1      2.215 ppm2      0.106 CV     1
 ASSI {  157}
   (( segid "    " and resid 196  and name HE2 ))
   (( segid "    " and resid 196  and name HG3 ))
      3.400     1.400     1.400 peak   157 spectrum    1 weight  0.10000E+01 volume  0.23019E-02 ppm1      1.957 ppm2      0.176 CV     1
 ASSI {  158}
   (( segid "    " and resid 196  and name HE2 ))
   (( segid "    " and resid 196  and name HG2 ))
      3.200     1.300     1.300 peak   158 spectrum    1 weight  0.10000E+01 volume  0.19701E-02 ppm1      1.953 ppm2      0.106 CV     1
 ASSI {  159}
   (( segid "    " and resid 196  and name HD2 ))
   (( segid "    " and resid 196  and name HG2 ))
      3.300     1.400     1.400 peak   159 spectrum    1 weight  0.10000E+01 volume  0.17670E-02 ppm1      0.881 ppm2      0.116 CV     1
 ASSI {  160}
   (( segid "    " and resid 196  and name HD3 ))
   (( segid "    " and resid 196  and name HG3 ))
      3.500     1.500     1.500 peak   160 spectrum    1 weight  0.10000E+01 volume  0.12796E-02 ppm1      0.547 ppm2      0.180 CV     1
 ASSI {  161}
   (( segid "    " and resid 196  and name HD3 ))
   (( segid "    " and resid 196  and name HG2 ))
      3.100     1.200     1.200 peak   161 spectrum    1 weight  0.10000E+01 volume  0.11679E-02 ppm1      0.545 ppm2      0.102 CV     1
 ASSI {  162}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 196  and name HG3 ))
      2.800     1.000     1.000 peak   162 spectrum    1 weight  0.10000E+01 volume  0.23967E-02 ppm1      3.773 ppm2      0.179 CV     1
 ASSI {  163}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 196  and name HG2 ))
      3.400     1.400     1.400 peak   163 spectrum    1 weight  0.10000E+01 volume  0.22240E-02 ppm1      3.773 ppm2      0.102 CV     1
 ASSI {  164}
   (( segid "    " and resid 196  and name HB2 ))
   (( segid "    " and resid 196  and name HG3 ))
      3.100     1.200     1.200 peak   164 spectrum    1 weight  0.10000E+01 volume  0.96137E-03 ppm1      0.884 ppm2      0.178 CV     1
 ASSI {  165}
   (( segid "    " and resid 196  and name HB2 ))
   (( segid "    " and resid 196  and name HG2 ))
      3.800     1.800     1.800 peak   165 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1      0.903 ppm2      0.106 CV     1
 ASSI {  166}
   (( segid "    " and resid 196  and name HB3 ))
   (( segid "    " and resid 196  and name HG3 ))
      3.700     1.700     1.700 peak   166 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      0.816 ppm2      0.181 CV     1
 ASSI {  169}
   (( segid "    " and resid 195  and name HB2 ))
   (( segid "    " and resid 195  and name H   ))
      3.300     1.300     1.300 peak   169 spectrum    1 weight  0.10000E+01 volume  0.15707E-02 ppm1      1.189 ppm2      8.792 CV     1
 ASSI {  170}
   (( segid "    " and resid 195  and name HD3 ))
   (( segid "    " and resid 195  and name H   ))
      4.500     2.500     1.500 peak   170 spectrum    1 weight  0.10000E+01 volume  0.93090E-03 ppm1      2.705 ppm2      8.792 CV     1
 OR {  170}
   (( segid "    " and resid 195  and name HD2 ))
   (( segid "    " and resid 195  and name H   ))
 ASSI {  171}
   (( segid "    " and resid 195  and name HG2 ))
   (( segid "    " and resid 195  and name H   ))
      3.800     1.800     1.800 peak   171 spectrum    1 weight  0.10000E+01 volume  0.15571E-02 ppm1      0.784 ppm2      8.791 CV     1
 OR {  171}
   (( segid "    " and resid 195  and name HG3 ))
   (( segid "    " and resid 195  and name H   ))
 ASSI {  172}
   (  segid "    " and resid 191  and name HD1%)
   (( segid "    " and resid 192  and name H   ))
      2.400     2.400     3.600 peak   172 spectrum    1 weight  0.10000E+01 volume  0.12627E-02 ppm1      0.777 ppm2      9.084 CV     1
 ASSI {  173}
   (( segid "    " and resid 195  and name HA  ))
   (( segid "    " and resid 196  and name H   ))
      2.700     0.900     0.900 peak   173 spectrum    1 weight  0.10000E+01 volume  0.12423E-02 ppm1      3.580 ppm2      8.349 CV     1
 ASSI {  174}
   (( segid "    " and resid 195  and name HD2 ))
   (( segid "    " and resid 196  and name H   ))
      5.000     3.100     1.000 peak   174 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      2.695 ppm2      8.348 CV     1
 OR {  174}
   (( segid "    " and resid 195  and name HD3 ))
   (( segid "    " and resid 196  and name H   ))
 ASSI {  175}
   (  segid "    " and resid 191  and name HD1%)
   (( segid "    " and resid 191  and name H   ))
      3.300     1.400     1.400 peak   175 spectrum    1 weight  0.10000E+01 volume  0.21428E-02 ppm1      0.777 ppm2      8.432 CV     1
 ASSI {  178}
   (( segid "    " and resid 195  and name HD3 ))
   (  segid "    " and resid 198  and name HE% )
      3.200     1.300     1.300 peak   178 spectrum    1 weight  0.10000E+01 volume  0.17264E-02 ppm1      2.705 ppm2      7.106 CV     1
 OR {  178}
   (( segid "    " and resid 195  and name HD2 ))
   (  segid "    " and resid 198  and name HE% )
 ASSI {  179}
   (( segid "    " and resid 195  and name HD3 ))
   (  segid "    " and resid 198  and name HD% )
      3.700     1.700     1.700 peak   179 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      2.704 ppm2      6.964 CV     1
 OR {  179}
   (( segid "    " and resid 195  and name HD2 ))
   (  segid "    " and resid 198  and name HD% )
 ASSI {  181}
   (( segid "    " and resid 121  and name HG12))
   (  segid "    " and resid 127  and name HE% )
      4.600     2.700     1.400 peak   181 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      0.809 ppm2      6.641 CV     1
 OR {  181}
   (( segid "    " and resid 121  and name HG13))
   (  segid "    " and resid 127  and name HE% )
 ASSI {  183}
   (( segid "    " and resid 195  and name HA  ))
   (( segid "    " and resid 127  and name HA  ))
      2.700     0.900     0.900 peak   183 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      3.580 ppm2      4.747 CV     1
 ASSI {  184}
   (  segid "    " and resid 191  and name HD1%)
   (( segid "    " and resid 191  and name HA  ))
      3.000     1.100     1.100 peak   184 spectrum    1 weight  0.10000E+01 volume  0.21732E-02 ppm1      0.778 ppm2      4.893 CV     1
 ASSI {  185}
   (( segid "    " and resid 121  and name HG12))
   (( segid "    " and resid 121  and name HA  ))
      3.000     1.100     1.100 peak   185 spectrum    1 weight  0.10000E+01 volume  0.17806E-02 ppm1      0.819 ppm2      4.100 CV     1
 OR {  185}
   (( segid "    " and resid 121  and name HG13))
   (( segid "    " and resid 121  and name HA  ))
 ASSI {  186}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 73   and name HA  ))
      3.600     1.600     1.600 peak   186 spectrum    1 weight  0.10000E+01 volume  0.20412E-02 ppm1      0.822 ppm2      4.212 CV     1
 ASSI {  187}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 68   and name HA  ))
      3.300     1.300     1.300 peak   187 spectrum    1 weight  0.10000E+01 volume  0.16553E-02 ppm1      0.820 ppm2      3.916 CV     1
 ASSI {  188}
   (( segid "    " and resid 195  and name HB2 ))
   (( segid "    " and resid 195  and name HA  ))
      3.000     1.100     1.100 peak   188 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      1.184 ppm2      3.579 CV     1
 ASSI {  189}
   (( segid "    " and resid 195  and name HD2 ))
   (( segid "    " and resid 195  and name HA  ))
      4.500     2.500     1.500 peak   189 spectrum    1 weight  0.10000E+01 volume  0.74811E-03 ppm1      2.687 ppm2      3.595 CV     1
 OR {  189}
   (( segid "    " and resid 195  and name HD3 ))
   (( segid "    " and resid 195  and name HA  ))
 ASSI {  190}
   (( segid "    " and resid 195  and name HG3 ))
   (( segid "    " and resid 195  and name HA  ))
      3.200     1.200     1.200 peak   190 spectrum    1 weight  0.10000E+01 volume  0.12694E-02 ppm1      0.790 ppm2      3.582 CV     1
 OR {  190}
   (( segid "    " and resid 195  and name HG2 ))
   (( segid "    " and resid 195  and name HA  ))
 ASSI {  191}
   (( segid "    " and resid 195  and name HA  ))
   (( segid "    " and resid 127  and name HB2 ))
      4.700     2.800     1.300 peak   191 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      3.579 ppm2      2.801 CV     1
 OR {  191}
   (( segid "    " and resid 195  and name HA  ))
   (( segid "    " and resid 127  and name HB3 ))
 ASSI {  196}
   (  segid "    " and resid 191  and name HD1%)
   (( segid "    " and resid 189  and name HG3 ))
      2.300     2.300     3.700 peak   196 spectrum    1 weight  0.10000E+01 volume  0.15876E-02 ppm1      0.779 ppm2      1.953 CV     1
 ASSI {  197}
   (  segid "    " and resid 191  and name HD1%)
   (( segid "    " and resid 189  and name HB2 ))
      2.900     2.900     3.100 peak   197 spectrum    1 weight  0.10000E+01 volume  0.16012E-02 ppm1      0.779 ppm2      1.839 CV     1
 ASSI {  198}
   (  segid "    " and resid 191  and name HD1%)
   (( segid "    " and resid 191  and name HG  ))
      2.200     0.600     0.600 peak   198 spectrum    1 weight  0.10000E+01 volume  0.99386E-02 ppm1      0.778 ppm2      1.632 CV     1
 OR {  198}
   (  segid "    " and resid 191  and name HD1%)
   (( segid "    " and resid 191  and name HB2 ))
 ASSI {  199}
   (( segid "    " and resid 195  and name HD3 ))
   (( segid "    " and resid 195  and name HB3 ))
      3.000     1.100     1.100 peak   199 spectrum    1 weight  0.10000E+01 volume  0.22680E-02 ppm1      2.695 ppm2      1.498 CV     1
 OR {  199}
   (( segid "    " and resid 195  and name HD2 ))
   (( segid "    " and resid 195  and name HB3 ))
 ASSI {  200}
   (( segid "    " and resid 195  and name HB2 ))
   (( segid "    " and resid 195  and name HB3 ))
      2.100     0.600     0.600 peak   200 spectrum    1 weight  0.10000E+01 volume  0.26404E-02 ppm1      1.192 ppm2      1.502 CV     1
 ASSI {  201}
   (( segid "    " and resid 195  and name HD2 ))
   (( segid "    " and resid 195  and name HB2 ))
      2.900     1.100     1.100 peak   201 spectrum    1 weight  0.10000E+01 volume  0.23120E-02 ppm1      2.696 ppm2      1.189 CV     1
 OR {  201}
   (( segid "    " and resid 195  and name HD3 ))
   (( segid "    " and resid 195  and name HB2 ))
 ASSI {  202}
   (( segid "    " and resid 195  and name HD3 ))
   (( segid "    " and resid 195  and name HG2 ))
      2.600     0.800     0.800 peak   202 spectrum    1 weight  0.10000E+01 volume  0.42450E-02 ppm1      2.698 ppm2      0.795 CV     1
 OR {  202}
   (( segid "    " and resid 195  and name HD2 ))
   (( segid "    " and resid 195  and name HG3 ))
 OR {  202}
   (( segid "    " and resid 195  and name HD2 ))
   (( segid "    " and resid 195  and name HG2 ))
 OR {  202}
   (( segid "    " and resid 195  and name HD3 ))
   (( segid "    " and resid 195  and name HG3 ))
 ASSI {  205}
   (( segid "    " and resid 195  and name HB2 ))
   (  segid "    " and resid 93   and name HD1%)
      3.400     1.500     1.500 peak   205 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      1.184 ppm2      0.948 CV     1
 ASSI {  206}
   (( segid "    " and resid 195  and name HB2 ))
   (( segid "    " and resid 195  and name HG3 ))
      3.100     1.200     1.200 peak   206 spectrum    1 weight  0.10000E+01 volume  0.15436E-02 ppm1      1.192 ppm2      0.797 CV     1
 OR {  206}
   (( segid "    " and resid 195  and name HB2 ))
   (( segid "    " and resid 195  and name HG2 ))
 ASSI {  207}
   (( segid "    " and resid 195  and name HB3 ))
   (( segid "    " and resid 195  and name HG2 ))
      3.000     1.100     1.100 peak   207 spectrum    1 weight  0.10000E+01 volume  0.17332E-02 ppm1      1.509 ppm2      0.795 CV     1
 OR {  207}
   (( segid "    " and resid 195  and name HB3 ))
   (( segid "    " and resid 195  and name HG3 ))
 ASSI {  211}
   (( segid "    " and resid 195  and name HA  ))
   (( segid "    " and resid 195  and name HB3 ))
      3.300     1.300     1.300 peak   211 spectrum    1 weight  0.10000E+01 volume  0.12153E-02 ppm1      3.578 ppm2      1.516 CV     1
 ASSI {  212}
   (  segid "    " and resid 73   and name HD2%)
   (  segid "    " and resid 62   and name HD1%)
      2.900     1.000     1.000 peak   212 spectrum    1 weight  0.10000E+01 volume  0.29009E-02 ppm1      0.822 ppm2      0.396 CV     1
 ASSI {  213}
   (  segid "    " and resid 73   and name HD2%)
   (  segid "    " and resid 62   and name HD2%)
      3.000     1.100     1.100 peak   213 spectrum    1 weight  0.10000E+01 volume  0.20751E-02 ppm1      0.823 ppm2     -0.162 CV     1
 ASSI {  214}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 195  and name H   ))
      3.100     1.200     1.200 peak   214 spectrum    1 weight  0.10000E+01 volume  0.11949E-02 ppm1      1.707 ppm2      8.789 CV     1
 ASSI {  216}
   (( segid "    " and resid 194  and name HB2 ))
   (( segid "    " and resid 195  and name H   ))
      4.100     2.100     1.900 peak   216 spectrum    1 weight  0.10000E+01 volume  0.10934E-02 ppm1      1.513 ppm2      8.792 CV     1
 ASSI {  217}
   (( segid "    " and resid 194  and name HD2 ))
   (( segid "    " and resid 195  and name H   ))
      4.100     2.100     1.900 peak   217 spectrum    1 weight  0.10000E+01 volume  0.14319E-02 ppm1      3.011 ppm2      8.794 CV     1
 ASSI {  218}
   (( segid "    " and resid 194  and name HD2 ))
   (( segid "    " and resid 194  and name H   ))
      4.500     2.500     1.500 peak   218 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      2.985 ppm2      8.646 CV     1
 OR {  218}
   (( segid "    " and resid 194  and name HD3 ))
   (( segid "    " and resid 194  and name H   ))
 ASSI {  219}
   (( segid "    " and resid 4    and name HG  ))
   (( segid "    " and resid 4    and name H   ))
      3.200     1.300     1.300 peak   219 spectrum    1 weight  0.10000E+01 volume  0.18990E-02 ppm1      1.483 ppm2      8.732 CV     1
 ASSI {  220}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 82   and name HE  ))
      4.400     2.400     1.600 peak   220 spectrum    1 weight  0.10000E+01 volume  0.74811E-03 ppm1      1.707 ppm2      6.627 CV     1
 ASSI {  222}
   (( segid "    " and resid 194  and name HB2 ))
   (( segid "    " and resid 194  and name HA  ))
      3.500     1.500     1.500 peak   222 spectrum    1 weight  0.10000E+01 volume  0.11340E-02 ppm1      1.506 ppm2      4.735 CV     1
 ASSI {  223}
   (( segid "    " and resid 192  and name HG  ))
   (( segid "    " and resid 192  and name HA  ))
      3.400     1.500     1.500 peak   223 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1      1.366 ppm2      4.714 CV     1
 ASSI {  226}
   (( segid "    " and resid 194  and name HB2 ))
   (( segid "    " and resid 194  and name HD2 ))
      4.500     2.500     1.500 peak   226 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      1.521 ppm2      2.989 CV     1
 OR {  226}
   (( segid "    " and resid 194  and name HB2 ))
   (( segid "    " and resid 194  and name HD3 ))
 ASSI {  227}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 194  and name HD2 ))
      3.400     1.500     1.500 peak   227 spectrum    1 weight  0.10000E+01 volume  0.14454E-02 ppm1      1.717 ppm2      2.993 CV     1
 OR {  227}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 194  and name HD3 ))
 ASSI {  228}
   (( segid "    " and resid 194  and name HG2 ))
   (( segid "    " and resid 194  and name HD2 ))
      2.400     0.700     0.700 peak   228 spectrum    1 weight  0.10000E+01 volume  0.44887E-02 ppm1      1.437 ppm2      2.990 CV     1
 OR {  228}
   (( segid "    " and resid 194  and name HG3 ))
   (( segid "    " and resid 194  and name HD3 ))
 OR {  228}
   (( segid "    " and resid 194  and name HG2 ))
   (( segid "    " and resid 194  and name HD3 ))
 OR {  228}
   (( segid "    " and resid 194  and name HG3 ))
   (( segid "    " and resid 194  and name HD2 ))
 ASSI {  231}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 80   and name HB3 ))
      3.700     1.700     1.700 peak   231 spectrum    1 weight  0.10000E+01 volume  0.87335E-03 ppm1      1.715 ppm2      1.969 CV     1
 ASSI {  232}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HD2 ))
      3.400     1.400     1.400 peak   232 spectrum    1 weight  0.10000E+01 volume  0.90382E-03 ppm1      1.472 ppm2      2.426 CV     1
 ASSI {  233}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HD3 ))
      4.200     2.200     1.800 peak   233 spectrum    1 weight  0.10000E+01 volume  0.73796E-03 ppm1      1.465 ppm2      2.138 CV     1
 ASSI {  234}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 80   and name HB3 ))
      4.800     2.900     1.200 peak   234 spectrum    1 weight  0.10000E+01 volume  0.58223E-03 ppm1      1.475 ppm2      1.972 CV     1
 ASSI {  235}
   (( segid "    " and resid 194  and name HA  ))
   (( segid "    " and resid 194  and name HB3 ))
      2.300     0.700     0.700 peak   235 spectrum    1 weight  0.10000E+01 volume  0.37982E-02 ppm1      4.748 ppm2      1.722 CV     1
 ASSI {  237}
   (( segid "    " and resid 194  and name HB2 ))
   (( segid "    " and resid 194  and name HB3 ))
      1.900     0.500     0.500 peak   237 spectrum    1 weight  0.10000E+01 volume  0.36186E-02 ppm1      1.504 ppm2      1.709 CV     1
 ASSI {  238}
   (( segid "    " and resid 194  and name HD2 ))
   (( segid "    " and resid 194  and name HG2 ))
      2.300     0.700     0.700 peak   238 spectrum    1 weight  0.10000E+01 volume  0.65771E-02 ppm1      3.010 ppm2      1.434 CV     1
 OR {  238}
   (( segid "    " and resid 194  and name HD2 ))
   (( segid "    " and resid 194  and name HG3 ))
 ASSI {  239}
   (( segid "    " and resid 194  and name HD3 ))
   (( segid "    " and resid 194  and name HG3 ))
      2.200     0.600     0.600 peak   239 spectrum    1 weight  0.10000E+01 volume  0.63877E-02 ppm1      2.977 ppm2      1.433 CV     1
 OR {  239}
   (( segid "    " and resid 194  and name HD3 ))
   (( segid "    " and resid 194  and name HG2 ))
 ASSI {  240}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 34   and name HG2 ))
      3.700     1.700     1.700 peak   240 spectrum    1 weight  0.10000E+01 volume  0.10460E-02 ppm1      3.009 ppm2      2.141 CV     1
 ASSI {  241}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 34   and name HB3 ))
      2.800     1.000     1.000 peak   241 spectrum    1 weight  0.10000E+01 volume  0.12660E-02 ppm1      3.009 ppm2      2.038 CV     1
 ASSI {  242}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 34   and name HB2 ))
      4.100     2.100     1.900 peak   242 spectrum    1 weight  0.10000E+01 volume  0.15876E-02 ppm1      3.009 ppm2      1.959 CV     1
 ASSI {  243}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HB2 ))
      3.300     1.400     1.400 peak   243 spectrum    1 weight  0.10000E+01 volume  0.31550E-02 ppm1      3.010 ppm2      1.881 CV     1
 ASSI {  244}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HG2 ))
      1.900     1.900     4.100 peak   244 spectrum    1 weight  0.10000E+01 volume  0.14939E-01 ppm1      3.009 ppm2      1.665 CV     1
 ASSI {  245}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 80   and name HB3 ))
      2.600     0.900     0.900 peak   245 spectrum    1 weight  0.10000E+01 volume  0.19870E-02 ppm1      1.460 ppm2      1.977 CV     1
 OR {  245}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 80   and name HG2 ))
 ASSI {  247}
   (( segid "    " and resid 4    and name HG  ))
   (( segid "    " and resid 21   and name HB3 ))
      3.600     1.600     1.600 peak   247 spectrum    1 weight  0.10000E+01 volume  0.95799E-03 ppm1      1.491 ppm2      2.354 CV     1
 ASSI {  248}
   (( segid "    " and resid 194  and name HB2 ))
   (  segid "    " and resid 193  and name HD2%)
      2.500     2.500     3.500 peak   248 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      1.522 ppm2      0.704 CV     1
 ASSI {  250}
   (( segid "    " and resid 194  and name HB3 ))
   (  segid "    " and resid 130  and name HG1%)
      4.600     2.600     1.400 peak   250 spectrum    1 weight  0.10000E+01 volume  0.12525E-02 ppm1      1.718 ppm2      0.221 CV     1
 ASSI {  251}
   (( segid "    " and resid 194  and name HB2 ))
   (  segid "    " and resid 130  and name HG1%)
      4.100     2.100     1.900 peak   251 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      1.506 ppm2      0.223 CV     1
 ASSI {  252}
   (( segid "    " and resid 194  and name HD2 ))
   (  segid "    " and resid 130  and name HG1%)
      3.800     1.800     1.800 peak   252 spectrum    1 weight  0.10000E+01 volume  0.27081E-02 ppm1      3.014 ppm2      0.227 CV     1
 ASSI {  255}
   (( segid "    " and resid 194  and name HD3 ))
   (  segid "    " and resid 130  and name HG2%)
      2.400     2.400     3.600 peak   255 spectrum    1 weight  0.10000E+01 volume  0.14421E-02 ppm1      2.982 ppm2      0.477 CV     1
 ASSI {  256}
   (( segid "    " and resid 194  and name HG2 ))
   (  segid "    " and resid 130  and name HG1%)
      2.600     0.800     0.800 peak   256 spectrum    1 weight  0.10000E+01 volume  0.28875E-02 ppm1      1.434 ppm2      0.225 CV     1
 OR {  256}
   (( segid "    " and resid 194  and name HG3 ))
   (  segid "    " and resid 130  and name HG1%)
 ASSI {  257}
   (( segid "    " and resid 194  and name HG3 ))
   (  segid "    " and resid 130  and name HG2%)
      3.400     1.400     1.400 peak   257 spectrum    1 weight  0.10000E+01 volume  0.18043E-02 ppm1      1.439 ppm2      0.482 CV     1
 ASSI {  258}
   (( segid "    " and resid 171  and name HG  ))
   (( segid "    " and resid 171  and name HB3 ))
      2.800     1.000     1.000 peak   258 spectrum    1 weight  0.10000E+01 volume  0.40486E-02 ppm1      1.434 ppm2      0.851 CV     1
 ASSI {  259}
   (( segid "    " and resid 192  and name HG  ))
   (  segid "    " and resid 130  and name HG1%)
      3.500     1.500     1.500 peak   259 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      1.370 ppm2      0.230 CV     1
 ASSI {  261}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 91   and name H   ))
      3.100     1.200     1.200 peak   261 spectrum    1 weight  0.10000E+01 volume  0.30568E-02 ppm1      0.925 ppm2      9.212 CV     1
 ASSI {  262}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 90   and name H   ))
      4.100     2.100     1.900 peak   262 spectrum    1 weight  0.10000E+01 volume  0.11577E-02 ppm1      0.924 ppm2      8.809 CV     1
 ASSI {  263}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 191  and name H   ))
      2.600     0.800     0.800 peak   263 spectrum    1 weight  0.10000E+01 volume  0.51622E-02 ppm1      0.925 ppm2      8.436 CV     1
 ASSI {  264}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 190  and name H   ))
      3.800     1.800     1.800 peak   264 spectrum    1 weight  0.10000E+01 volume  0.26505E-02 ppm1      0.926 ppm2      8.621 CV     1
 ASSI {  266}
   (( segid "    " and resid 190  and name HA  ))
   (( segid "    " and resid 191  and name H   ))
      2.600     0.800     0.800 peak   266 spectrum    1 weight  0.10000E+01 volume  0.28570E-02 ppm1      4.559 ppm2      8.442 CV     1
 ASSI {  267}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 90   and name HA  ))
      3.200     1.300     1.300 peak   267 spectrum    1 weight  0.10000E+01 volume  0.23899E-02 ppm1      0.929 ppm2      5.054 CV     1
 ASSI {  268}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 190  and name HA  ))
      2.500     0.800     0.800 peak   268 spectrum    1 weight  0.10000E+01 volume  0.58055E-02 ppm1      0.927 ppm2      4.559 CV     1
 ASSI {  269}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 190  and name HB  ))
      2.400     0.700     0.700 peak   269 spectrum    1 weight  0.10000E+01 volume  0.66991E-02 ppm1      0.927 ppm2      3.892 CV     1
 ASSI {  270}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 91   and name HD3 ))
      4.500     2.500     1.500 peak   270 spectrum    1 weight  0.10000E+01 volume  0.11171E-02 ppm1      0.925 ppm2      3.165 CV     1
 ASSI {  272}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 89   and name HG2 ))
      3.200     1.300     1.300 peak   272 spectrum    1 weight  0.10000E+01 volume  0.35747E-02 ppm1      0.907 ppm2      1.307 CV     1
 ASSI {  273}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 89   and name HB3 ))
      2.900     1.000     1.000 peak   273 spectrum    1 weight  0.10000E+01 volume  0.39910E-02 ppm1      0.926 ppm2      1.820 CV     1
 OR {  273}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 89   and name HB2 ))
 ASSI {  274}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 91   and name HB2 ))
      2.400     0.700     0.700 peak   274 spectrum    1 weight  0.10000E+01 volume  0.76062E-02 ppm1      0.926 ppm2      1.365 CV     1
 ASSI {  277}
   (( segid "    " and resid 188  and name HB2 ))
   (( segid "    " and resid 188  and name H   ))
      4.500     2.500     1.500 peak   277 spectrum    1 weight  0.10000E+01 volume  0.50777E-03 ppm1      3.226 ppm2      7.589 CV     1
 ASSI {  278}
   (( segid "    " and resid 188  and name HA  ))
   (( segid "    " and resid 188  and name H   ))
      3.300     1.400     1.400 peak   278 spectrum    1 weight  0.10000E+01 volume  0.10798E-02 ppm1      4.521 ppm2      7.587 CV     1
 ASSI {  279}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 17   and name H   ))
      3.400     1.500     1.500 peak   279 spectrum    1 weight  0.10000E+01 volume  0.13608E-02 ppm1      4.510 ppm2      9.141 CV     1
 ASSI {  284}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 16   and name HA  ))
      2.800     1.000     1.000 peak   284 spectrum    1 weight  0.10000E+01 volume  0.20852E-02 ppm1      4.500 ppm2      4.952 CV     1
 ASSI {  286}
   (( segid "    " and resid 188  and name HA  ))
   (( segid "    " and resid 188  and name HB2 ))
      2.700     0.900     0.900 peak   286 spectrum    1 weight  0.10000E+01 volume  0.55008E-02 ppm1      4.517 ppm2      3.233 CV     1
 ASSI {  287}
   (( segid "    " and resid 188  and name HA  ))
   (( segid "    " and resid 188  and name HB3 ))
      2.600     0.800     0.800 peak   287 spectrum    1 weight  0.10000E+01 volume  0.57682E-02 ppm1      4.518 ppm2      2.966 CV     1
 ASSI {  288}
   (( segid "    " and resid 188  and name HA  ))
   (( segid "    " and resid 89   and name HE2 ))
      3.300     1.400     1.400 peak   288 spectrum    1 weight  0.10000E+01 volume  0.14827E-02 ppm1      4.517 ppm2      2.793 CV     1
 OR {  288}
   (( segid "    " and resid 188  and name HA  ))
   (( segid "    " and resid 89   and name HE3 ))
 ASSI {  289}
   (( segid "    " and resid 188  and name HB2 ))
   (( segid "    " and resid 188  and name HB3 ))
      2.100     0.500     0.500 peak   289 spectrum    1 weight  0.10000E+01 volume  0.55313E-02 ppm1      3.238 ppm2      2.971 CV     1
 ASSI {  290}
   (( segid "    " and resid 188  and name HA  ))
   (( segid "    " and resid 187  and name HB3 ))
      3.400     1.500     1.500 peak   290 spectrum    1 weight  0.10000E+01 volume  0.13879E-02 ppm1      4.513 ppm2      1.911 CV     1
 OR {  290}
   (( segid "    " and resid 188  and name HA  ))
   (( segid "    " and resid 187  and name HB2 ))
 ASSI {  291}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      3.300     1.400     1.400 peak   291 spectrum    1 weight  0.10000E+01 volume  0.13676E-02 ppm1      4.506 ppm2      1.817 CV     1
 ASSI {  293}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB3 ))
      2.900     1.100     1.100 peak   293 spectrum    1 weight  0.10000E+01 volume  0.13033E-02 ppm1      4.510 ppm2      1.326 CV     1
 ASSI {  295}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 51   and name HB2 ))
      3.200     1.300     1.300 peak   295 spectrum    1 weight  0.10000E+01 volume  0.14454E-02 ppm1      2.139 ppm2      0.991 CV     1
 OR {  295}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 51   and name HB2 ))
 ASSI {  296}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 66   and name HG3 ))
      3.500     1.500     1.500 peak   296 spectrum    1 weight  0.10000E+01 volume  0.21969E-02 ppm1      2.401 ppm2      0.995 CV     1
 ASSI {  297}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 66   and name HD3 ))
      3.200     1.300     1.300 peak   297 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      2.397 ppm2      0.846 CV     1
 ASSI {  298}
   (( segid "    " and resid 186  and name HG2 ))
   (  segid "    " and resid 185  and name HG2%)
      2.400     2.400     3.600 peak   298 spectrum    1 weight  0.10000E+01 volume  0.12390E-02 ppm1      2.187 ppm2      0.743 CV     1
 OR {  298}
   (( segid "    " and resid 186  and name HG2 ))
   (  segid "    " and resid 185  and name HG1%)
 ASSI {  299}
   (( segid "    " and resid 186  and name HG3 ))
   (( segid "    " and resid 186  and name HB3 ))
      2.500     0.800     0.800 peak   299 spectrum    1 weight  0.10000E+01 volume  0.40926E-02 ppm1      2.389 ppm2      1.664 CV     1
 ASSI {  300}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 66   and name HB3 ))
      2.900     1.000     1.000 peak   300 spectrum    1 weight  0.10000E+01 volume  0.20581E-02 ppm1      2.399 ppm2      1.530 CV     1
 ASSI {  304}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 63   and name HG3 ))
      1.400     0.200     0.800 peak   304 spectrum    1 weight  0.10000E+01 volume  0.31570E-01 ppm1      2.401 ppm2      2.284 CV     1
 ASSI {  305}
   (( segid "    " and resid 186  and name HG3 ))
   (( segid "    " and resid 186  and name HG2 ))
      1.700     0.400     0.500 peak   305 spectrum    1 weight  0.10000E+01 volume  0.20520E-01 ppm1      2.390 ppm2      2.172 CV     1
 OR {  305}
   (( segid "    " and resid 186  and name HG3 ))
   (( segid "    " and resid 186  and name HB2 ))
 ASSI {  307}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 63   and name HB2 ))
      2.700     0.900     0.900 peak   307 spectrum    1 weight  0.10000E+01 volume  0.69056E-02 ppm1      2.400 ppm2      1.919 CV     1
 ASSI {  308}
   (( segid "    " and resid 187  and name HG3 ))
   (( segid "    " and resid 187  and name HG2 ))
      1.500     0.300     0.700 peak   308 spectrum    1 weight  0.10000E+01 volume  0.18181E-01 ppm1      2.208 ppm2      2.055 CV     1
 ASSI {  310}
   (( segid "    " and resid 186  and name HG2 ))
   (( segid "    " and resid 186  and name HB3 ))
      3.000     1.100     1.100 peak   310 spectrum    1 weight  0.10000E+01 volume  0.42042E-02 ppm1      2.173 ppm2      1.667 CV     1
 ASSI {  313}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 21   and name HB3 ))
      2.000     0.500     0.500 peak   313 spectrum    1 weight  0.10000E+01 volume  0.52333E-02 ppm1      2.095 ppm2      2.343 CV     1
 ASSI {  314}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HB3 ))
      2.500     0.800     0.800 peak   314 spectrum    1 weight  0.10000E+01 volume  0.44345E-02 ppm1      2.147 ppm2      1.819 CV     1
 OR {  314}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 79   and name HB3 ))
 ASSI {  316}
   (( segid "    " and resid 186  and name HB3 ))
   (( segid "    " and resid 186  and name HB2 ))
      2.200     0.600     0.600 peak   316 spectrum    1 weight  0.10000E+01 volume  0.26642E-02 ppm1      1.666 ppm2      2.168 CV     1
 OR {  316}
   (( segid "    " and resid 186  and name HB3 ))
   (( segid "    " and resid 186  and name HG2 ))
 ASSI {  317}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 34   and name HB3 ))
      3.800     1.800     1.800 peak   317 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      4.324 ppm2      2.048 CV     1
 ASSI {  318}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
      2.800     1.000     1.000 peak   318 spectrum    1 weight  0.10000E+01 volume  0.40011E-02 ppm1      4.326 ppm2      1.885 CV     1
 ASSI {  320}
   (( segid "    " and resid 186  and name HA  ))
   (( segid "    " and resid 186  and name HB2 ))
      3.000     1.100     1.100 peak   320 spectrum    1 weight  0.10000E+01 volume  0.39437E-02 ppm1      4.320 ppm2      2.170 CV     1
 ASSI {  324}
   (( segid "    " and resid 187  and name HG3 ))
   (( segid "    " and resid 187  and name HA  ))
      2.400     0.700     0.700 peak   324 spectrum    1 weight  0.10000E+01 volume  0.41569E-02 ppm1      2.206 ppm2      3.831 CV     1
 ASSI {  325}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 62   and name HA  ))
      3.800     1.800     1.800 peak   325 spectrum    1 weight  0.10000E+01 volume  0.24880E-02 ppm1      2.395 ppm2      3.870 CV     1
 ASSI {  326}
   (( segid "    " and resid 186  and name HG3 ))
   (( segid "    " and resid 186  and name HA  ))
      3.400     1.400     1.400 peak   326 spectrum    1 weight  0.10000E+01 volume  0.37034E-02 ppm1      2.390 ppm2      4.320 CV     1
 ASSI {  327}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 63   and name HA  ))
      3.300     1.300     1.300 peak   327 spectrum    1 weight  0.10000E+01 volume  0.43533E-02 ppm1      2.400 ppm2      4.214 CV     1
 ASSI {  328}
   (( segid "    " and resid 186  and name HG2 ))
   (( segid "    " and resid 186  and name HA  ))
      3.000     1.100     1.100 peak   328 spectrum    1 weight  0.10000E+01 volume  0.38150E-02 ppm1      2.178 ppm2      4.317 CV     1
 ASSI {  330}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 79   and name HA  ))
      2.600     0.800     0.800 peak   330 spectrum    1 weight  0.10000E+01 volume  0.30025E-02 ppm1      2.148 ppm2      4.896 CV     1
 OR {  330}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HA  ))
 ASSI {  332}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name H   ))
      3.300     1.400     1.400 peak   332 spectrum    1 weight  0.10000E+01 volume  0.17941E-02 ppm1      4.331 ppm2      7.973 CV     1
 ASSI {  333}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 63   and name H   ))
      2.100     0.600     0.600 peak   333 spectrum    1 weight  0.10000E+01 volume  0.39910E-02 ppm1      2.401 ppm2      8.481 CV     1
 ASSI {  334}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 65   and name H   ))
      4.400     2.500     1.600 peak   334 spectrum    1 weight  0.10000E+01 volume  0.14014E-02 ppm1      2.398 ppm2      8.156 CV     1
 ASSI {  335}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 133  and name H   ))
      4.700     2.800     1.300 peak   335 spectrum    1 weight  0.10000E+01 volume  0.14150E-02 ppm1      2.118 ppm2      8.201 CV     1
 ASSI {  336}
   (( segid "    " and resid 186  and name HG2 ))
   (( segid "    " and resid 188  and name HE1 ))
      4.900     3.000     1.100 peak   336 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      2.180 ppm2      7.837 CV     1
 ASSI {  338}
   (( segid "    " and resid 186  and name HG2 ))
   (( segid "    " and resid 186  and name H   ))
      2.800     1.000     1.000 peak   338 spectrum    1 weight  0.10000E+01 volume  0.22409E-02 ppm1      2.174 ppm2      8.795 CV     1
 ASSI {  339}
   (( segid "    " and resid 186  and name HG3 ))
   (( segid "    " and resid 186  and name H   ))
      3.600     1.600     1.600 peak   339 spectrum    1 weight  0.10000E+01 volume  0.32700E-02 ppm1      2.388 ppm2      8.796 CV     1
 ASSI {  340}
   (( segid "    " and resid 186  and name HB2 ))
   (( segid "    " and resid 186  and name H   ))
      3.100     1.200     1.200 peak   340 spectrum    1 weight  0.10000E+01 volume  0.10020E-02 ppm1      2.146 ppm2      8.798 CV     1
 ASSI {  341}
   (( segid "    " and resid 186  and name HA  ))
   (( segid "    " and resid 186  and name H   ))
      3.200     1.300     1.300 peak   341 spectrum    1 weight  0.10000E+01 volume  0.14048E-02 ppm1      4.326 ppm2      8.795 CV     1
 ASSI {  347}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 79   and name H   ))
      3.800     1.800     1.800 peak   347 spectrum    1 weight  0.10000E+01 volume  0.19803E-02 ppm1      2.144 ppm2      9.051 CV     1
 OR {  347}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name H   ))
 ASSI {  348}
   (( segid "    " and resid 186  and name HG3 ))
   (( segid "    " and resid 187  and name H   ))
      4.500     2.600     1.500 peak   348 spectrum    1 weight  0.10000E+01 volume  0.14184E-02 ppm1      2.390 ppm2      9.148 CV     1
 ASSI {  350}
   (( segid "    " and resid 185  and name HA  ))
   (( segid "    " and resid 186  and name H   ))
      2.800     0.900     0.900 peak   350 spectrum    1 weight  0.10000E+01 volume  0.25151E-02 ppm1      3.846 ppm2      8.796 CV     1
 ASSI {  351}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 98   and name H   ))
      2.700     0.900     0.900 peak   351 spectrum    1 weight  0.10000E+01 volume  0.65976E-02 ppm1      0.692 ppm2      9.136 CV     1
 ASSI {  353}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 15   and name H   ))
      2.300     0.700     0.700 peak   353 spectrum    1 weight  0.10000E+01 volume  0.93057E-02 ppm1      0.709 ppm2      8.895 CV     1
 ASSI {  355}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 16   and name H   ))
      3.700     1.700     1.700 peak   355 spectrum    1 weight  0.10000E+01 volume  0.15639E-02 ppm1      0.707 ppm2      8.603 CV     1
 ASSI {  356}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 64   and name H   ))
      3.100     1.200     1.200 peak   356 spectrum    1 weight  0.10000E+01 volume  0.25151E-02 ppm1      0.755 ppm2      8.428 CV     1
 ASSI {  357}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 97   and name H   ))
      3.200     1.300     1.300 peak   357 spectrum    1 weight  0.10000E+01 volume  0.49728E-02 ppm1      0.690 ppm2      8.405 CV     1
 ASSI {  358}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 14   and name H   ))
      3.400     1.500     1.500 peak   358 spectrum    1 weight  0.10000E+01 volume  0.36729E-02 ppm1      0.709 ppm2      8.208 CV     1
 ASSI {  359}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 103  and name H   ))
      2.900     1.100     1.100 peak   359 spectrum    1 weight  0.10000E+01 volume  0.28164E-02 ppm1      0.742 ppm2      8.060 CV     1
 ASSI {  360}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 185  and name H   ))
      2.600     0.800     0.800 peak   360 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      0.754 ppm2      7.345 CV     1
 ASSI {  361}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 185  and name H   ))
      2.200     0.600     0.600 peak   361 spectrum    1 weight  0.10000E+01 volume  0.82528E-02 ppm1      0.696 ppm2      7.347 CV     1
 ASSI {  363}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 184  and name H   ))
      3.900     1.900     1.900 peak   363 spectrum    1 weight  0.10000E+01 volume  0.16181E-02 ppm1      0.698 ppm2      7.705 CV     1
 ASSI {  366}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 183  and name H   ))
      2.400     2.400     3.600 peak   366 spectrum    1 weight  0.10000E+01 volume  0.11916E-02 ppm1      0.756 ppm2      7.171 CV     1
 ASSI {  367}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 183  and name H   ))
      4.200     2.200     1.800 peak   367 spectrum    1 weight  0.10000E+01 volume  0.14082E-02 ppm1      0.695 ppm2      7.168 CV     1
 ASSI {  369}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 91   and name HH22))
      3.300     1.400     1.400 peak   369 spectrum    1 weight  0.10000E+01 volume  0.15538E-02 ppm1      0.696 ppm2      6.848 CV     1
 ASSI {  370}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 27   and name H   ))
      4.100     2.100     1.900 peak   370 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      0.756 ppm2      6.718 CV     1
 ASSI {  371}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 9    and name HA  ))
      2.700     0.900     0.900 peak   371 spectrum    1 weight  0.10000E+01 volume  0.37912E-02 ppm1      0.710 ppm2      5.306 CV     1
 ASSI {  372}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 14   and name HA  ))
      2.400     0.700     0.700 peak   372 spectrum    1 weight  0.10000E+01 volume  0.86658E-02 ppm1      0.709 ppm2      4.990 CV     1
 ASSI {  374}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 7    and name HA  ))
      3.100     1.200     1.200 peak   374 spectrum    1 weight  0.10000E+01 volume  0.34765E-02 ppm1      0.706 ppm2      4.495 CV     1
 ASSI {  375}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 26   and name HA  ))
      3.000     1.100     1.100 peak   375 spectrum    1 weight  0.10000E+01 volume  0.21055E-02 ppm1      0.755 ppm2      4.377 CV     1
 ASSI {  377}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 114  and name HB  ))
      2.900     1.000     1.000 peak   377 spectrum    1 weight  0.10000E+01 volume  0.22782E-02 ppm1      0.705 ppm2      4.223 CV     1
 ASSI {  378}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 102  and name HA  ))
      2.300     0.700     0.700 peak   378 spectrum    1 weight  0.10000E+01 volume  0.63029E-02 ppm1      0.742 ppm2      4.652 CV     1
 ASSI {  380}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 64   and name HA  ))
      2.600     0.800     0.800 peak   380 spectrum    1 weight  0.10000E+01 volume  0.70953E-02 ppm1      0.757 ppm2      3.910 CV     1
 ASSI {  381}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 185  and name HA  ))
      2.900     1.100     1.100 peak   381 spectrum    1 weight  0.10000E+01 volume  0.76672E-02 ppm1      0.755 ppm2      3.848 CV     1
 ASSI {  382}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 185  and name HA  ))
      2.400     0.700     0.700 peak   382 spectrum    1 weight  0.10000E+01 volume  0.75047E-02 ppm1      0.696 ppm2      3.841 CV     1
 ASSI {  383}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 9    and name HB3 ))
      3.700     1.700     1.700 peak   383 spectrum    1 weight  0.10000E+01 volume  0.27283E-02 ppm1      0.707 ppm2      3.661 CV     1
 ASSI {  384}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 9    and name HB2 ))
      3.000     1.100     1.100 peak   384 spectrum    1 weight  0.10000E+01 volume  0.31177E-02 ppm1      0.709 ppm2      3.575 CV     1
 ASSI {  385}
   (( segid "    " and resid 91   and name HB3 ))
   (( segid "    " and resid 91   and name HD3 ))
      4.600     2.700     1.400 peak   385 spectrum    1 weight  0.10000E+01 volume  0.57887E-03 ppm1      1.692 ppm2      3.164 CV     1
 ASSI {  386}
   (( segid "    " and resid 91   and name HB3 ))
   (( segid "    " and resid 91   and name HD2 ))
      3.300     1.300     1.300 peak   386 spectrum    1 weight  0.10000E+01 volume  0.58561E-03 ppm1      1.688 ppm2      2.957 CV     1
 ASSI {  387}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 25   and name HA  ))
      2.700     0.900     0.900 peak   387 spectrum    1 weight  0.10000E+01 volume  0.47154E-02 ppm1      0.759 ppm2      3.280 CV     1
 ASSI {  388}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 131  and name HD3 ))
      2.300     0.700     0.700 peak   388 spectrum    1 weight  0.10000E+01 volume  0.22308E-02 ppm1      0.696 ppm2      3.061 CV     1
 ASSI {  390}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 131  and name HD2 ))
      3.000     1.100     1.100 peak   390 spectrum    1 weight  0.10000E+01 volume  0.32227E-02 ppm1      0.696 ppm2      2.956 CV     1
 ASSI {  392}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 25   and name HB  ))
      2.300     0.700     0.700 peak   392 spectrum    1 weight  0.10000E+01 volume  0.51726E-02 ppm1      0.758 ppm2      2.751 CV     1
 ASSI {  393}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 111  and name HG2 ))
      3.100     1.200     1.200 peak   393 spectrum    1 weight  0.10000E+01 volume  0.32260E-02 ppm1      0.754 ppm2      2.613 CV     1
 ASSI {  395}
   (( segid "    " and resid 185  and name HA  ))
   (( segid "    " and resid 186  and name HG2 ))
      4.000     2.000     2.000 peak   395 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      3.840 ppm2      2.162 CV     1
 OR {  395}
   (( segid "    " and resid 185  and name HA  ))
   (( segid "    " and resid 186  and name HB2 ))
 ASSI {  396}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 111  and name HG3 ))
      2.700     0.900     0.900 peak   396 spectrum    1 weight  0.10000E+01 volume  0.25117E-02 ppm1      0.744 ppm2      2.243 CV     1
 ASSI {  397}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 183  and name HB2 ))
      3.100     1.200     1.200 peak   397 spectrum    1 weight  0.10000E+01 volume  0.20277E-02 ppm1      0.753 ppm2      2.168 CV     1
 ASSI {  398}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 183  and name HB2 ))
      2.500     0.800     0.800 peak   398 spectrum    1 weight  0.10000E+01 volume  0.33005E-02 ppm1      0.697 ppm2      2.161 CV     1
 ASSI {  399}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 183  and name HB3 ))
      2.800     1.000     1.000 peak   399 spectrum    1 weight  0.10000E+01 volume  0.32464E-02 ppm1      0.702 ppm2      2.062 CV     1
 OR {  399}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 183  and name HB3 ))
 ASSI {  400}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 102  and name HB  ))
      2.100     0.600     0.600 peak   400 spectrum    1 weight  0.10000E+01 volume  0.98337E-02 ppm1      0.745 ppm2      1.955 CV     1
 ASSI {  402}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 185  and name HB  ))
      2.100     0.600     0.600 peak   402 spectrum    1 weight  0.10000E+01 volume  0.98135E-02 ppm1      0.754 ppm2      1.683 CV     1
 ASSI {  403}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 185  and name HB  ))
      2.000     0.500     0.500 peak   403 spectrum    1 weight  0.10000E+01 volume  0.11096E-01 ppm1      0.697 ppm2      1.681 CV     1
 ASSI {  404}
   (  segid "    " and resid 25   and name HG1%)
   (  segid "    " and resid 64   and name HB% )
      2.700     0.900     0.900 peak   404 spectrum    1 weight  0.10000E+01 volume  0.79515E-02 ppm1      0.755 ppm2      1.516 CV     1
 ASSI {  405}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 7    and name HD3 ))
      2.400     0.700     0.700 peak   405 spectrum    1 weight  0.10000E+01 volume  0.15148E-01 ppm1      0.705 ppm2      1.464 CV     1
 OR {  405}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 7    and name HD2 ))
 ASSI {  406}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 7    and name HB3 ))
      2.000     0.500     0.500 peak   406 spectrum    1 weight  0.10000E+01 volume  0.12153E-01 ppm1      0.701 ppm2      1.336 CV     1
 ASSI {  407}
   (  segid "    " and resid 102  and name HG1%)
   (  segid "    " and resid 114  and name HG2%)
      2.200     0.600     0.600 peak   407 spectrum    1 weight  0.10000E+01 volume  0.80735E-02 ppm1      0.705 ppm2      1.187 CV     1
 ASSI {  409}
   (  segid "    " and resid 14   and name HG2%)
   (  segid "    " and resid 78   and name HG2%)
      1.900     1.900     4.100 peak   409 spectrum    1 weight  0.10000E+01 volume  0.49999E-02 ppm1      0.709 ppm2      1.006 CV     1
 ASSI {  410}
   (  segid "    " and resid 25   and name HG1%)
   (  segid "    " and resid 25   and name HG2%)
      2.100     0.600     0.600 peak   410 spectrum    1 weight  0.10000E+01 volume  0.13222E-01 ppm1      0.758 ppm2      0.979 CV     1
 ASSI {  411}
   (  segid "    " and resid 97   and name HG2%)
   (  segid "    " and resid 190  and name HG2%)
      2.500     0.800     0.800 peak   411 spectrum    1 weight  0.10000E+01 volume  0.79213E-02 ppm1      0.694 ppm2      0.925 CV     1
 ASSI {  413}
   (( segid "    " and resid 91   and name HB3 ))
   (  segid "    " and resid 190  and name HG2%)
      4.100     2.100     1.900 peak   413 spectrum    1 weight  0.10000E+01 volume  0.11780E-02 ppm1      1.697 ppm2      0.929 CV     1
 ASSI {  414}
   (( segid "    " and resid 185  and name HB  ))
   (  segid "    " and resid 185  and name HG1%)
      2.500     0.800     0.800 peak   414 spectrum    1 weight  0.10000E+01 volume  0.37269E-02 ppm1      1.701 ppm2      0.712 CV     1
 OR {  414}
   (( segid "    " and resid 185  and name HB  ))
   (  segid "    " and resid 185  and name HG2%)
 ASSI {  416}
   (( segid "    " and resid 185  and name HA  ))
   (  segid "    " and resid 185  and name HG1%)
      2.900     1.100     1.100 peak   416 spectrum    1 weight  0.10000E+01 volume  0.29384E-02 ppm1      3.843 ppm2      0.699 CV     1
 OR {  416}
   (( segid "    " and resid 185  and name HA  ))
   (  segid "    " and resid 185  and name HG2%)
 ASSI {  417}
   (  segid "    " and resid 25   and name HG1%)
   (  segid "    " and resid 62   and name HD1%)
      4.200     2.200     1.800 peak   417 spectrum    1 weight  0.10000E+01 volume  0.27216E-02 ppm1      0.758 ppm2      0.400 CV     1
 ASSI {  418}
   (  segid "    " and resid 25   and name HG1%)
   (  segid "    " and resid 68   and name HD2%)
      4.100     2.100     1.900 peak   418 spectrum    1 weight  0.10000E+01 volume  0.25151E-02 ppm1      0.757 ppm2      0.293 CV     1
 ASSI {  419}
   (  segid "    " and resid 25   and name HG1%)
   (  segid "    " and resid 62   and name HD2%)
      4.700     2.800     1.300 peak   419 spectrum    1 weight  0.10000E+01 volume  0.16722E-02 ppm1      0.756 ppm2     -0.161 CV     1
 ASSI {  420}
   (( segid "    " and resid 120  and name HA2 ))
   (( segid "    " and resid 119  and name HG12))
      5.100     3.300     0.900 peak   420 spectrum    1 weight  0.10000E+01 volume  0.75150E-03 ppm1      3.668 ppm2      1.205 CV     1
 ASSI {  422}
   (( segid "    " and resid 184  and name HA3 ))
   (( segid "    " and resid 57   and name HG2 ))
      4.900     3.000     1.100 peak   422 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      4.048 ppm2      1.419 CV     1
 OR {  422}
   (( segid "    " and resid 184  and name HA3 ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI {  423}
   (( segid "    " and resid 184  and name HA2 ))
   (( segid "    " and resid 57   and name HG3 ))
      4.200     2.200     1.800 peak   423 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      3.665 ppm2      1.429 CV     1
 OR {  423}
   (( segid "    " and resid 184  and name HA2 ))
   (( segid "    " and resid 57   and name HG2 ))
 ASSI {  424}
   (( segid "    " and resid 184  and name HA2 ))
   (( segid "    " and resid 57   and name HD2 ))
      3.200     1.300     1.300 peak   424 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      3.666 ppm2      1.658 CV     1
 OR {  424}
   (( segid "    " and resid 184  and name HA2 ))
   (( segid "    " and resid 57   and name HD3 ))
 ASSI {  425}
   (( segid "    " and resid 120  and name HA3 ))
   (( segid "    " and resid 119  and name HG12))
      5.100     3.200     0.900 peak   425 spectrum    1 weight  0.10000E+01 volume  0.83611E-03 ppm1      4.049 ppm2      1.209 CV     1
 ASSI {  429}
   (( segid "    " and resid 120  and name HA2 ))
   (( segid "    " and resid 119  and name HA  ))
      4.500     2.500     1.500 peak   429 spectrum    1 weight  0.10000E+01 volume  0.86319E-03 ppm1      3.671 ppm2      4.325 CV     1
 ASSI {  430}
   (( segid "    " and resid 120  and name HA3 ))
   (( segid "    " and resid 119  and name HA  ))
      4.200     2.200     1.800 peak   430 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      4.055 ppm2      4.326 CV     1
 ASSI {  432}
   (( segid "    " and resid 184  and name HA3 ))
   (( segid "    " and resid 183  and name H   ))
      5.000     3.100     1.000 peak   432 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      4.056 ppm2      7.164 CV     1
 ASSI {  441}
   (( segid "    " and resid 179  and name HA  ))
   (( segid "    " and resid 179  and name HB  ))
      3.000     1.100     1.100 peak   441 spectrum    1 weight  0.10000E+01 volume  0.14928E-02 ppm1      4.581 ppm2      4.714 CV     1
 ASSI {  442}
   (( segid "    " and resid 179  and name HA  ))
   (( segid "    " and resid 180  and name H   ))
      2.900     1.000     1.000 peak   442 spectrum    1 weight  0.10000E+01 volume  0.13540E-02 ppm1      4.586 ppm2      8.962 CV     1
 ASSI {  443}
   (( segid "    " and resid 179  and name HA  ))
   (( segid "    " and resid 179  and name H   ))
      3.500     1.500     1.500 peak   443 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      4.595 ppm2      9.375 CV     1
 ASSI {  445}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 97   and name HA  ))
      3.500     1.600     1.600 peak   445 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      1.072 ppm2      4.868 CV     1
 ASSI {  446}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HA  ))
      2.300     0.700     0.700 peak   446 spectrum    1 weight  0.10000E+01 volume  0.12860E-01 ppm1      1.072 ppm2      4.172 CV     1
 ASSI {  447}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HB  ))
      2.100     0.500     0.500 peak   447 spectrum    1 weight  0.10000E+01 volume  0.18039E-01 ppm1      1.073 ppm2      4.069 CV     1
 ASSI {  448}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 97   and name H   ))
      2.500     0.800     0.800 peak   448 spectrum    1 weight  0.10000E+01 volume  0.78163E-02 ppm1      1.073 ppm2      8.397 CV     1
 ASSI {  449}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name H   ))
      3.300     1.400     1.400 peak   449 spectrum    1 weight  0.10000E+01 volume  0.65231E-02 ppm1      1.073 ppm2      8.052 CV     1
 ASSI {  450}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 92   and name HB2 ))
      4.200     2.200     1.800 peak   450 spectrum    1 weight  0.10000E+01 volume  0.10663E-02 ppm1      1.073 ppm2      2.453 CV     1
 ASSI {  452}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 97   and name HB  ))
      4.100     2.100     1.900 peak   452 spectrum    1 weight  0.10000E+01 volume  0.20615E-02 ppm1      1.072 ppm2      1.807 CV     1
 ASSI {  454}
   (( segid "    " and resid 179  and name HA  ))
   (  segid "    " and resid 108  and name HG2%)
      3.600     1.600     1.600 peak   454 spectrum    1 weight  0.10000E+01 volume  0.11171E-02 ppm1      4.578 ppm2      0.929 CV     1
 ASSI {  456}
   (( segid "    " and resid 177  and name HA2 ))
   (  segid "    " and resid 107  and name HG2%)
      3.500     1.600     1.600 peak   456 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      3.709 ppm2      1.203 CV     1
 ASSI {  457}
   (( segid "    " and resid 65   and name HA3 ))
   (  segid "    " and resid 64   and name HB% )
      4.300     2.400     1.700 peak   457 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      4.359 ppm2      1.528 CV     1
 ASSI {  458}
   (( segid "    " and resid 65   and name HA3 ))
   (  segid "    " and resid 24   and name HE% )
      4.200     2.200     1.800 peak   458 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      4.351 ppm2      2.024 CV     1
 ASSI {  459}
   (( segid "    " and resid 177  and name HA3 ))
   (( segid "    " and resid 177  and name HA2 ))
      2.300     0.600     0.600 peak   459 spectrum    1 weight  0.10000E+01 volume  0.44955E-02 ppm1      4.377 ppm2      3.703 CV     1
 ASSI {  460}
   (( segid "    " and resid 65   and name HA3 ))
   (( segid "    " and resid 65   and name HA2 ))
      2.200     0.600     0.600 peak   460 spectrum    1 weight  0.10000E+01 volume  0.45970E-02 ppm1      4.347 ppm2      3.571 CV     1
 ASSI {  461}
   (( segid "    " and resid 95   and name HA2 ))
   (( segid "    " and resid 95   and name HA3 ))
      2.200     0.600     0.600 peak   461 spectrum    1 weight  0.10000E+01 volume  0.46477E-02 ppm1      4.330 ppm2      3.503 CV     1
 ASSI {  462}
   (( segid "    " and resid 177  and name HA3 ))
   (  segid "    " and resid 107  and name HG2%)
      4.700     2.700     1.300 peak   462 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      4.373 ppm2      1.200 CV     1
 ASSI {  464}
   (( segid "    " and resid 65   and name HA3 ))
   (( segid "    " and resid 66   and name H   ))
      4.000     2.000     2.000 peak   464 spectrum    1 weight  0.10000E+01 volume  0.68718E-03 ppm1      4.365 ppm2      7.471 CV     1
 ASSI {  466}
   (( segid "    " and resid 177  and name HA2 ))
   (( segid "    " and resid 178  and name H   ))
      3.900     1.900     1.900 peak   466 spectrum    1 weight  0.10000E+01 volume  0.11374E-02 ppm1      3.709 ppm2      7.012 CV     1
 ASSI {  474}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 108  and name H   ))
      3.500     1.500     1.500 peak   474 spectrum    1 weight  0.10000E+01 volume  0.10663E-02 ppm1      4.259 ppm2      7.894 CV     1
 ASSI {  475}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 101  and name H   ))
      2.300     0.700     0.700 peak   475 spectrum    1 weight  0.10000E+01 volume  0.53010E-02 ppm1      4.274 ppm2      8.324 CV     1
 ASSI {  479}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name H   ))
      3.000     1.100     1.100 peak   479 spectrum    1 weight  0.10000E+01 volume  0.13947E-02 ppm1      4.278 ppm2      9.174 CV     1
 ASSI {  480}
   (( segid "    " and resid 176  and name HB3 ))
   (( segid "    " and resid 176  and name H   ))
      4.300     2.300     1.700 peak   480 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      3.511 ppm2      9.309 CV     1
 ASSI {  481}
   (( segid "    " and resid 176  and name HB2 ))
   (( segid "    " and resid 176  and name H   ))
      3.600     1.700     1.700 peak   481 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      3.001 ppm2      9.308 CV     1
 ASSI {  482}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 101  and name HA  ))
      3.900     1.900     1.900 peak   482 spectrum    1 weight  0.10000E+01 volume  0.95460E-03 ppm1      4.269 ppm2      4.863 CV     1
 ASSI {  484}
   (( segid "    " and resid 176  and name HB2 ))
   (( segid "    " and resid 176  and name HB3 ))
      2.400     0.700     0.700 peak   484 spectrum    1 weight  0.10000E+01 volume  0.18990E-02 ppm1      3.004 ppm2      3.515 CV     1
 ASSI {  485}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 176  and name HB3 ))
      2.900     1.100     1.100 peak   485 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      4.256 ppm2      3.519 CV     1
 ASSI {  486}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 118  and name HD2 ))
      6.000     4.600     0.000 peak   486 spectrum    1 weight  0.10000E+01 volume  0.68718E-03 ppm1      4.267 ppm2      3.152 CV     1
 ASSI {  487}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 176  and name HB2 ))
      3.600     1.600     1.600 peak   487 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1      4.261 ppm2      3.006 CV     1
 ASSI {  489}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 108  and name HB  ))
      2.300     0.600     0.600 peak   489 spectrum    1 weight  0.10000E+01 volume  0.16282E-02 ppm1      4.254 ppm2      2.312 CV     1
 ASSI {  490}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 101  and name HG3 ))
      5.000     3.200     1.000 peak   490 spectrum    1 weight  0.10000E+01 volume  0.10460E-02 ppm1      4.277 ppm2      2.506 CV     1
 ASSI {  491}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 101  and name HB2 ))
      4.500     2.500     1.500 peak   491 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      4.282 ppm2      1.885 CV     1
 ASSI {  492}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB  ))
      2.500     0.800     0.800 peak   492 spectrum    1 weight  0.10000E+01 volume  0.26066E-02 ppm1      4.275 ppm2      1.582 CV     1
 ASSI {  495}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HG13))
      3.700     1.700     1.700 peak   495 spectrum    1 weight  0.10000E+01 volume  0.19329E-02 ppm1      4.276 ppm2      1.068 CV     1
 ASSI {  496}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HG12))
      2.600     0.800     0.800 peak   496 spectrum    1 weight  0.10000E+01 volume  0.17806E-02 ppm1      4.274 ppm2      1.245 CV     1
 ASSI {  499}
   (( segid "    " and resid 173  and name HB3 ))
   (( segid "    " and resid 174  and name H   ))
      3.800     1.800     1.800 peak   499 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1      3.542 ppm2      8.445 CV     1
 ASSI {  502}
   (( segid "    " and resid 173  and name HB3 ))
   (( segid "    " and resid 173  and name HE3 ))
      3.400     1.400     1.400 peak   502 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      3.546 ppm2      7.590 CV     1
 ASSI {  507}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name H   ))
      2.900     1.100     1.100 peak   507 spectrum    1 weight  0.10000E+01 volume  0.22680E-02 ppm1      4.631 ppm2      6.713 CV     1
 ASSI {  508}
   (( segid "    " and resid 173  and name HB3 ))
   (( segid "    " and resid 173  and name HA  ))
      2.900     1.100     1.100 peak   508 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1      3.545 ppm2      4.663 CV     1
 ASSI {  509}
   (( segid "    " and resid 173  and name HB2 ))
   (( segid "    " and resid 173  and name HA  ))
      3.300     1.400     1.400 peak   509 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      2.986 ppm2      4.670 CV     1
 ASSI {  510}
   (( segid "    " and resid 173  and name HB2 ))
   (( segid "    " and resid 173  and name HB3 ))
      2.300     0.600     0.600 peak   510 spectrum    1 weight  0.10000E+01 volume  0.30162E-02 ppm1      2.992 ppm2      3.549 CV     1
 ASSI {  512}
   (( segid "    " and resid 172  and name HB3 ))
   (( segid "    " and resid 173  and name H   ))
      4.000     2.000     2.000 peak   512 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      2.629 ppm2      7.679 CV     1
 ASSI {  515}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 173  and name H   ))
      4.000     2.000     2.000 peak   515 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      2.845 ppm2      7.677 CV     1
 ASSI {  516}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HD21))
      2.900     1.100     1.100 peak   516 spectrum    1 weight  0.10000E+01 volume  0.26877E-02 ppm1      2.846 ppm2      7.505 CV     1
 OR {  516}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 12   and name HD21))
 ASSI {  517}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 172  and name HD21))
      2.200     0.600     0.600 peak   517 spectrum    1 weight  0.10000E+01 volume  0.26234E-02 ppm1      2.839 ppm2      7.400 CV     1
 ASSI {  518}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HD22))
      4.000     2.000     2.000 peak   518 spectrum    1 weight  0.10000E+01 volume  0.20818E-02 ppm1      2.848 ppm2      6.817 CV     1
 OR {  518}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 12   and name HD22))
 ASSI {  519}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 173  and name H   ))
      2.300     0.600     0.600 peak   519 spectrum    1 weight  0.10000E+01 volume  0.81412E-02 ppm1      4.769 ppm2      7.681 CV     1
 ASSI {  520}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 172  and name HD21))
      3.900     1.900     1.900 peak   520 spectrum    1 weight  0.10000E+01 volume  0.15098E-02 ppm1      4.762 ppm2      7.399 CV     1
 ASSI {  521}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 172  and name H   ))
      2.900     1.000     1.000 peak   521 spectrum    1 weight  0.10000E+01 volume  0.34630E-02 ppm1      2.838 ppm2      8.335 CV     1
 ASSI {  523}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name H   ))
      2.200     0.600     0.600 peak   523 spectrum    1 weight  0.10000E+01 volume  0.46242E-02 ppm1      2.626 ppm2      8.341 CV     1
 ASSI {  524}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 172  and name H   ))
      2.600     0.900     0.900 peak   524 spectrum    1 weight  0.10000E+01 volume  0.31278E-02 ppm1      4.774 ppm2      8.334 CV     1
 ASSI {  525}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 171  and name H   ))
      4.800     2.800     1.200 peak   525 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      4.763 ppm2      8.190 CV     1
 ASSI {  529}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 172  and name HA  ))
      2.900     1.000     1.000 peak   529 spectrum    1 weight  0.10000E+01 volume  0.36323E-02 ppm1      2.837 ppm2      4.769 CV     1
 ASSI {  531}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 13   and name HA  ))
      4.100     2.100     1.900 peak   531 spectrum    1 weight  0.10000E+01 volume  0.86319E-03 ppm1      2.835 ppm2      4.226 CV     1
 OR {  531}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI {  533}
   (( segid "    " and resid 172  and name HB3 ))
   (( segid "    " and resid 132  and name HA  ))
      4.500     2.600     1.500 peak   533 spectrum    1 weight  0.10000E+01 volume  0.11374E-02 ppm1      2.618 ppm2      4.146 CV     1
 ASSI {  534}
   (( segid "    " and resid -3   and name HA  ))
   (( segid "    " and resid -4   and name HA  ))
      3.800     1.800     1.800 peak   534 spectrum    1 weight  0.10000E+01 volume  0.17095E-02 ppm1      4.790 ppm2      4.132 CV     1
 ASSI {  535}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 11   and name HA3 ))
      4.800     2.900     1.200 peak   535 spectrum    1 weight  0.10000E+01 volume  0.70749E-03 ppm1      2.859 ppm2      3.670 CV     1
 OR {  535}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 11   and name HA3 ))
 ASSI {  536}
   (( segid "    " and resid 172  and name HB3 ))
   (( segid "    " and resid 172  and name HB2 ))
      1.700     0.300     0.500 peak   536 spectrum    1 weight  0.10000E+01 volume  0.10897E-01 ppm1      2.628 ppm2      2.837 CV     1
 ASSI {  539}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 172  and name HB3 ))
      2.400     0.700     0.700 peak   539 spectrum    1 weight  0.10000E+01 volume  0.40587E-02 ppm1      4.778 ppm2      2.633 CV     1
 ASSI {  540}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 131  and name HB2 ))
      2.400     0.700     0.700 peak   540 spectrum    1 weight  0.10000E+01 volume  0.13033E-02 ppm1      2.836 ppm2      1.987 CV     1
 ASSI {  542}
   (( segid "    " and resid 172  and name HB3 ))
   (( segid "    " and resid 131  and name HB2 ))
      3.500     1.500     1.500 peak   542 spectrum    1 weight  0.10000E+01 volume  0.10189E-02 ppm1      2.628 ppm2      1.995 CV     1
 ASSI {  543}
   (( segid "    " and resid 172  and name HB3 ))
   (  segid "    " and resid 133  and name HD1%)
      4.700     2.800     1.300 peak   543 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      2.631 ppm2      0.821 CV     1
 OR {  543}
   (( segid "    " and resid 172  and name HB3 ))
   (  segid "    " and resid 133  and name HD2%)
 ASSI {  546}
   (( segid "    " and resid 12   and name HB2 ))
   (  segid "    " and resid 13   and name HG1%)
      4.700     2.700     1.300 peak   546 spectrum    1 weight  0.10000E+01 volume  0.13540E-02 ppm1      2.850 ppm2      0.912 CV     1
 ASSI {  547}
   (( segid "    " and resid 172  and name HB2 ))
   (  segid "    " and resid 133  and name HD2%)
      4.000     2.000     2.000 peak   547 spectrum    1 weight  0.10000E+01 volume  0.16384E-02 ppm1      2.844 ppm2      0.819 CV     1
 OR {  547}
   (( segid "    " and resid 172  and name HB2 ))
   (  segid "    " and resid 133  and name HD1%)
 ASSI {  548}
   (( segid "    " and resid 172  and name HB2 ))
   (  segid "    " and resid 174  and name HD2%)
      3.800     1.800     1.800 peak   548 spectrum    1 weight  0.10000E+01 volume  0.96476E-03 ppm1      2.840 ppm2      0.691 CV     1
 ASSI {  550}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name H   ))
      3.000     1.100     1.100 peak   550 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      4.392 ppm2      8.789 CV     1
 ASSI {  552}
   (( segid "    " and resid 130  and name HB  ))
   (( segid "    " and resid 130  and name H   ))
      3.200     1.300     1.300 peak   552 spectrum    1 weight  0.10000E+01 volume  0.16079E-02 ppm1      1.656 ppm2      8.792 CV     1
 ASSI {  553}
   (( segid "    " and resid 130  and name HB  ))
   (( segid "    " and resid 192  and name H   ))
      4.700     2.800     1.300 peak   553 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      1.664 ppm2      9.100 CV     1
 ASSI {  555}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 130  and name H   ))
      2.300     0.700     0.700 peak   555 spectrum    1 weight  0.10000E+01 volume  0.57073E-02 ppm1      0.228 ppm2      8.792 CV     1
 ASSI {  556}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 194  and name H   ))
      3.800     1.900     1.900 peak   556 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1      0.229 ppm2      8.641 CV     1
 ASSI {  557}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 192  and name H   ))
      2.900     1.100     1.100 peak   557 spectrum    1 weight  0.10000E+01 volume  0.15808E-02 ppm1      0.228 ppm2      9.084 CV     1
 ASSI {  559}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 131  and name H   ))
      2.300     0.700     0.700 peak   559 spectrum    1 weight  0.10000E+01 volume  0.88521E-02 ppm1      0.485 ppm2      8.411 CV     1
 ASSI {  560}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 171  and name H   ))
      4.500     2.500     1.500 peak   560 spectrum    1 weight  0.10000E+01 volume  0.13845E-02 ppm1      0.482 ppm2      8.193 CV     1
 ASSI {  561}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 108  and name H   ))
      3.700     1.700     1.700 peak   561 spectrum    1 weight  0.10000E+01 volume  0.25422E-02 ppm1      0.490 ppm2      7.899 CV     1
 ASSI {  562}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 129  and name H   ))
      3.800     1.800     1.800 peak   562 spectrum    1 weight  0.10000E+01 volume  0.12254E-02 ppm1      0.487 ppm2      8.899 CV     1
 ASSI {  564}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 132  and name H   ))
      3.200     1.300     1.300 peak   564 spectrum    1 weight  0.10000E+01 volume  0.14285E-02 ppm1      0.487 ppm2      8.638 CV     1
 ASSI {  566}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 173  and name H   ))
      3.600     1.600     1.600 peak   566 spectrum    1 weight  0.10000E+01 volume  0.15876E-02 ppm1      0.485 ppm2      7.677 CV     1
 ASSI {  567}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 173  and name HE3 ))
      4.000     2.000     2.000 peak   567 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      0.484 ppm2      7.563 CV     1
 ASSI {  568}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 173  and name H   ))
      4.900     3.000     1.100 peak   568 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      0.226 ppm2      7.677 CV     1
 ASSI {  570}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 173  and name HE3 ))
      3.600     1.700     1.700 peak   570 spectrum    1 weight  0.10000E+01 volume  0.19329E-02 ppm1      0.228 ppm2      7.563 CV     1
 ASSI {  571}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 172  and name HD21))
      3.900     1.900     1.900 peak   571 spectrum    1 weight  0.10000E+01 volume  0.10697E-02 ppm1      0.486 ppm2      7.402 CV     1
 ASSI {  572}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 173  and name HD1 ))
      3.400     1.400     1.400 peak   572 spectrum    1 weight  0.10000E+01 volume  0.14895E-02 ppm1      0.485 ppm2      7.268 CV     1
 ASSI {  573}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 129  and name HA  ))
      4.500     2.500     1.500 peak   573 spectrum    1 weight  0.10000E+01 volume  0.13811E-02 ppm1      0.485 ppm2      5.576 CV     1
 ASSI {  574}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 129  and name HA  ))
      3.600     1.600     1.600 peak   574 spectrum    1 weight  0.10000E+01 volume  0.16215E-02 ppm1      0.229 ppm2      5.578 CV     1
 ASSI {  576}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 176  and name HD2 ))
      3.200     1.300     1.300 peak   576 spectrum    1 weight  0.10000E+01 volume  0.25828E-02 ppm1      0.493 ppm2      6.920 CV     1
 ASSI {  577}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 173  and name HZ3 ))
      4.400     2.400     1.600 peak   577 spectrum    1 weight  0.10000E+01 volume  0.95799E-03 ppm1      0.484 ppm2      6.704 CV     1
 ASSI {  578}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 173  and name HH2 ))
      4.200     2.200     1.800 peak   578 spectrum    1 weight  0.10000E+01 volume  0.12762E-02 ppm1      0.231 ppm2      6.839 CV     1
 ASSI {  579}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 173  and name HZ3 ))
      4.000     2.000     2.000 peak   579 spectrum    1 weight  0.10000E+01 volume  0.15199E-02 ppm1      0.227 ppm2      6.711 CV     1
 ASSI {  580}
   (( segid "    " and resid 130  and name HB  ))
   (( segid "    " and resid 173  and name HA  ))
      3.400     1.400     1.400 peak   580 spectrum    1 weight  0.10000E+01 volume  0.65332E-03 ppm1      1.645 ppm2      4.681 CV     1
 ASSI {  581}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 173  and name HA  ))
      2.500     0.800     0.800 peak   581 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1      4.382 ppm2      4.668 CV     1
 ASSI {  582}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 173  and name HA  ))
      3.800     1.800     1.800 peak   582 spectrum    1 weight  0.10000E+01 volume  0.32056E-02 ppm1      0.226 ppm2      4.672 CV     1
 ASSI {  584}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 130  and name HA  ))
      2.800     1.000     1.000 peak   584 spectrum    1 weight  0.10000E+01 volume  0.53992E-02 ppm1      0.227 ppm2      4.387 CV     1
 ASSI {  585}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 193  and name HA  ))
      3.700     1.700     1.700 peak   585 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      0.226 ppm2      4.880 CV     1
 ASSI {  587}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 191  and name HA  ))
      4.000     2.000     2.000 peak   587 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      0.482 ppm2      4.887 CV     1
 ASSI {  588}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 173  and name HA  ))
      2.600     0.900     0.900 peak   588 spectrum    1 weight  0.10000E+01 volume  0.43872E-02 ppm1      0.485 ppm2      4.678 CV     1
 ASSI {  589}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 130  and name HA  ))
      2.200     0.600     0.600 peak   589 spectrum    1 weight  0.10000E+01 volume  0.94005E-02 ppm1      0.485 ppm2      4.389 CV     1
 ASSI {  590}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 176  and name HA  ))
      3.200     1.300     1.300 peak   590 spectrum    1 weight  0.10000E+01 volume  0.46882E-02 ppm1      0.494 ppm2      4.255 CV     1
 ASSI {  591}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 171  and name HA  ))
      2.900     1.000     1.000 peak   591 spectrum    1 weight  0.10000E+01 volume  0.42753E-02 ppm1      0.484 ppm2      4.131 CV     1
 ASSI {  592}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 109  and name HA  ))
      3.800     1.800     1.800 peak   592 spectrum    1 weight  0.10000E+01 volume  0.18957E-02 ppm1      0.493 ppm2      3.777 CV     1
 ASSI {  593}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 108  and name HA  ))
      2.400     0.700     0.700 peak   593 spectrum    1 weight  0.10000E+01 volume  0.44244E-02 ppm1      0.495 ppm2      3.456 CV     1
 ASSI {  594}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 194  and name HD3 ))
      3.000     1.100     1.100 peak   594 spectrum    1 weight  0.10000E+01 volume  0.40688E-02 ppm1      0.227 ppm2      2.990 CV     1
 OR {  594}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 194  and name HD2 ))
 ASSI {  596}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 172  and name HB2 ))
      3.100     1.200     1.200 peak   596 spectrum    1 weight  0.10000E+01 volume  0.24643E-02 ppm1      0.485 ppm2      2.835 CV     1
 ASSI {  597}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 109  and name HB  ))
      4.800     2.900     1.200 peak   597 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      0.492 ppm2      4.010 CV     1
 ASSI {  598}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB  ))
      2.700     0.900     0.900 peak   598 spectrum    1 weight  0.10000E+01 volume  0.20886E-02 ppm1      4.386 ppm2      1.648 CV     1
 ASSI {  599}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 192  and name HB2 ))
      4.800     2.900     1.200 peak   599 spectrum    1 weight  0.10000E+01 volume  0.56871E-03 ppm1      4.383 ppm2      1.362 CV     1
 ASSI {  600}
   (( segid "    " and resid 130  and name HB  ))
   (( segid "    " and resid 192  and name HB2 ))
      4.000     2.000     2.000 peak   600 spectrum    1 weight  0.10000E+01 volume  0.23086E-02 ppm1      1.658 ppm2      1.382 CV     1
 OR {  600}
   (( segid "    " and resid 130  and name HB  ))
   (( segid "    " and resid 192  and name HG  ))
 ASSI {  601}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 130  and name HB  ))
      2.100     0.600     0.600 peak   601 spectrum    1 weight  0.10000E+01 volume  0.91736E-02 ppm1      0.227 ppm2      1.659 CV     1
 ASSI {  604}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 108  and name HB  ))
      2.300     0.600     0.600 peak   604 spectrum    1 weight  0.10000E+01 volume  0.42923E-02 ppm1      0.494 ppm2      2.313 CV     1
 ASSI {  605}
   (  segid "    " and resid 108  and name HG1%)
   (  segid "    " and resid 111  and name HE% )
      2.700     0.900     0.900 peak   605 spectrum    1 weight  0.10000E+01 volume  0.38083E-02 ppm1      0.487 ppm2      1.998 CV     1
 ASSI {  606}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 130  and name HB  ))
      2.000     0.500     0.500 peak   606 spectrum    1 weight  0.10000E+01 volume  0.13771E-01 ppm1      0.485 ppm2      1.655 CV     1
 ASSI {  608}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 172  and name HB3 ))
      3.700     1.700     1.700 peak   608 spectrum    1 weight  0.10000E+01 volume  0.27386E-02 ppm1      0.485 ppm2      2.624 CV     1
 ASSI {  614}
   (( segid "    " and resid 130  and name HB  ))
   (  segid "    " and resid 192  and name HD2%)
      4.000     2.000     2.000 peak   614 spectrum    1 weight  0.10000E+01 volume  0.28368E-02 ppm1      1.659 ppm2      0.706 CV     1
 OR {  614}
   (( segid "    " and resid 130  and name HB  ))
   (  segid "    " and resid 192  and name HD1%)
 ASSI {  615}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 171  and name HB3 ))
      3.700     1.700     1.700 peak   615 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      0.226 ppm2      0.815 CV     1
 ASSI {  616}
   (  segid "    " and resid 130  and name HG1%)
   (  segid "    " and resid 192  and name HD1%)
      2.400     0.700     0.700 peak   616 spectrum    1 weight  0.10000E+01 volume  0.12653E-01 ppm1      0.227 ppm2      0.701 CV     1
 ASSI {  617}
   (  segid "    " and resid 130  and name HG1%)
   (  segid "    " and resid 129  and name HD2%)
      3.400     1.400     1.400 peak   617 spectrum    1 weight  0.10000E+01 volume  0.45665E-02 ppm1      0.224 ppm2      0.629 CV     1
 ASSI {  618}
   (  segid "    " and resid 130  and name HG1%)
   (  segid "    " and resid 130  and name HG2%)
      2.000     0.500     0.500 peak   618 spectrum    1 weight  0.10000E+01 volume  0.17704E-01 ppm1      0.227 ppm2      0.482 CV     1
 ASSI {  620}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 171  and name HB3 ))
      2.200     0.600     0.600 peak   620 spectrum    1 weight  0.10000E+01 volume  0.47898E-02 ppm1      0.486 ppm2      0.844 CV     1
 ASSI {  622}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 129  and name HB2 ))
      2.500     0.800     0.800 peak   622 spectrum    1 weight  0.10000E+01 volume  0.28469E-02 ppm1      0.491 ppm2      1.202 CV     1
 ASSI {  624}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 130  and name H   ))
      2.700     0.900     0.900 peak   624 spectrum    1 weight  0.10000E+01 volume  0.19092E-02 ppm1      5.581 ppm2      8.795 CV     1
 ASSI {  625}
   (  segid "    " and resid 129  and name HD1%)
   (( segid "    " and resid 130  and name H   ))
      3.200     1.300     1.300 peak   625 spectrum    1 weight  0.10000E+01 volume  0.53653E-02 ppm1      0.742 ppm2      8.794 CV     1
 ASSI {  626}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 194  and name H   ))
      2.700     0.900     0.900 peak   626 spectrum    1 weight  0.10000E+01 volume  0.66686E-02 ppm1      0.741 ppm2      8.641 CV     1
 ASSI {  627}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 129  and name H   ))
      3.500     1.500     1.500 peak   627 spectrum    1 weight  0.10000E+01 volume  0.34664E-02 ppm1      0.683 ppm2      8.880 CV     1
 ASSI {  628}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 129  and name H   ))
      4.200     2.200     1.800 peak   628 spectrum    1 weight  0.10000E+01 volume  0.16621E-02 ppm1      0.637 ppm2      8.883 CV     1
 ASSI {  629}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 130  and name H   ))
      2.900     1.100     1.100 peak   629 spectrum    1 weight  0.10000E+01 volume  0.18618E-02 ppm1      0.638 ppm2      8.788 CV     1
 ASSI {  630}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 112  and name H   ))
      3.700     1.700     1.700 peak   630 spectrum    1 weight  0.10000E+01 volume  0.47221E-02 ppm1      0.682 ppm2      8.749 CV     1
 ASSI {  631}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 131  and name H   ))
      4.100     2.100     1.900 peak   631 spectrum    1 weight  0.10000E+01 volume  0.10020E-02 ppm1      0.632 ppm2      8.405 CV     1
 ASSI {  632}
   (  segid "    " and resid 129  and name HD1%)
   (( segid "    " and resid 129  and name HA  ))
      3.100     1.200     1.200 peak   632 spectrum    1 weight  0.10000E+01 volume  0.61947E-02 ppm1      0.739 ppm2      5.577 CV     1
 ASSI {  633}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 129  and name HA  ))
      2.900     1.100     1.100 peak   633 spectrum    1 weight  0.10000E+01 volume  0.20548E-02 ppm1      0.637 ppm2      5.576 CV     1
 ASSI {  634}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 193  and name HA  ))
      3.500     1.500     1.500 peak   634 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      5.587 ppm2      4.871 CV     1
 ASSI {  635}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 191  and name HA  ))
      2.500     0.800     0.800 peak   635 spectrum    1 weight  0.10000E+01 volume  0.10470E-01 ppm1      0.745 ppm2      4.883 CV     1
 ASSI {  636}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 90   and name HA  ))
      2.400     2.400     3.600 peak   636 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      0.748 ppm2      5.045 CV     1
 ASSI {  638}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 129  and name HB2 ))
      3.300     1.400     1.400 peak   638 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      5.587 ppm2      1.151 CV     1
 ASSI {  639}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 129  and name HB3 ))
      3.100     1.200     1.200 peak   639 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      5.583 ppm2      1.482 CV     1
 ASSI {  640}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 129  and name HB3 ))
      2.200     0.600     0.600 peak   640 spectrum    1 weight  0.10000E+01 volume  0.10968E-02 ppm1      1.165 ppm2      1.466 CV     1
 ASSI {  642}
   (  segid "    " and resid 129  and name HD2%)
   (  segid "    " and resid 111  and name HE% )
      3.400     1.500     1.500 peak   642 spectrum    1 weight  0.10000E+01 volume  0.21936E-02 ppm1      0.636 ppm2      1.949 CV     1
 ASSI {  643}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 191  and name HB2 ))
      3.100     1.200     1.200 peak   643 spectrum    1 weight  0.10000E+01 volume  0.37811E-02 ppm1      0.637 ppm2      1.619 CV     1
 OR {  643}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 191  and name HG  ))
 ASSI {  644}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 129  and name HB3 ))
      2.100     0.600     0.600 peak   644 spectrum    1 weight  0.10000E+01 volume  0.10362E-01 ppm1      0.637 ppm2      1.502 CV     1
 ASSI {  645}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 129  and name HB2 ))
      2.900     1.100     1.100 peak   645 spectrum    1 weight  0.10000E+01 volume  0.48102E-02 ppm1      0.636 ppm2      1.160 CV     1
 ASSI {  646}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 193  and name HB2 ))
      3.700     1.700     1.700 peak   646 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      0.636 ppm2      1.014 CV     1
 ASSI {  647}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 193  and name HB3 ))
      2.500     0.800     0.800 peak   647 spectrum    1 weight  0.10000E+01 volume  0.47019E-02 ppm1      0.742 ppm2      1.842 CV     1
 ASSI {  649}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 191  and name HB3 ))
      2.700     0.900     0.900 peak   649 spectrum    1 weight  0.10000E+01 volume  0.68550E-02 ppm1      0.745 ppm2      1.227 CV     1
 ASSI {  650}
   (  segid "    " and resid 129  and name HD1%)
   (( segid "    " and resid 129  and name HB2 ))
      2.400     0.700     0.700 peak   650 spectrum    1 weight  0.10000E+01 volume  0.69157E-02 ppm1      0.740 ppm2      1.170 CV     1
 ASSI {  653}
   (( segid "    " and resid 129  and name HB3 ))
   (  segid "    " and resid 129  and name HD1%)
      3.100     1.200     1.200 peak   653 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      1.450 ppm2      0.745 CV     1
 ASSI {  658}
   (  segid "    " and resid 129  and name HD2%)
   (  segid "    " and resid 129  and name HD1%)
      2.000     0.500     0.500 peak   658 spectrum    1 weight  0.10000E+01 volume  0.26980E-01 ppm1      0.637 ppm2      0.743 CV     1
 ASSI {  663}
   (( segid "    " and resid 121  and name HB  ))
   (( segid "    " and resid 121  and name H   ))
      3.000     1.100     1.100 peak   663 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      1.225 ppm2      7.952 CV     1
 ASSI {  664}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name H   ))
      3.600     1.600     1.600 peak   664 spectrum    1 weight  0.10000E+01 volume  0.34630E-02 ppm1      0.286 ppm2      7.949 CV     1
 ASSI {  665}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 123  and name H   ))
      2.800     1.000     1.000 peak   665 spectrum    1 weight  0.10000E+01 volume  0.27249E-02 ppm1      0.492 ppm2      8.700 CV     1
 ASSI {  666}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 122  and name H   ))
      3.100     1.200     1.200 peak   666 spectrum    1 weight  0.10000E+01 volume  0.24339E-02 ppm1      0.491 ppm2      8.498 CV     1
 ASSI {  667}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 116  and name H   ))
      4.900     3.000     1.100 peak   667 spectrum    1 weight  0.10000E+01 volume  0.10223E-02 ppm1      0.490 ppm2      8.346 CV     1
 ASSI {  668}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 121  and name H   ))
      3.700     1.700     1.700 peak   668 spectrum    1 weight  0.10000E+01 volume  0.35170E-02 ppm1      0.490 ppm2      7.950 CV     1
 ASSI {  671}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 93   and name H   ))
      3.700     1.700     1.700 peak   671 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      0.283 ppm2      8.506 CV     1
 ASSI {  672}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 116  and name H   ))
      4.600     2.700     1.400 peak   672 spectrum    1 weight  0.10000E+01 volume  0.85304E-03 ppm1      0.284 ppm2      8.346 CV     1
 ASSI {  674}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 118  and name H   ))
      2.600     2.600     3.400 peak   674 spectrum    1 weight  0.10000E+01 volume  0.84627E-03 ppm1      0.292 ppm2      7.675 CV     1
 ASSI {  678}
   (  segid "    " and resid 121  and name HG2%)
   (  segid "    " and resid 127  and name HD% )
      3.600     1.700     1.700 peak   678 spectrum    1 weight  0.10000E+01 volume  0.31855E-02 ppm1      0.490 ppm2      6.866 CV     1
 ASSI {  679}
   (  segid "    " and resid 121  and name HG2%)
   (  segid "    " and resid 127  and name HE% )
      2.400     0.700     0.700 peak   679 spectrum    1 weight  0.10000E+01 volume  0.56429E-02 ppm1      0.491 ppm2      6.636 CV     1
 ASSI {  680}
   (  segid "    " and resid 121  and name HD1%)
   (  segid "    " and resid 127  and name HD% )
      3.700     1.700     1.700 peak   680 spectrum    1 weight  0.10000E+01 volume  0.15707E-02 ppm1      0.285 ppm2      6.863 CV     1
 ASSI {  681}
   (  segid "    " and resid 121  and name HD1%)
   (  segid "    " and resid 127  and name HE% )
      2.900     1.000     1.000 peak   681 spectrum    1 weight  0.10000E+01 volume  0.29009E-02 ppm1      0.286 ppm2      6.638 CV     1
 ASSI {  682}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 123  and name HA  ))
      3.900     1.900     1.900 peak   682 spectrum    1 weight  0.10000E+01 volume  0.11137E-02 ppm1      0.491 ppm2      4.893 CV     1
 ASSI {  683}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 66   and name HA  ))
      3.300     1.400     1.400 peak   683 spectrum    1 weight  0.10000E+01 volume  0.24407E-02 ppm1      0.866 ppm2      4.390 CV     1
 ASSI {  684}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 124  and name HA  ))
      3.200     1.200     1.200 peak   684 spectrum    1 weight  0.10000E+01 volume  0.26337E-02 ppm1      0.491 ppm2      4.382 CV     1
 ASSI {  685}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 119  and name HA  ))
      2.500     2.500     3.500 peak   685 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      0.288 ppm2      4.322 CV     1
 ASSI {  686}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 121  and name HA  ))
      2.500     0.800     0.800 peak   686 spectrum    1 weight  0.10000E+01 volume  0.52741E-02 ppm1      0.491 ppm2      4.114 CV     1
 ASSI {  687}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HA  ))
      3.900     1.900     1.900 peak   687 spectrum    1 weight  0.10000E+01 volume  0.34597E-02 ppm1      0.285 ppm2      4.114 CV     1
 ASSI {  688}
   (( segid "    " and resid 121  and name HB  ))
   (( segid "    " and resid 116  and name HA  ))
      3.400     1.500     1.500 peak   688 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.225 ppm2      3.746 CV     1
 ASSI {  689}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 116  and name HA  ))
      2.500     0.800     0.800 peak   689 spectrum    1 weight  0.10000E+01 volume  0.36695E-02 ppm1      0.285 ppm2      3.744 CV     1
 ASSI {  690}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 116  and name HA  ))
      4.000     2.000     2.000 peak   690 spectrum    1 weight  0.10000E+01 volume  0.23696E-02 ppm1      0.492 ppm2      3.745 CV     1
 ASSI {  691}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 116  and name HB2 ))
      3.000     1.200     1.200 peak   691 spectrum    1 weight  0.10000E+01 volume  0.32227E-02 ppm1      0.492 ppm2      2.996 CV     1
 ASSI {  692}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 116  and name HB3 ))
      3.500     1.500     1.500 peak   692 spectrum    1 weight  0.10000E+01 volume  0.33782E-02 ppm1      0.491 ppm2      2.804 CV     1
 ASSI {  693}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 123  and name HB3 ))
      3.400     1.500     1.500 peak   693 spectrum    1 weight  0.10000E+01 volume  0.16045E-02 ppm1      0.489 ppm2      2.694 CV     1
 ASSI {  694}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 116  and name HB2 ))
      3.500     1.500     1.500 peak   694 spectrum    1 weight  0.10000E+01 volume  0.16892E-02 ppm1      0.286 ppm2      2.989 CV     1
 ASSI {  695}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 116  and name HB3 ))
      3.600     1.600     1.600 peak   695 spectrum    1 weight  0.10000E+01 volume  0.19397E-02 ppm1      0.286 ppm2      2.801 CV     1
 ASSI {  696}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HB  ))
      3.000     1.100     1.100 peak   696 spectrum    1 weight  0.10000E+01 volume  0.21969E-02 ppm1      4.121 ppm2      1.211 CV     1
 ASSI {  698}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 119  and name HB  ))
      3.000     1.100     1.100 peak   698 spectrum    1 weight  0.10000E+01 volume  0.37372E-02 ppm1      0.286 ppm2      1.916 CV     1
 ASSI {  702}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 66   and name HB3 ))
      2.800     1.000     1.000 peak   702 spectrum    1 weight  0.10000E+01 volume  0.10257E-02 ppm1      0.864 ppm2      1.549 CV     1
 ASSI {  703}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 121  and name HB  ))
      2.000     0.500     0.500 peak   703 spectrum    1 weight  0.10000E+01 volume  0.11723E-01 ppm1      0.491 ppm2      1.211 CV     1
 ASSI {  704}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 121  and name HG12))
      2.500     0.800     0.800 peak   704 spectrum    1 weight  0.10000E+01 volume  0.59003E-02 ppm1      0.491 ppm2      0.816 CV     1
 OR {  704}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 121  and name HG13))
 ASSI {  705}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 66   and name HD2 ))
      1.600     0.300     0.600 peak   705 spectrum    1 weight  0.10000E+01 volume  0.61947E-02 ppm1      0.865 ppm2      0.496 CV     1
 ASSI {  706}
   (( segid "    " and resid 121  and name HB  ))
   (( segid "    " and resid 121  and name HG13))
      3.200     1.300     1.300 peak   706 spectrum    1 weight  0.10000E+01 volume  0.81580E-03 ppm1      1.207 ppm2      0.809 CV     1
 OR {  706}
   (( segid "    " and resid 121  and name HB  ))
   (( segid "    " and resid 121  and name HG12))
 ASSI {  707}
   (  segid "    " and resid 121  and name HD1%)
   (  segid "    " and resid 93   and name HD2%)
      2.400     0.700     0.700 peak   707 spectrum    1 weight  0.10000E+01 volume  0.57817E-02 ppm1      0.286 ppm2      0.957 CV     1
 ASSI {  708}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HG13))
      2.100     0.500     0.500 peak   708 spectrum    1 weight  0.10000E+01 volume  0.10687E-01 ppm1      0.286 ppm2      0.808 CV     1
 OR {  708}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HG12))
 ASSI {  711}
   (  segid "    " and resid 121  and name HD1%)
   (  segid "    " and resid 121  and name HG2%)
      2.100     0.500     0.500 peak   711 spectrum    1 weight  0.10000E+01 volume  0.16783E-01 ppm1      0.286 ppm2      0.490 CV     1
 ASSI {  713}
   (( segid "    " and resid 121  and name HB  ))
   (  segid "    " and resid 193  and name HD1%)
      3.900     1.900     1.900 peak   713 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      1.215 ppm2      0.594 CV     1
 ASSI {  715}
   (( segid "    " and resid 121  and name HB  ))
   (  segid "    " and resid 121  and name HD1%)
      3.000     1.100     1.100 peak   715 spectrum    1 weight  0.10000E+01 volume  0.15876E-02 ppm1      1.214 ppm2      0.285 CV     1
 ASSI {  720}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 121  and name H   ))
      4.600     2.600     1.400 peak   720 spectrum    1 weight  0.10000E+01 volume  0.58900E-03 ppm1      4.306 ppm2      7.948 CV     1
 ASSI {  721}
   (( segid "    " and resid 119  and name HB  ))
   (( segid "    " and resid 121  and name H   ))
      3.600     1.600     1.600 peak   721 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      1.960 ppm2      7.968 CV     1
 ASSI {  722}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 121  and name H   ))
      4.700     2.700     1.300 peak   722 spectrum    1 weight  0.10000E+01 volume  0.13168E-02 ppm1      0.590 ppm2      7.949 CV     1
 ASSI {  724}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 116  and name H   ))
      2.500     2.500     3.500 peak   724 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      0.594 ppm2      8.344 CV     1
 ASSI {  725}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 118  and name H   ))
      4.300     2.300     1.700 peak   725 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      4.323 ppm2      7.668 CV     1
 ASSI {  727}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name H   ))
      2.700     0.900     0.900 peak   727 spectrum    1 weight  0.10000E+01 volume  0.27353E-02 ppm1      4.319 ppm2      7.456 CV     1
 ASSI {  729}
   (( segid "    " and resid 119  and name HB  ))
   (( segid "    " and resid 119  and name H   ))
      3.200     1.200     1.200 peak   729 spectrum    1 weight  0.10000E+01 volume  0.18449E-02 ppm1      1.963 ppm2      7.456 CV     1
 ASSI {  730}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 117  and name H   ))
      4.700     2.800     1.300 peak   730 spectrum    1 weight  0.10000E+01 volume  0.69395E-03 ppm1      0.596 ppm2      7.783 CV     1
 ASSI {  731}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 118  and name H   ))
      4.200     2.200     1.800 peak   731 spectrum    1 weight  0.10000E+01 volume  0.90721E-03 ppm1      0.587 ppm2      7.676 CV     1
 ASSI {  733}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name H   ))
      2.500     0.800     0.800 peak   733 spectrum    1 weight  0.10000E+01 volume  0.30601E-02 ppm1      0.590 ppm2      7.457 CV     1
 ASSI {  734}
   (( segid "    " and resid 119  and name HG12))
   (( segid "    " and resid 119  and name H   ))
      2.200     0.600     0.600 peak   734 spectrum    1 weight  0.10000E+01 volume  0.16452E-02 ppm1      1.274 ppm2      7.458 CV     1
 OR {  734}
   (( segid "    " and resid 119  and name HG13))
   (( segid "    " and resid 119  and name H   ))
 ASSI {  736}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 120  and name H   ))
      4.100     2.100     1.900 peak   736 spectrum    1 weight  0.10000E+01 volume  0.21292E-02 ppm1      0.764 ppm2      7.549 CV     1
 ASSI {  737}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 119  and name H   ))
      3.300     1.300     1.300 peak   737 spectrum    1 weight  0.10000E+01 volume  0.59375E-02 ppm1      0.766 ppm2      7.459 CV     1
 ASSI {  738}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 118  and name H   ))
      4.400     2.500     1.600 peak   738 spectrum    1 weight  0.10000E+01 volume  0.19532E-02 ppm1      0.764 ppm2      7.675 CV     1
 ASSI {  739}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 121  and name H   ))
      4.600     2.700     1.400 peak   739 spectrum    1 weight  0.10000E+01 volume  0.13947E-02 ppm1      0.763 ppm2      7.948 CV     1
 ASSI {  740}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 81   and name H   ))
      2.600     0.900     0.900 peak   740 spectrum    1 weight  0.10000E+01 volume  0.41096E-02 ppm1      0.730 ppm2      8.538 CV     1
 ASSI {  741}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 116  and name H   ))
      3.600     1.600     1.600 peak   741 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      0.724 ppm2      8.347 CV     1
 ASSI {  742}
   (  segid "    " and resid 8    and name HG2%)
   (  segid "    " and resid 19   and name HE% )
      5.300     3.500     0.700 peak   742 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      0.743 ppm2      7.106 CV     1
 ASSI {  743}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HA  ))
      3.000     1.100     1.100 peak   743 spectrum    1 weight  0.10000E+01 volume  0.29619E-02 ppm1      0.591 ppm2      4.319 CV     1
 ASSI {  744}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 118  and name HA  ))
      4.700     2.800     1.300 peak   744 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      0.591 ppm2      4.089 CV     1
 ASSI {  745}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 116  and name HA  ))
      3.400     1.400     1.400 peak   745 spectrum    1 weight  0.10000E+01 volume  0.29213E-02 ppm1      0.592 ppm2      3.747 CV     1
 ASSI {  746}
   (( segid "    " and resid 119  and name HG12))
   (( segid "    " and resid 116  and name HA  ))
      2.900     1.000     1.000 peak   746 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      1.271 ppm2      3.747 CV     1
 OR {  746}
   (( segid "    " and resid 119  and name HG13))
   (( segid "    " and resid 116  and name HA  ))
 ASSI {  747}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 119  and name HA  ))
      2.200     0.600     0.600 peak   747 spectrum    1 weight  0.10000E+01 volume  0.11628E-01 ppm1      0.766 ppm2      4.319 CV     1
 ASSI {  748}
   (( segid "    " and resid 119  and name HG13))
   (( segid "    " and resid 119  and name HA  ))
      4.400     2.400     1.600 peak   748 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      1.292 ppm2      4.319 CV     1
 ASSI {  749}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 118  and name HA  ))
      3.600     1.600     1.600 peak   749 spectrum    1 weight  0.10000E+01 volume  0.12627E-02 ppm1      4.321 ppm2      4.106 CV     1
 ASSI {  750}
   (( segid "    " and resid 119  and name HB  ))
   (( segid "    " and resid 119  and name HA  ))
      2.600     0.800     0.800 peak   750 spectrum    1 weight  0.10000E+01 volume  0.43939E-02 ppm1      1.963 ppm2      4.319 CV     1
 ASSI {  751}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 116  and name HB2 ))
      5.200     3.300     0.800 peak   751 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      0.595 ppm2      2.979 CV     1
 ASSI {  752}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 115  and name HA  ))
      2.600     2.600     3.400 peak   752 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      0.587 ppm2      3.371 CV     1
 ASSI {  753}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 98   and name HE2 ))
      4.300     2.300     1.700 peak   753 spectrum    1 weight  0.10000E+01 volume  0.23764E-02 ppm1      0.764 ppm2      2.874 CV     1
 ASSI {  754}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 81   and name HB3 ))
      3.300     1.400     1.400 peak   754 spectrum    1 weight  0.10000E+01 volume  0.18855E-02 ppm1      0.765 ppm2      3.147 CV     1
 ASSI {  758}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HG12))
      1.900     0.400     0.400 peak   758 spectrum    1 weight  0.10000E+01 volume  0.15236E-01 ppm1      0.592 ppm2      1.248 CV     1
 OR {  758}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HG13))
 ASSI {  759}
   (( segid "    " and resid 119  and name HG13))
   (( segid "    " and resid 119  and name HB  ))
      2.600     0.800     0.800 peak   759 spectrum    1 weight  0.10000E+01 volume  0.18652E-02 ppm1      1.257 ppm2      1.959 CV     1
 OR {  759}
   (( segid "    " and resid 119  and name HG12))
   (( segid "    " and resid 119  and name HB  ))
 ASSI {  762}
   (( segid "    " and resid 119  and name HB  ))
   (  segid "    " and resid 119  and name HD1%)
      3.100     1.200     1.200 peak   762 spectrum    1 weight  0.10000E+01 volume  0.45766E-02 ppm1      1.962 ppm2      0.589 CV     1
 ASSI {  763}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 93   and name HD2%)
      3.700     1.700     1.700 peak   763 spectrum    1 weight  0.10000E+01 volume  0.26709E-02 ppm1      0.592 ppm2      0.962 CV     1
 ASSI {  766}
   (( segid "    " and resid 119  and name HG12))
   (  segid "    " and resid 119  and name HD1%)
      2.300     0.700     0.700 peak   766 spectrum    1 weight  0.10000E+01 volume  0.46544E-02 ppm1      1.243 ppm2      0.595 CV     1
 ASSI {  768}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 121  and name HD1%)
      3.000     1.100     1.100 peak   768 spectrum    1 weight  0.10000E+01 volume  0.12444E-01 ppm1      0.592 ppm2      0.285 CV     1
 ASSI {  769}
   (( segid "    " and resid 119  and name HG13))
   (  segid "    " and resid 121  and name HD1%)
      2.900     1.100     1.100 peak   769 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      1.291 ppm2      0.286 CV     1
 ASSI {  770}
   (( segid "    " and resid 119  and name HG12))
   (  segid "    " and resid 121  and name HD1%)
      3.500     1.500     1.500 peak   770 spectrum    1 weight  0.10000E+01 volume  0.10968E-02 ppm1      1.248 ppm2      0.284 CV     1
 ASSI {  771}
   (  segid "    " and resid 119  and name HG2%)
   (  segid "    " and resid 121  and name HD1%)
      3.000     1.100     1.100 peak   771 spectrum    1 weight  0.10000E+01 volume  0.70715E-02 ppm1      0.770 ppm2      0.286 CV     1
 ASSI {  772}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 121  and name H   ))
      3.500     1.500     1.500 peak   772 spectrum    1 weight  0.10000E+01 volume  0.10054E-02 ppm1      4.075 ppm2      7.952 CV     1
 ASSI {  774}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 118  and name H   ))
      3.200     1.300     1.300 peak   774 spectrum    1 weight  0.10000E+01 volume  0.12525E-02 ppm1      4.072 ppm2      7.679 CV     1
 ASSI {  775}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 120  and name H   ))
      3.400     1.500     1.500 peak   775 spectrum    1 weight  0.10000E+01 volume  0.98169E-03 ppm1      4.077 ppm2      7.549 CV     1
 ASSI {  776}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 117  and name H   ))
      2.200     0.600     0.600 peak   776 spectrum    1 weight  0.10000E+01 volume  0.13811E-01 ppm1      1.429 ppm2      7.773 CV     1
 ASSI {  777}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 118  and name H   ))
      2.500     0.800     0.800 peak   777 spectrum    1 weight  0.10000E+01 volume  0.60290E-02 ppm1      1.430 ppm2      7.672 CV     1
 ASSI {  778}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 120  and name H   ))
      4.100     2.100     1.900 peak   778 spectrum    1 weight  0.10000E+01 volume  0.12491E-02 ppm1      1.428 ppm2      7.548 CV     1
 ASSI {  780}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 116  and name H   ))
      4.500     2.500     1.500 peak   780 spectrum    1 weight  0.10000E+01 volume  0.12051E-02 ppm1      1.427 ppm2      8.352 CV     1
 ASSI {  781}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 117  and name HA  ))
      2.100     0.600     0.600 peak   781 spectrum    1 weight  0.10000E+01 volume  0.21394E-01 ppm1      1.429 ppm2      4.074 CV     1
 ASSI {  782}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 114  and name HA  ))
      2.700     0.900     0.900 peak   782 spectrum    1 weight  0.10000E+01 volume  0.56057E-02 ppm1      1.430 ppm2      3.834 CV     1
 ASSI {  783}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 114  and name HA  ))
      4.900     3.000     1.100 peak   783 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      4.073 ppm2      3.836 CV     1
 ASSI {  784}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 120  and name HA2 ))
      3.600     1.600     1.600 peak   784 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      4.078 ppm2      3.682 CV     1
 ASSI {  785}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 113  and name HA  ))
      2.600     2.600     3.400 peak   785 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      1.427 ppm2      3.579 CV     1
 ASSI {  786}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 118  and name HD3 ))
      3.500     1.500     1.500 peak   786 spectrum    1 weight  0.10000E+01 volume  0.11272E-02 ppm1      1.427 ppm2      3.156 CV     1
 OR {  786}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 118  and name HD2 ))
 ASSI {  787}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 116  and name HB3 ))
      4.800     2.900     1.200 peak   787 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      1.430 ppm2      2.821 CV     1
 ASSI {  788}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 118  and name HG2 ))
      3.900     1.900     1.900 peak   788 spectrum    1 weight  0.10000E+01 volume  0.10528E-02 ppm1      1.432 ppm2      1.623 CV     1
 ASSI {  791}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      3.300     1.300     1.300 peak   791 spectrum    1 weight  0.10000E+01 volume  0.15131E-02 ppm1      3.756 ppm2      0.741 CV     1
 ASSI {  796}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 121  and name HB  ))
      3.000     1.200     1.200 peak   796 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      2.973 ppm2      1.219 CV     1
 ASSI {  797}
   (( segid "    " and resid 116  and name HB3 ))
   (( segid "    " and resid 121  and name HB  ))
      4.300     2.300     1.700 peak   797 spectrum    1 weight  0.10000E+01 volume  0.61269E-03 ppm1      2.810 ppm2      1.216 CV     1
 ASSI {  799}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
      3.100     1.200     1.200 peak   799 spectrum    1 weight  0.10000E+01 volume  0.11374E-02 ppm1      3.746 ppm2      2.995 CV     1
 ASSI {  800}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB3 ))
      3.300     1.300     1.300 peak   800 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      3.750 ppm2      2.822 CV     1
 ASSI {  801}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HB3 ))
      2.800     1.000     1.000 peak   801 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      2.994 ppm2      2.805 CV     1
 ASSI {  807}
   (  segid "    " and resid 115  and name HD1%)
   (  segid "    " and resid 111  and name HE% )
      3.500     1.600     1.600 peak   807 spectrum    1 weight  0.10000E+01 volume  0.25795E-02 ppm1      0.642 ppm2      1.950 CV     1
 ASSI {  808}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 115  and name HB  ))
      2.200     0.600     0.600 peak   808 spectrum    1 weight  0.10000E+01 volume  0.68379E-02 ppm1      0.642 ppm2      1.735 CV     1
 ASSI {  809}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 112  and name HG  ))
      3.800     1.800     1.800 peak   809 spectrum    1 weight  0.10000E+01 volume  0.24576E-02 ppm1      0.643 ppm2      1.514 CV     1
 ASSI {  810}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 90   and name HG13))
      2.100     0.500     0.500 peak   810 spectrum    1 weight  0.10000E+01 volume  0.33444E-02 ppm1      0.642 ppm2      1.188 CV     1
 ASSI {  811}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name HB  ))
      2.200     0.600     0.600 peak   811 spectrum    1 weight  0.10000E+01 volume  0.67397E-02 ppm1      0.727 ppm2      1.742 CV     1
 ASSI {  812}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 8    and name HG13))
      2.200     0.600     0.600 peak   812 spectrum    1 weight  0.10000E+01 volume  0.76233E-02 ppm1      0.736 ppm2      1.658 CV     1
 ASSI {  813}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 32   and name HG13))
      3.700     1.700     1.700 peak   813 spectrum    1 weight  0.10000E+01 volume  0.22206E-02 ppm1      0.737 ppm2      1.007 CV     1
 OR {  813}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 32   and name HG12))
 ASSI {  814}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 10   and name HG13))
      2.100     0.500     0.500 peak   814 spectrum    1 weight  0.10000E+01 volume  0.59543E-02 ppm1      0.753 ppm2      1.591 CV     1
 ASSI {  815}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 119  and name HG13))
      2.300     0.600     0.600 peak   815 spectrum    1 weight  0.10000E+01 volume  0.12863E-01 ppm1      0.767 ppm2      1.259 CV     1
 OR {  815}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 119  and name HG12))
 ASSI {  816}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      3.100     1.200     1.200 peak   816 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      3.374 ppm2      1.163 CV     1
 ASSI {  817}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 118  and name HB3 ))
      4.700     2.700     1.300 peak   817 spectrum    1 weight  0.10000E+01 volume  0.93429E-03 ppm1      3.372 ppm2      1.894 CV     1
 ASSI {  819}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 118  and name HG2 ))
      2.300     0.700     0.700 peak   819 spectrum    1 weight  0.10000E+01 volume  0.16452E-02 ppm1      3.374 ppm2      1.634 CV     1
 ASSI {  822}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
      2.400     0.700     0.700 peak   822 spectrum    1 weight  0.10000E+01 volume  0.50979E-02 ppm1      3.376 ppm2      0.652 CV     1
 OR {  822}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI {  823}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 112  and name HA  ))
      3.400     1.500     1.500 peak   823 spectrum    1 weight  0.10000E+01 volume  0.92413E-03 ppm1      1.748 ppm2      3.834 CV     1
 ASSI {  824}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 115  and name HA  ))
      3.300     1.400     1.400 peak   824 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.737 ppm2      3.370 CV     1
 ASSI {  825}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 112  and name HA  ))
      2.200     0.600     0.600 peak   825 spectrum    1 weight  0.10000E+01 volume  0.40114E-02 ppm1      0.643 ppm2      3.838 CV     1
 ASSI {  826}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 115  and name HA  ))
      3.600     1.700     1.700 peak   826 spectrum    1 weight  0.10000E+01 volume  0.25998E-02 ppm1      0.643 ppm2      3.376 CV     1
 ASSI {  827}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name HA  ))
      2.200     0.600     0.600 peak   827 spectrum    1 weight  0.10000E+01 volume  0.49118E-02 ppm1      0.726 ppm2      3.372 CV     1
 ASSI {  828}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 112  and name HA  ))
      4.200     2.200     1.800 peak   828 spectrum    1 weight  0.10000E+01 volume  0.23425E-02 ppm1      0.727 ppm2      3.839 CV     1
 ASSI {  830}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 114  and name HA  ))
      3.700     1.700     1.700 peak   830 spectrum    1 weight  0.10000E+01 volume  0.86319E-03 ppm1      3.369 ppm2      3.838 CV     1
 ASSI {  831}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 114  and name HB  ))
      3.900     1.900     1.900 peak   831 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      3.367 ppm2      4.235 CV     1
 ASSI {  832}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 114  and name HB  ))
      4.000     2.000     2.000 peak   832 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      0.645 ppm2      4.256 CV     1
 ASSI {  833}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 114  and name H   ))
      4.300     2.300     1.700 peak   833 spectrum    1 weight  0.10000E+01 volume  0.97153E-03 ppm1      0.645 ppm2      7.468 CV     1
 ASSI {  834}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 115  and name H   ))
      2.900     1.000     1.000 peak   834 spectrum    1 weight  0.10000E+01 volume  0.12796E-02 ppm1      3.375 ppm2      8.532 CV     1
 ASSI {  835}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 116  and name H   ))
      3.400     1.500     1.500 peak   835 spectrum    1 weight  0.10000E+01 volume  0.90721E-03 ppm1      3.382 ppm2      8.348 CV     1
 ASSI {  837}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 115  and name H   ))
      3.100     1.200     1.200 peak   837 spectrum    1 weight  0.10000E+01 volume  0.31684E-02 ppm1      0.644 ppm2      8.534 CV     1
 ASSI {  838}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 116  and name H   ))
      4.000     2.000     2.000 peak   838 spectrum    1 weight  0.10000E+01 volume  0.13913E-02 ppm1      0.642 ppm2      8.350 CV     1
 ASSI {  839}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 112  and name H   ))
      3.800     1.800     1.800 peak   839 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      0.645 ppm2      8.772 CV     1
 ASSI {  840}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 115  and name H   ))
      3.600     1.600     1.600 peak   840 spectrum    1 weight  0.10000E+01 volume  0.93090E-03 ppm1      3.837 ppm2      8.528 CV     1
 ASSI {  844}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 117  and name H   ))
      4.500     2.600     1.500 peak   844 spectrum    1 weight  0.10000E+01 volume  0.59577E-03 ppm1      4.251 ppm2      7.767 CV     1
 ASSI {  846}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 115  and name H   ))
      2.800     1.000     1.000 peak   846 spectrum    1 weight  0.10000E+01 volume  0.21022E-02 ppm1      4.241 ppm2      8.536 CV     1
 ASSI {  847}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 116  and name H   ))
      4.800     2.800     1.200 peak   847 spectrum    1 weight  0.10000E+01 volume  0.69395E-03 ppm1      4.239 ppm2      8.357 CV     1
 ASSI {  848}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 117  and name H   ))
      3.800     1.800     1.800 peak   848 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      1.160 ppm2      7.776 CV     1
 ASSI {  849}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 118  and name H   ))
      4.100     2.100     1.900 peak   849 spectrum    1 weight  0.10000E+01 volume  0.17704E-02 ppm1      1.154 ppm2      7.675 CV     1
 ASSI {  850}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name H   ))
      3.500     1.500     1.500 peak   850 spectrum    1 weight  0.10000E+01 volume  0.46242E-02 ppm1      1.163 ppm2      7.466 CV     1
 ASSI {  852}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 116  and name H   ))
      3.700     1.700     1.700 peak   852 spectrum    1 weight  0.10000E+01 volume  0.14725E-02 ppm1      1.161 ppm2      8.339 CV     1
 ASSI {  853}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HB  ))
      3.100     1.200     1.200 peak   853 spectrum    1 weight  0.10000E+01 volume  0.20243E-02 ppm1      3.840 ppm2      4.247 CV     1
 ASSI {  855}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 111  and name HA  ))
      3.100     1.200     1.200 peak   855 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      4.246 ppm2      4.016 CV     1
 ASSI {  856}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name HA  ))
      2.200     0.600     0.600 peak   856 spectrum    1 weight  0.10000E+01 volume  0.12701E-01 ppm1      1.164 ppm2      3.834 CV     1
 ASSI {  857}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 111  and name HA  ))
      4.000     2.000     2.000 peak   857 spectrum    1 weight  0.10000E+01 volume  0.20480E-02 ppm1      1.158 ppm2      4.019 CV     1
 ASSI {  861}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
      4.500     2.500     1.500 peak   861 spectrum    1 weight  0.10000E+01 volume  0.95799E-03 ppm1      3.836 ppm2      1.899 CV     1
 ASSI {  862}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 113  and name HB3 ))
      3.800     1.800     1.800 peak   862 spectrum    1 weight  0.10000E+01 volume  0.67025E-03 ppm1      3.843 ppm2      1.751 CV     1
 ASSI {  863}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 113  and name HB2 ))
      4.900     3.000     1.100 peak   863 spectrum    1 weight  0.10000E+01 volume  0.96137E-03 ppm1      4.239 ppm2      1.903 CV     1
 ASSI {  865}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 118  and name HG3 ))
      3.000     1.200     1.200 peak   865 spectrum    1 weight  0.10000E+01 volume  0.44479E-02 ppm1      1.161 ppm2      1.762 CV     1
 ASSI {  866}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 118  and name HG2 ))
      3.000     1.100     1.100 peak   866 spectrum    1 weight  0.10000E+01 volume  0.45327E-02 ppm1      1.163 ppm2      1.631 CV     1
 ASSI {  867}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 117  and name HB% )
      3.200     1.300     1.300 peak   867 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      1.163 ppm2      1.429 CV     1
 ASSI {  872}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 115  and name H   ))
      3.100     1.200     1.200 peak   872 spectrum    1 weight  0.10000E+01 volume  0.10731E-02 ppm1      3.846 ppm2      8.534 CV     1
 ASSI {  875}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name H   ))
      2.400     0.700     0.700 peak   875 spectrum    1 weight  0.10000E+01 volume  0.20378E-02 ppm1      1.640 ppm2      8.743 CV     1
 ASSI {  876}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 129  and name H   ))
      3.300     1.400     1.400 peak   876 spectrum    1 weight  0.10000E+01 volume  0.31144E-02 ppm1      0.746 ppm2      8.875 CV     1
 ASSI {  877}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 112  and name H   ))
      3.300     1.300     1.300 peak   877 spectrum    1 weight  0.10000E+01 volume  0.43533E-02 ppm1      0.749 ppm2      8.747 CV     1
 ASSI {  878}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 74   and name H   ))
      3.700     1.700     1.700 peak   878 spectrum    1 weight  0.10000E+01 volume  0.23628E-02 ppm1      0.698 ppm2      8.917 CV     1
 ASSI {  879}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 4    and name H   ))
      2.800     1.000     1.000 peak   879 spectrum    1 weight  0.10000E+01 volume  0.36695E-02 ppm1      0.695 ppm2      8.734 CV     1
 ASSI {  880}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 5    and name H   ))
      3.100     1.200     1.200 peak   880 spectrum    1 weight  0.10000E+01 volume  0.46138E-02 ppm1      0.697 ppm2      8.648 CV     1
 ASSI {  881}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 91   and name H   ))
      3.500     1.500     1.500 peak   881 spectrum    1 weight  0.10000E+01 volume  0.20751E-02 ppm1      0.696 ppm2      9.213 CV     1
 ASSI {  886}
   (( segid "    " and resid 112  and name HB3 ))
   (( segid "    " and resid 113  and name H   ))
      2.900     1.100     1.100 peak   886 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      1.785 ppm2      7.637 CV     1
 ASSI {  887}
   (  segid "    " and resid 49   and name HD1%)
   (  segid "    " and resid 19   and name HD% )
      4.300     2.300     1.700 peak   887 spectrum    1 weight  0.10000E+01 volume  0.13744E-02 ppm1      0.748 ppm2      7.069 CV     1
 ASSI {  888}
   (  segid "    " and resid 49   and name HD1%)
   (  segid "    " and resid 81   and name HD% )
      4.000     2.000     2.000 peak   888 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      0.745 ppm2      6.821 CV     1
 ASSI {  889}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 113  and name H   ))
      3.700     1.800     1.800 peak   889 spectrum    1 weight  0.10000E+01 volume  0.92075E-03 ppm1      1.635 ppm2      7.639 CV     1
 ASSI {  890}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 191  and name HA  ))
      3.100     1.200     1.200 peak   890 spectrum    1 weight  0.10000E+01 volume  0.32126E-02 ppm1      0.701 ppm2      4.880 CV     1
 ASSI {  891}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 53   and name HA  ))
      3.000     3.000     3.000 peak   891 spectrum    1 weight  0.10000E+01 volume  0.39538E-02 ppm1      0.747 ppm2      4.611 CV     1
 ASSI {  894}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HA  ))
      2.900     1.000     1.000 peak   894 spectrum    1 weight  0.10000E+01 volume  0.13033E-02 ppm1      1.634 ppm2      3.833 CV     1
 ASSI {  895}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 112  and name HA  ))
      3.300     1.400     1.400 peak   895 spectrum    1 weight  0.10000E+01 volume  0.67330E-02 ppm1      0.682 ppm2      3.834 CV     1
 ASSI {  896}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 112  and name HA  ))
      2.100     0.500     0.500 peak   896 spectrum    1 weight  0.10000E+01 volume  0.79890E-02 ppm1      0.749 ppm2      3.842 CV     1
 ASSI {  897}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 52   and name HB2 ))
      4.100     2.100     1.900 peak   897 spectrum    1 weight  0.10000E+01 volume  0.18686E-02 ppm1      0.747 ppm2      3.670 CV     1
 OR {  897}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 52   and name HB3 ))
 ASSI {  898}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 113  and name HA  ))
      4.400     2.400     1.600 peak   898 spectrum    1 weight  0.10000E+01 volume  0.14116E-02 ppm1      0.750 ppm2      3.597 CV     1
 ASSI {  900}
   (  segid "    " and resid 171  and name HD1%)
   (( segid "    " and resid 171  and name HA  ))
      3.200     1.300     1.300 peak   900 spectrum    1 weight  0.10000E+01 volume  0.92853E-02 ppm1      0.696 ppm2      4.111 CV     1
 ASSI {  902}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 29   and name HB2 ))
      3.100     1.200     1.200 peak   902 spectrum    1 weight  0.10000E+01 volume  0.16418E-02 ppm1      0.745 ppm2      2.949 CV     1
 ASSI {  903}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 111  and name HG2 ))
      3.700     1.700     1.700 peak   903 spectrum    1 weight  0.10000E+01 volume  0.20311E-02 ppm1      0.746 ppm2      2.614 CV     1
 ASSI {  905}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 77   and name HB3 ))
      2.900     1.000     1.000 peak   905 spectrum    1 weight  0.10000E+01 volume  0.18246E-02 ppm1      0.700 ppm2      2.432 CV     1
 ASSI {  906}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 81   and name HB2 ))
      4.200     2.200     1.800 peak   906 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      0.743 ppm2      2.421 CV     1
 ASSI {  907}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 127  and name HB3 ))
      2.500     0.800     0.800 peak   907 spectrum    1 weight  0.10000E+01 volume  0.34191E-02 ppm1      0.682 ppm2      2.801 CV     1
 OR {  907}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  908}
   (( segid "    " and resid 180  and name HA  ))
   (( segid "    " and resid 183  and name HG2 ))
      4.500     2.600     1.500 peak   908 spectrum    1 weight  0.10000E+01 volume  0.75489E-03 ppm1      3.840 ppm2      2.246 CV     1
 ASSI {  913}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 113  and name HB2 ))
      4.900     3.100     1.100 peak   913 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      1.638 ppm2      1.893 CV     1
 ASSI {  914}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HB3 ))
      1.800     0.400     0.400 peak   914 spectrum    1 weight  0.10000E+01 volume  0.37778E-02 ppm1      1.640 ppm2      1.773 CV     1
 ASSI {  917}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HG  ))
      2.900     1.100     1.100 peak   917 spectrum    1 weight  0.10000E+01 volume  0.27792E-02 ppm1      1.648 ppm2      1.503 CV     1
 ASSI {  918}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 112  and name HB3 ))
      2.200     0.600     0.600 peak   918 spectrum    1 weight  0.10000E+01 volume  0.88689E-02 ppm1      0.684 ppm2      1.768 CV     1
 ASSI {  919}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 49   and name HG  ))
      1.900     0.400     0.400 peak   919 spectrum    1 weight  0.10000E+01 volume  0.13848E-01 ppm1      0.748 ppm2      1.770 CV     1
 ASSI {  920}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 112  and name HB2 ))
      2.100     0.600     0.600 peak   920 spectrum    1 weight  0.10000E+01 volume  0.10125E-01 ppm1      0.748 ppm2      1.638 CV     1
 ASSI {  925}
   (( segid "    " and resid 112  and name HB2 ))
   (  segid "    " and resid 112  and name HD2%)
      2.800     1.000     1.000 peak   925 spectrum    1 weight  0.10000E+01 volume  0.23323E-02 ppm1      1.645 ppm2      0.677 CV     1
 ASSI {  927}
   (( segid "    " and resid 112  and name HB3 ))
   (  segid "    " and resid 112  and name HD1%)
      3.500     1.600     1.600 peak   927 spectrum    1 weight  0.10000E+01 volume  0.23933E-02 ppm1      1.778 ppm2      0.745 CV     1
 ASSI {  929}
   (  segid "    " and resid 49   and name HD1%)
   (  segid "    " and resid 68   and name HD2%)
      2.600     0.800     0.800 peak   929 spectrum    1 weight  0.10000E+01 volume  0.37811E-02 ppm1      0.744 ppm2      0.294 CV     1
 OR {  929}
   (  segid "    " and resid 49   and name HD1%)
   (  segid "    " and resid 68   and name HD1%)
 ASSI {  930}
   (  segid "    " and resid 51   and name HD2%)
   (  segid "    " and resid 62   and name HD2%)
      3.100     1.200     1.200 peak   930 spectrum    1 weight  0.10000E+01 volume  0.69599E-02 ppm1      0.729 ppm2     -0.161 CV     1
 ASSI {  931}
   (  segid "    " and resid 112  and name HD1%)
   (  segid "    " and resid 108  and name HG1%)
      2.800     1.000     1.000 peak   931 spectrum    1 weight  0.10000E+01 volume  0.44244E-02 ppm1      0.754 ppm2      0.497 CV     1
 ASSI {  932}
   (  segid "    " and resid 112  and name HD2%)
   (  segid "    " and resid 108  and name HG1%)
      3.200     1.300     1.300 peak   932 spectrum    1 weight  0.10000E+01 volume  0.83578E-02 ppm1      0.688 ppm2      0.483 CV     1
 ASSI {  935}
   (( segid "    " and resid 109  and name HB  ))
   (( segid "    " and resid 109  and name H   ))
      2.700     0.900     0.900 peak   935 spectrum    1 weight  0.10000E+01 volume  0.26776E-02 ppm1      4.011 ppm2      8.765 CV     1
 ASSI {  936}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 111  and name H   ))
      4.100     2.100     1.900 peak   936 spectrum    1 weight  0.10000E+01 volume  0.15199E-02 ppm1      1.205 ppm2      8.408 CV     1
 ASSI {  938}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 113  and name H   ))
      3.800     1.800     1.800 peak   938 spectrum    1 weight  0.10000E+01 volume  0.12220E-02 ppm1      1.205 ppm2      7.645 CV     1
 ASSI {  939}
   (( segid "    " and resid 109  and name HB  ))
   (( segid "    " and resid 110  and name H   ))
      2.700     0.900     0.900 peak   939 spectrum    1 weight  0.10000E+01 volume  0.19972E-02 ppm1      4.015 ppm2      7.010 CV     1
 ASSI {  940}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 110  and name H   ))
      3.000     1.100     1.100 peak   940 spectrum    1 weight  0.10000E+01 volume  0.63606E-02 ppm1      1.205 ppm2      7.009 CV     1
 ASSI {  941}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 178  and name HA  ))
      4.100     2.100     1.900 peak   941 spectrum    1 weight  0.10000E+01 volume  0.24068E-02 ppm1      1.175 ppm2      4.870 CV     1
 ASSI {  942}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 179  and name HB  ))
      2.200     0.600     0.600 peak   942 spectrum    1 weight  0.10000E+01 volume  0.97016E-02 ppm1      1.175 ppm2      4.714 CV     1
 ASSI {  943}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 179  and name HA  ))
      3.000     1.100     1.100 peak   943 spectrum    1 weight  0.10000E+01 volume  0.63877E-02 ppm1      1.176 ppm2      4.583 CV     1
 ASSI {  945}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 109  and name HB  ))
      2.100     0.600     0.600 peak   945 spectrum    1 weight  0.10000E+01 volume  0.14607E-01 ppm1      1.206 ppm2      4.011 CV     1
 ASSI {  946}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 109  and name HA  ))
      2.200     0.600     0.600 peak   946 spectrum    1 weight  0.10000E+01 volume  0.10142E-01 ppm1      1.205 ppm2      3.777 CV     1
 ASSI {  948}
   (( segid "    " and resid 109  and name HB  ))
   (( segid "    " and resid 109  and name HA  ))
      3.000     1.100     1.100 peak   948 spectrum    1 weight  0.10000E+01 volume  0.21834E-02 ppm1      4.014 ppm2      3.778 CV     1
 ASSI {  949}
   (( segid "    " and resid 109  and name HB  ))
   (( segid "    " and resid 176  and name HB3 ))
      4.500     2.600     1.500 peak   949 spectrum    1 weight  0.10000E+01 volume  0.64316E-03 ppm1      4.020 ppm2      3.542 CV     1
 ASSI {  950}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 176  and name HB3 ))
      4.300     2.300     1.700 peak   950 spectrum    1 weight  0.10000E+01 volume  0.11746E-02 ppm1      1.206 ppm2      3.520 CV     1
 ASSI {  952}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 182  and name HG2 ))
      3.500     1.500     1.500 peak   952 spectrum    1 weight  0.10000E+01 volume  0.20243E-02 ppm1      1.205 ppm2      2.606 CV     1
 ASSI {  954}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 182  and name HB3 ))
      2.600     0.900     0.900 peak   954 spectrum    1 weight  0.10000E+01 volume  0.29180E-02 ppm1      1.205 ppm2      2.302 CV     1
 ASSI {  955}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 112  and name HB3 ))
      3.700     1.700     1.700 peak   955 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      3.777 ppm2      1.774 CV     1
 ASSI {  956}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 112  and name HB2 ))
      3.200     1.300     1.300 peak   956 spectrum    1 weight  0.10000E+01 volume  0.86658E-03 ppm1      3.779 ppm2      1.632 CV     1
 ASSI {  957}
   (  segid "    " and resid 109  and name HG2%)
   (  segid "    " and resid 113  and name HE% )
      3.300     1.400     1.400 peak   957 spectrum    1 weight  0.10000E+01 volume  0.31821E-02 ppm1      1.201 ppm2      1.768 CV     1
 ASSI {  958}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 112  and name HB2 ))
      3.600     1.600     1.600 peak   958 spectrum    1 weight  0.10000E+01 volume  0.22172E-02 ppm1      1.196 ppm2      1.678 CV     1
 ASSI {  961}
   (( segid "    " and resid 109  and name HA  ))
   (  segid "    " and resid 112  and name HD2%)
      4.000     2.000     2.000 peak   961 spectrum    1 weight  0.10000E+01 volume  0.13371E-02 ppm1      3.779 ppm2      0.676 CV     1
 ASSI {  964}
   (  segid "    " and resid 109  and name HG2%)
   (  segid "    " and resid 112  and name HD2%)
      3.700     1.700     1.700 peak   964 spectrum    1 weight  0.10000E+01 volume  0.25795E-02 ppm1      1.201 ppm2      0.691 CV     1
 ASSI {  967}
   (( segid "    " and resid 108  and name HA  ))
   (  segid "    " and resid 180  and name HD1%)
      4.500     2.500     1.500 peak   967 spectrum    1 weight  0.10000E+01 volume  0.10968E-02 ppm1      3.451 ppm2      0.734 CV     1
 ASSI {  968}
   (( segid "    " and resid 108  and name HA  ))
   (  segid "    " and resid 174  and name HD1%)
      4.000     2.000     2.000 peak   968 spectrum    1 weight  0.10000E+01 volume  0.11949E-02 ppm1      3.456 ppm2      0.655 CV     1
 ASSI {  970}
   (( segid "    " and resid 108  and name HA  ))
   (  segid "    " and resid 107  and name HG2%)
      5.000     3.200     1.000 peak   970 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      3.454 ppm2      1.205 CV     1
 ASSI {  971}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 106  and name HD3 ))
      4.100     2.100     1.900 peak   971 spectrum    1 weight  0.10000E+01 volume  0.67025E-03 ppm1      3.458 ppm2      1.509 CV     1
 ASSI {  972}
   (( segid "    " and resid 108  and name HA  ))
   (  segid "    " and resid 111  and name HE% )
      2.800     1.000     1.000 peak   972 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      3.458 ppm2      1.999 CV     1
 OR {  972}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 111  and name HB3 ))
 ASSI {  974}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 111  and name HB2 ))
      3.300     1.400     1.400 peak   974 spectrum    1 weight  0.10000E+01 volume  0.14285E-02 ppm1      3.454 ppm2      1.724 CV     1
 ASSI {  978}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 113  and name HB2 ))
      2.100     0.600     0.600 peak   978 spectrum    1 weight  0.10000E+01 volume  0.97187E-02 ppm1      2.302 ppm2      1.904 CV     1
 ASSI {  979}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 113  and name HG2 ))
      1.800     0.400     0.400 peak   979 spectrum    1 weight  0.10000E+01 volume  0.14106E-01 ppm1      2.300 ppm2      1.746 CV     1
 OR {  979}
   (( segid "    " and resid 113  and name HG3 ))
   (  segid "    " and resid 113  and name HE% )
 ASSI {  980}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HB  ))
      3.100     1.200     1.200 peak   980 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      3.450 ppm2      2.296 CV     1
 ASSI {  982}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 113  and name HA  ))
      2.800     1.000     1.000 peak   982 spectrum    1 weight  0.10000E+01 volume  0.26234E-02 ppm1      2.301 ppm2      3.594 CV     1
 ASSI {  983}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 107  and name HA  ))
      3.900     1.900     1.900 peak   983 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      3.458 ppm2      3.794 CV     1
 ASSI {  984}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 111  and name HA  ))
      4.800     2.900     1.200 peak   984 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      3.457 ppm2      4.006 CV     1
 ASSI {  985}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 110  and name HA  ))
      4.100     2.100     1.900 peak   985 spectrum    1 weight  0.10000E+01 volume  0.18618E-02 ppm1      2.305 ppm2      4.376 CV     1
 ASSI {  988}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name H   ))
      3.000     1.100     1.100 peak   988 spectrum    1 weight  0.10000E+01 volume  0.96476E-03 ppm1      3.457 ppm2      7.902 CV     1
 ASSI {  989}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 113  and name H   ))
      3.600     1.600     1.600 peak   989 spectrum    1 weight  0.10000E+01 volume  0.36729E-02 ppm1      2.301 ppm2      7.639 CV     1
 ASSI {  992}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 180  and name H   ))
      4.100     2.100     1.900 peak   992 spectrum    1 weight  0.10000E+01 volume  0.16079E-02 ppm1      0.932 ppm2      8.964 CV     1
 ASSI {  994}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 175  and name H   ))
      4.100     2.100     1.900 peak   994 spectrum    1 weight  0.10000E+01 volume  0.89705E-03 ppm1      0.935 ppm2      9.107 CV     1
 ASSI {  995}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 108  and name H   ))
      2.200     0.600     0.600 peak   995 spectrum    1 weight  0.10000E+01 volume  0.47663E-02 ppm1      0.931 ppm2      7.902 CV     1
 ASSI {  996}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 183  and name HE22))
      2.800     1.000     1.000 peak   996 spectrum    1 weight  0.10000E+01 volume  0.24407E-02 ppm1      0.932 ppm2      7.282 CV     1
 ASSI {  997}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 178  and name H   ))
      3.300     1.400     1.400 peak   997 spectrum    1 weight  0.10000E+01 volume  0.13980E-02 ppm1      0.929 ppm2      7.020 CV     1
 ASSI {  998}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 176  and name HD2 ))
      4.500     2.500     1.500 peak   998 spectrum    1 weight  0.10000E+01 volume  0.90044E-03 ppm1      0.935 ppm2      6.917 CV     1
 ASSI {  999}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 183  and name HE21))
      3.400     1.500     1.500 peak   999 spectrum    1 weight  0.10000E+01 volume  0.20717E-02 ppm1      0.931 ppm2      6.498 CV     1
 ASSI { 1000}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 92   and name HA  ))
      3.500     1.600     1.600 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.20717E-02 ppm1      0.931 ppm2      4.584 CV     1
 ASSI { 1001}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 107  and name HB  ))
      4.200     2.200     1.800 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.18787E-02 ppm1      0.932 ppm2      4.426 CV     1
 ASSI { 1002}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 176  and name HA  ))
      2.700     0.900     0.900 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.37744E-02 ppm1      0.931 ppm2      4.255 CV     1
 ASSI { 1003}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 108  and name HA  ))
      2.300     0.700     0.700 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.61879E-02 ppm1      0.931 ppm2      3.456 CV     1
 ASSI { 1007}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 108  and name HB  ))
      2.300     0.600     0.600 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.48169E-02 ppm1      0.931 ppm2      2.311 CV     1
 ASSI { 1010}
   (  segid "    " and resid 108  and name HG2%)
   (  segid "    " and resid 174  and name HD1%)
      2.300     0.700     0.700 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.10152E-01 ppm1      0.930 ppm2      0.665 CV     1
 ASSI { 1011}
   (  segid "    " and resid 108  and name HG2%)
   (  segid "    " and resid 180  and name HD2%)
      2.200     0.600     0.600 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.96915E-02 ppm1      0.931 ppm2      0.604 CV     1
 ASSI { 1012}
   (  segid "    " and resid 108  and name HG2%)
   (  segid "    " and resid 108  and name HG1%)
      2.100     0.500     0.500 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.14238E-01 ppm1      0.931 ppm2      0.494 CV     1
 ASSI { 1013}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 179  and name H   ))
      3.500     1.600     1.600 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.14590E-02 ppm1      1.206 ppm2      9.375 CV     1
 ASSI { 1015}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 107  and name H   ))
      2.600     0.800     0.800 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.69971E-02 ppm1      1.207 ppm2      8.522 CV     1
 ASSI { 1017}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 109  and name H   ))
      4.800     2.800     1.200 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      3.781 ppm2      8.767 CV     1
 ASSI { 1018}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 108  and name H   ))
      3.600     1.600     1.600 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.39742E-02 ppm1      1.208 ppm2      7.904 CV     1
 ASSI { 1019}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 108  and name H   ))
      3.000     1.200     1.200 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.16282E-02 ppm1      3.794 ppm2      7.908 CV     1
 ASSI { 1020}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 178  and name H   ))
      3.200     1.300     1.300 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.23594E-02 ppm1      1.207 ppm2      7.015 CV     1
 ASSI { 1021}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 179  and name HB  ))
      4.100     2.100     1.900 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      3.788 ppm2      4.711 CV     1
 ASSI { 1022}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 179  and name HA  ))
      3.100     1.200     1.200 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      3.791 ppm2      4.582 CV     1
 ASSI { 1023}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HB  ))
      3.000     1.100     1.100 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      3.788 ppm2      4.429 CV     1
 ASSI { 1024}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 178  and name HA  ))
      3.100     1.200     1.200 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.25895E-02 ppm1      1.208 ppm2      4.877 CV     1
 ASSI { 1025}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 179  and name HA  ))
      3.100     1.200     1.200 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.25016E-02 ppm1      1.210 ppm2      4.565 CV     1
 ASSI { 1026}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 107  and name HB  ))
      2.200     0.600     0.600 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.11371E-01 ppm1      1.208 ppm2      4.430 CV     1
 ASSI { 1027}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 109  and name HB  ))
      4.400     2.400     1.600 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.98169E-03 ppm1      1.213 ppm2      4.027 CV     1
 ASSI { 1028}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 107  and name HA  ))
      2.500     0.800     0.800 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.67397E-02 ppm1      1.208 ppm2      3.789 CV     1
 ASSI { 1030}
   (  segid "    " and resid 107  and name HG2%)
   (  segid "    " and resid 111  and name HE% )
      4.500     2.500     1.500 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.19938E-02 ppm1      1.207 ppm2      1.950 CV     1
 ASSI { 1031}
   (  segid "    " and resid 107  and name HG2%)
   (  segid "    " and resid 108  and name HG2%)
      4.800     2.800     1.200 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      1.211 ppm2      0.928 CV     1
 ASSI { 1032}
   (( segid "    " and resid 107  and name HA  ))
   (  segid "    " and resid 108  and name HG2%)
      4.200     2.200     1.800 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.92413E-03 ppm1      3.787 ppm2      0.934 CV     1
 ASSI { 1035}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name H   ))
      2.800     1.000     1.000 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.17704E-02 ppm1      4.664 ppm2      8.801 CV     1
 ASSI { 1036}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 103  and name H   ))
      2.300     0.700     0.700 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.41026E-02 ppm1      4.654 ppm2      8.059 CV     1
 ASSI { 1038}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 88   and name H   ))
      3.600     1.600     1.600 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.12186E-02 ppm1      0.732 ppm2      9.018 CV     1
 ASSI { 1039}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 102  and name H   ))
      2.200     0.600     0.600 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.51521E-02 ppm1      0.730 ppm2      8.821 CV     1
 ASSI { 1040}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 86   and name H   ))
      3.400     1.400     1.400 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.18483E-02 ppm1      0.729 ppm2      9.312 CV     1
 ASSI { 1041}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 101  and name H   ))
      2.600     2.600     3.400 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.90721E-03 ppm1      0.739 ppm2      8.373 CV     1
 ASSI { 1042}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 103  and name H   ))
      3.800     1.800     1.800 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.23053E-02 ppm1      0.731 ppm2      8.058 CV     1
 ASSI { 1045}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 102  and name HA  ))
      2.700     0.900     0.900 peak  1045 spectrum    1 weight  0.10000E+01 volume  0.41703E-02 ppm1      0.730 ppm2      4.649 CV     1
 ASSI { 1046}
   (( segid "    " and resid 102  and name HB  ))
   (( segid "    " and resid 102  and name HA  ))
      3.100     1.200     1.200 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.16282E-02 ppm1      1.967 ppm2      4.645 CV     1
 ASSI { 1048}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 111  and name HG2 ))
      3.400     1.400     1.400 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.16181E-02 ppm1      0.729 ppm2      2.602 CV     1
 ASSI { 1049}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 86   and name HD2 ))
      3.600     1.600     1.600 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.15233E-02 ppm1      0.729 ppm2      2.965 CV     1
 ASSI { 1050}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 86   and name HD3 ))
      3.000     1.100     1.100 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.17095E-02 ppm1      0.732 ppm2      2.909 CV     1
 ASSI { 1051}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 111  and name HG3 ))
      2.800     1.000     1.000 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.18280E-02 ppm1      0.732 ppm2      2.239 CV     1
 ASSI { 1052}
   (( segid "    " and resid 102  and name HB  ))
   (( segid "    " and resid 111  and name HG2 ))
      4.100     2.100     1.900 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      1.980 ppm2      2.585 CV     1
 ASSI { 1053}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 102  and name HB  ))
      2.100     0.600     0.600 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.10697E-01 ppm1      0.730 ppm2      1.951 CV     1
 ASSI { 1054}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 88   and name HB2 ))
      2.300     0.700     0.700 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.40553E-02 ppm1      0.730 ppm2      1.849 CV     1
 ASSI { 1056}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 86   and name HG3 ))
      2.100     2.100     3.900 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.28097E-02 ppm1      0.729 ppm2      1.490 CV     1
 OR { 1056}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 86   and name HG2 ))
 ASSI { 1057}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 88   and name HG  ))
      3.500     1.500     1.500 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.22274E-02 ppm1      0.731 ppm2      1.294 CV     1
 ASSI { 1058}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 88   and name HB3 ))
      3.100     1.200     1.200 peak  1058 spectrum    1 weight  0.10000E+01 volume  0.34935E-02 ppm1      0.730 ppm2      1.090 CV     1
 ASSI { 1059}
   (( segid "    " and resid 102  and name HB  ))
   (  segid "    " and resid 102  and name HG1%)
      2.400     0.700     0.700 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.54501E-02 ppm1      1.961 ppm2      0.736 CV     1
 OR { 1059}
   (( segid "    " and resid 102  and name HB  ))
   (  segid "    " and resid 102  and name HG2%)
 ASSI { 1060}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 102  and name HG1%)
      2.300     0.700     0.700 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.72069E-02 ppm1      4.659 ppm2      0.739 CV     1
 OR { 1060}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 102  and name HG2%)
 ASSI { 1061}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 100  and name HG12))
      2.500     0.800     0.800 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.30534E-02 ppm1      1.584 ppm2      1.249 CV     1
 ASSI { 1062}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 100  and name HG13))
      2.200     0.600     0.600 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.26676E-02 ppm1      1.586 ppm2      1.071 CV     1
 ASSI { 1063}
   (( segid "    " and resid 100  and name HB  ))
   (  segid "    " and resid 100  and name HG2%)
      2.200     0.600     0.600 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.72610E-02 ppm1      1.585 ppm2      0.675 CV     1
 OR { 1063}
   (( segid "    " and resid 100  and name HB  ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 1067}
   (( segid "    " and resid 100  and name HG13))
   (( segid "    " and resid 100  and name HG12))
      1.600     0.300     0.600 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.89638E-02 ppm1      1.068 ppm2      1.249 CV     1
 ASSI { 1068}
   (( segid "    " and resid -4   and name HG12))
   (  segid "    " and resid -4   and name HD1%)
      2.700     0.900     0.900 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.50371E-02 ppm1      1.073 ppm2      0.780 CV     1
 OR { 1068}
   (( segid "    " and resid -4   and name HG12))
   (  segid "    " and resid -4   and name HG2%)
 ASSI { 1069}
   (( segid "    " and resid 100  and name HG13))
   (  segid "    " and resid 100  and name HD1%)
      2.200     0.600     0.600 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.67769E-02 ppm1      1.071 ppm2      0.645 CV     1
 OR { 1069}
   (( segid "    " and resid 100  and name HG13))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 1070}
   (( segid "    " and resid 100  and name HG12))
   (  segid "    " and resid 100  and name HD1%)
      2.200     0.600     0.600 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.92142E-02 ppm1      1.252 ppm2      0.642 CV     1
 OR { 1070}
   (( segid "    " and resid 100  and name HG12))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 1071}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 100  and name HG12))
      2.700     0.900     0.900 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.97626E-02 ppm1      0.686 ppm2      1.251 CV     1
 ASSI { 1072}
   (  segid "    " and resid 100  and name HG2%)
   (  segid "    " and resid 114  and name HG2%)
      2.600     0.800     0.800 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.98742E-02 ppm1      0.686 ppm2      1.163 CV     1
 ASSI { 1073}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 100  and name HG13))
      2.300     0.600     0.600 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.87979E-02 ppm1      0.686 ppm2      1.071 CV     1
 ASSI { 1076}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 100  and name HB  ))
      1.800     0.400     0.400 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.15148E-01 ppm1      0.686 ppm2      1.588 CV     1
 ASSI { 1077}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HB  ))
      2.200     0.600     0.600 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.81311E-02 ppm1      0.660 ppm2      1.873 CV     1
 ASSI { 1078}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 118  and name HG3 ))
      2.900     1.000     1.000 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.70444E-02 ppm1      0.636 ppm2      1.762 CV     1
 ASSI { 1080}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 118  and name HG3 ))
      2.500     0.800     0.800 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.40654E-02 ppm1      0.687 ppm2      1.762 CV     1
 ASSI { 1081}
   (( segid "    " and resid 100  and name HG12))
   (( segid "    " and resid 118  and name HB3 ))
      4.900     3.000     1.100 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.10494E-02 ppm1      1.244 ppm2      1.904 CV     1
 OR { 1081}
   (( segid "    " and resid 100  and name HG12))
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 1082}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 118  and name HB3 ))
      4.200     2.200     1.800 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.10325E-02 ppm1      1.577 ppm2      1.894 CV     1
 ASSI { 1083}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 98   and name HE3 ))
      4.400     2.500     1.600 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.18110E-02 ppm1      0.635 ppm2      2.875 CV     1
 OR { 1083}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 98   and name HE2 ))
 ASSI { 1084}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 101  and name HG2 ))
      4.300     2.300     1.700 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.12796E-02 ppm1      0.636 ppm2      2.457 CV     1
 ASSI { 1085}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 115  and name HA  ))
      2.900     1.100     1.100 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.54059E-02 ppm1      0.635 ppm2      3.373 CV     1
 ASSI { 1086}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 118  and name HD2 ))
      3.000     1.100     1.100 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.32498E-02 ppm1      0.636 ppm2      3.156 CV     1
 OR { 1086}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 118  and name HD3 ))
 ASSI { 1087}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 115  and name HA  ))
      2.300     0.700     0.700 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.54840E-02 ppm1      0.686 ppm2      3.374 CV     1
 ASSI { 1088}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 118  and name HD2 ))
      4.000     2.000     2.000 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.29586E-02 ppm1      0.686 ppm2      3.154 CV     1
 ASSI { 1089}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 100  and name HA  ))
      2.700     0.900     0.900 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.84865E-02 ppm1      0.686 ppm2      4.272 CV     1
 ASSI { 1093}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 118  and name HA  ))
      4.800     2.900     1.200 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.17433E-02 ppm1      0.636 ppm2      4.097 CV     1
 ASSI { 1094}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 114  and name HA  ))
      4.400     2.400     1.600 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.18957E-02 ppm1      0.635 ppm2      3.839 CV     1
 ASSI { 1096}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 101  and name HA  ))
      3.500     1.600     1.600 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.16181E-02 ppm1      0.689 ppm2      4.883 CV     1
 ASSI { 1097}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 90   and name HA  ))
      2.300     0.700     0.700 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.50573E-02 ppm1      0.633 ppm2      5.052 CV     1
 ASSI { 1099}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 99   and name HA  ))
      4.200     2.300     1.800 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.73796E-03 ppm1      1.579 ppm2      4.927 CV     1
 ASSI { 1100}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 193  and name H   ))
      4.200     2.200     1.800 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      0.633 ppm2      7.895 CV     1
 ASSI { 1101}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 118  and name H   ))
      4.800     2.900     1.200 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.18821E-02 ppm1      0.637 ppm2      7.672 CV     1
 ASSI { 1102}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 115  and name H   ))
      3.900     1.900     1.900 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.21292E-02 ppm1      0.635 ppm2      8.529 CV     1
 ASSI { 1103}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 191  and name H   ))
      3.300     1.400     1.400 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.36762E-02 ppm1      0.633 ppm2      8.430 CV     1
 ASSI { 1104}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 101  and name H   ))
      2.500     0.800     0.800 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.32904E-02 ppm1      0.635 ppm2      8.333 CV     1
 ASSI { 1105}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 101  and name H   ))
      4.000     2.000     2.000 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      1.585 ppm2      8.325 CV     1
 ASSI { 1106}
   (( segid "    " and resid 100  and name HG12))
   (( segid "    " and resid 101  and name H   ))
      3.000     1.100     1.100 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      1.255 ppm2      8.319 CV     1
 ASSI { 1107}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 115  and name H   ))
      4.200     2.200     1.800 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.16722E-02 ppm1      0.685 ppm2      8.533 CV     1
 ASSI { 1108}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 101  and name H   ))
      2.900     1.100     1.100 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.70545E-02 ppm1      0.686 ppm2      8.326 CV     1
 ASSI { 1109}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 100  and name H   ))
      2.600     0.800     0.800 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.27115E-02 ppm1      0.686 ppm2      9.170 CV     1
 ASSI { 1110}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 88   and name H   ))
      3.800     1.800     1.800 peak  1110 spectrum    1 weight  0.10000E+01 volume  0.86658E-03 ppm1      0.686 ppm2      9.022 CV     1
 ASSI { 1111}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 102  and name H   ))
      3.800     1.800     1.800 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.14353E-02 ppm1      0.686 ppm2      8.812 CV     1
 ASSI { 1112}
   (( segid "    " and resid 100  and name HG12))
   (( segid "    " and resid 100  and name H   ))
      4.100     2.100     1.900 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      1.251 ppm2      9.167 CV     1
 ASSI { 1113}
   (( segid "    " and resid 100  and name HB  ))
   (( segid "    " and resid 100  and name H   ))
      2.800     0.900     0.900 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.20209E-02 ppm1      1.583 ppm2      9.175 CV     1
 ASSI { 1114}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 91   and name H   ))
      3.500     1.500     1.500 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.47053E-02 ppm1      0.634 ppm2      9.184 CV     1
 ASSI { 1115}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 192  and name H   ))
      4.100     2.100     1.900 peak  1115 spectrum    1 weight  0.10000E+01 volume  0.13980E-02 ppm1      0.634 ppm2      9.037 CV     1
 ASSI { 1116}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 90   and name H   ))
      3.200     1.300     1.300 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.34155E-02 ppm1      0.635 ppm2      8.806 CV     1
 ASSI { 1121}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 88   and name H   ))
      2.900     1.100     1.100 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.32056E-02 ppm1      0.907 ppm2      9.021 CV     1
 ASSI { 1129}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 100  and name HA  ))
      3.400     1.500     1.500 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      0.907 ppm2      4.281 CV     1
 ASSI { 1130}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 89   and name HA  ))
      2.900     1.000     1.000 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.16959E-02 ppm1      4.932 ppm2      4.629 CV     1
 ASSI { 1131}
   (( segid "    " and resid 99   and name HB  ))
   (( segid "    " and resid 98   and name HA  ))
      4.300     2.300     1.700 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.14217E-02 ppm1      3.832 ppm2      4.609 CV     1
 ASSI { 1132}
   (( segid "    " and resid 16   and name HB  ))
   (( segid "    " and resid 16   and name HA  ))
      3.100     1.200     1.200 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.20751E-02 ppm1      3.867 ppm2      4.953 CV     1
 ASSI { 1133}
   (( segid "    " and resid 99   and name HB  ))
   (( segid "    " and resid 99   and name HA  ))
      3.300     1.400     1.400 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.14387E-02 ppm1      3.837 ppm2      4.931 CV     1
 ASSI { 1134}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 99   and name HB  ))
      2.200     0.600     0.600 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.12880E-01 ppm1      0.908 ppm2      3.831 CV     1
 ASSI { 1136}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 87   and name HB3 ))
      2.400     0.700     0.700 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.78264E-02 ppm1      0.905 ppm2      1.901 CV     1
 ASSI { 1137}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 87   and name HB2 ))
      2.500     0.800     0.800 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.74674E-02 ppm1      0.906 ppm2      1.668 CV     1
 ASSI { 1138}
   (( segid "    " and resid 99   and name HB  ))
   (( segid "    " and resid 87   and name HB2 ))
      4.900     3.000     1.100 peak  1138 spectrum    1 weight  0.10000E+01 volume  0.78874E-03 ppm1      3.836 ppm2      1.653 CV     1
 ASSI { 1139}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 98   and name HG3 ))
      3.300     1.400     1.400 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.75150E-03 ppm1      4.922 ppm2      1.331 CV     1
 ASSI { 1140}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 7    and name HB3 ))
      3.900     1.900     1.900 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.91059E-03 ppm1      4.946 ppm2      1.323 CV     1
 ASSI { 1141}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 99   and name HG2%)
      2.700     0.900     0.900 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.37540E-02 ppm1      4.934 ppm2      0.909 CV     1
 ASSI { 1142}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
      4.200     2.200     1.800 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.10054E-02 ppm1      4.936 ppm2      0.711 CV     1
 ASSI { 1143}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 97   and name HG1%)
      3.200     1.300     1.300 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.25185E-02 ppm1      4.873 ppm2      0.818 CV     1
 ASSI { 1144}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 97   and name HG2%)
      2.800     1.000     1.000 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.27521E-02 ppm1      4.867 ppm2      0.690 CV     1
 ASSI { 1146}
   (( segid "    " and resid 97   and name HB  ))
   (  segid "    " and resid 97   and name HG2%)
      2.300     0.600     0.600 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.93362E-02 ppm1      1.810 ppm2      0.692 CV     1
 ASSI { 1149}
   (  segid "    " and resid 97   and name HG1%)
   (  segid "    " and resid 97   and name HG2%)
      2.100     0.500     0.500 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.26745E-01 ppm1      0.820 ppm2      0.692 CV     1
 ASSI { 1150}
   (  segid "    " and resid 97   and name HG1%)
   (  segid "    " and resid 96   and name HG2%)
      4.000     2.000     2.000 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.17400E-02 ppm1      0.821 ppm2      1.075 CV     1
 ASSI { 1151}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 97   and name HB  ))
      2.100     0.600     0.600 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.15602E-01 ppm1      0.820 ppm2      1.808 CV     1
 ASSI { 1152}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name HG3 ))
      3.000     1.100     1.100 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.77011E-02 ppm1      0.820 ppm2      1.365 CV     1
 ASSI { 1154}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 90   and name HB  ))
      4.100     2.100     1.900 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      4.866 ppm2      1.649 CV     1
 ASSI { 1155}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name HD3 ))
      4.200     2.200     1.800 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.16790E-02 ppm1      0.822 ppm2      3.172 CV     1
 ASSI { 1158}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 96   and name HB  ))
      4.000     2.000     2.000 peak  1158 spectrum    1 weight  0.10000E+01 volume  0.15944E-02 ppm1      0.820 ppm2      4.064 CV     1
 ASSI { 1162}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 98   and name HA  ))
      3.400     1.400     1.400 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.13066E-02 ppm1      0.822 ppm2      4.582 CV     1
 ASSI { 1163}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 97   and name HA  ))
      3.000     1.100     1.100 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      1.813 ppm2      4.867 CV     1
 ASSI { 1164}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name HH22))
      3.700     1.700     1.700 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      0.821 ppm2      6.817 CV     1
 ASSI { 1165}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name HE  ))
      4.000     2.000     2.000 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.12491E-02 ppm1      0.818 ppm2      7.985 CV     1
 ASSI { 1167}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 97   and name H   ))
      2.600     0.900     0.900 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.71493E-02 ppm1      0.820 ppm2      8.400 CV     1
 ASSI { 1168}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 98   and name H   ))
      3.000     1.100     1.100 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.40047E-02 ppm1      0.821 ppm2      9.135 CV     1
 ASSI { 1169}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 92   and name H   ))
      4.400     2.400     1.600 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.19329E-02 ppm1      0.820 ppm2      8.935 CV     1
 ASSI { 1170}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 90   and name H   ))
      3.800     1.800     1.800 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      0.819 ppm2      8.803 CV     1
 ASSI { 1171}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 98   and name H   ))
      2.400     0.700     0.700 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.32532E-02 ppm1      4.870 ppm2      9.138 CV     1
 ASSI { 1172}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 92   and name H   ))
      3.700     1.700     1.700 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.91059E-03 ppm1      4.871 ppm2      8.935 CV     1
 ASSI { 1173}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 90   and name H   ))
      4.200     2.200     1.800 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      4.878 ppm2      8.816 CV     1
 ASSI { 1174}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 98   and name H   ))
      4.100     2.100     1.900 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.13913E-02 ppm1      1.817 ppm2      9.141 CV     1
 ASSI { 1175}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name H   ))
      2.300     0.700     0.700 peak  1175 spectrum    1 weight  0.10000E+01 volume  0.73287E-02 ppm1      4.174 ppm2      8.396 CV     1
 ASSI { 1179}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HA  ))
      4.500     2.500     1.500 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.59577E-03 ppm1      4.179 ppm2      4.879 CV     1
 ASSI { 1181}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HB  ))
      2.800     1.000     1.000 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.44818E-02 ppm1      4.173 ppm2      4.069 CV     1
 ASSI { 1182}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HB  ))
      4.100     2.100     1.900 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.14488E-02 ppm1      4.171 ppm2      1.809 CV     1
 ASSI { 1184}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 97   and name HG1%)
      4.400     2.400     1.600 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.17941E-02 ppm1      4.174 ppm2      0.822 CV     1
 ASSI { 1185}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 97   and name HG2%)
      4.500     2.500     1.500 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      4.170 ppm2      0.693 CV     1
 ASSI { 1189}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name H   ))
      2.700     0.900     0.900 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.44921E-02 ppm1      4.367 ppm2      8.068 CV     1
 ASSI { 1192}
   (( segid "    " and resid 95   and name HA3 ))
   (( segid "    " and resid 91   and name HD3 ))
      4.200     2.200     1.800 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      3.487 ppm2      3.169 CV     1
 ASSI { 1194}
   (( segid "    " and resid 95   and name HA3 ))
   (( segid "    " and resid 91   and name HG2 ))
      4.700     2.800     1.300 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      3.497 ppm2      1.642 CV     1
 ASSI { 1201}
   (( segid "    " and resid 125  and name HB3 ))
   (( segid "    " and resid 126  and name H   ))
      3.500     1.500     1.500 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      2.490 ppm2      7.676 CV     1
 ASSI { 1202}
   (( segid "    " and resid 125  and name HB3 ))
   (( segid "    " and resid 125  and name HA  ))
      2.600     0.800     0.800 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.81277E-02 ppm1      2.485 ppm2      4.439 CV     1
 ASSI { 1204}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 79   and name HA  ))
      3.000     1.100     1.100 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      4.418 ppm2      4.883 CV     1
 ASSI { 1205}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB3 ))
      2.700     0.900     0.900 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.49795E-02 ppm1      4.439 ppm2      3.038 CV     1
 ASSI { 1206}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name HB3 ))
      2.100     0.600     0.600 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.53281E-02 ppm1      2.534 ppm2      3.037 CV     1
 ASSI { 1208}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.900     1.100     1.100 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.45732E-02 ppm1      4.438 ppm2      2.535 CV     1
 ASSI { 1209}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB3 ))
      3.000     1.100     1.100 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.22105E-02 ppm1      4.397 ppm2      1.524 CV     1
 ASSI { 1210}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 67   and name HB% )
      3.800     1.800     1.800 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.18212E-02 ppm1      4.392 ppm2      1.392 CV     1
 ASSI { 1211}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HG2 ))
      3.000     1.100     1.100 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.30025E-02 ppm1      4.398 ppm2      0.993 CV     1
 ASSI { 1215}
   (( segid "    " and resid 93   and name HB2 ))
   (  segid "    " and resid 93   and name HD2%)
      2.400     0.700     0.700 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.71121E-02 ppm1      1.737 ppm2      0.955 CV     1
 OR { 1215}
   (( segid "    " and resid 93   and name HB2 ))
   (  segid "    " and resid 93   and name HD1%)
 ASSI { 1216}
   (( segid "    " and resid 93   and name HB3 ))
   (  segid "    " and resid 93   and name HD1%)
      2.800     1.000     1.000 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.74574E-02 ppm1      1.618 ppm2      0.956 CV     1
 OR { 1216}
   (( segid "    " and resid 93   and name HB3 ))
   (  segid "    " and resid 93   and name HD2%)
 ASSI { 1217}
   (  segid "    " and resid 93   and name HD1%)
   (  segid "    " and resid 193  and name HD2%)
      2.700     0.900     0.900 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.39843E-02 ppm1      0.951 ppm2      0.713 CV     1
 ASSI { 1218}
   (  segid "    " and resid 93   and name HD1%)
   (  segid "    " and resid 193  and name HD1%)
      2.900     1.100     1.100 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.56328E-02 ppm1      0.949 ppm2      0.569 CV     1
 ASSI { 1219}
   (  segid "    " and resid 93   and name HD1%)
   (  segid "    " and resid 121  and name HD1%)
      3.700     1.800     1.800 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.21766E-02 ppm1      0.948 ppm2      0.279 CV     1
 ASSI { 1222}
   (  segid "    " and resid 25   and name HG2%)
   (  segid "    " and resid 62   and name HD1%)
      2.900     1.100     1.100 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.57277E-02 ppm1      0.976 ppm2      0.399 CV     1
 ASSI { 1224}
   (( segid "    " and resid 93   and name HG  ))
   (  segid "    " and resid 193  and name HD1%)
      4.200     2.300     1.800 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.16858E-02 ppm1      1.750 ppm2      0.576 CV     1
 ASSI { 1225}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name HB2 ))
      2.800     1.000     1.000 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.59308E-02 ppm1      4.072 ppm2      1.740 CV     1
 ASSI { 1227}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 93   and name HB3 ))
      1.800     0.400     0.400 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.73457E-02 ppm1      1.738 ppm2      1.618 CV     1
 ASSI { 1228}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 93   and name HB2 ))
      1.800     0.400     0.400 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.98541E-02 ppm1      1.618 ppm2      1.739 CV     1
 OR { 1228}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 93   and name HG  ))
 ASSI { 1229}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 93   and name HG  ))
      1.900     0.400     0.400 peak  1229 spectrum    1 weight  0.10000E+01 volume  0.24501E-01 ppm1      0.951 ppm2      1.742 CV     1
 ASSI { 1230}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 93   and name HB3 ))
      2.400     0.700     0.700 peak  1230 spectrum    1 weight  0.10000E+01 volume  0.11746E-01 ppm1      0.950 ppm2      1.617 CV     1
 ASSI { 1231}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 195  and name HB3 ))
      2.900     1.100     1.100 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.37507E-02 ppm1      0.949 ppm2      1.518 CV     1
 ASSI { 1232}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 193  and name HG  ))
      3.200     1.200     1.200 peak  1232 spectrum    1 weight  0.10000E+01 volume  0.42618E-02 ppm1      0.949 ppm2      1.404 CV     1
 ASSI { 1234}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 93   and name HG  ))
      1.800     0.400     0.400 peak  1234 spectrum    1 weight  0.10000E+01 volume  0.29642E-01 ppm1      0.962 ppm2      1.740 CV     1
 OR { 1234}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 93   and name HB2 ))
 ASSI { 1235}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 93   and name HB3 ))
      2.900     1.100     1.100 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.13798E-01 ppm1      0.961 ppm2      1.619 CV     1
 ASSI { 1237}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 62   and name HB3 ))
      2.000     0.500     0.500 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.54703E-02 ppm1      0.967 ppm2      1.436 CV     1
 ASSI { 1239}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 62   and name HB2 ))
      2.300     0.700     0.700 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.40758E-02 ppm1      0.977 ppm2      1.171 CV     1
 ASSI { 1240}
   (( segid "    " and resid 93   and name HG  ))
   (  segid "    " and resid 93   and name HD2%)
      2.100     0.500     0.500 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.13784E-01 ppm1      1.746 ppm2      0.955 CV     1
 OR { 1240}
   (( segid "    " and resid 93   and name HG  ))
   (  segid "    " and resid 93   and name HD1%)
 ASSI { 1241}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 92   and name HB3 ))
      4.500     2.500     1.500 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      0.952 ppm2      2.255 CV     1
 ASSI { 1242}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 92   and name HB3 ))
      4.300     2.300     1.700 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.69056E-03 ppm1      1.737 ppm2      2.256 CV     1
 ASSI { 1243}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 194  and name HD2 ))
      3.100     1.200     1.200 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.20243E-02 ppm1      0.950 ppm2      2.992 CV     1
 ASSI { 1244}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 195  and name HD2 ))
      3.900     1.900     1.900 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.10257E-02 ppm1      0.956 ppm2      2.693 CV     1
 OR { 1244}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 195  and name HD3 ))
 ASSI { 1245}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 92   and name HG3 ))
      4.600     2.600     1.400 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.92413E-03 ppm1      0.960 ppm2      2.566 CV     1
 ASSI { 1246}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 77   and name HB2 ))
      2.700     0.900     0.900 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.43701E-02 ppm1      0.884 ppm2      2.802 CV     1
 ASSI { 1247}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HB  ))
      2.100     0.600     0.600 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.57277E-02 ppm1      0.977 ppm2      2.749 CV     1
 ASSI { 1249}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 77   and name HB3 ))
      3.200     1.200     1.200 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.31684E-02 ppm1      0.883 ppm2      2.470 CV     1
 ASSI { 1250}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 92   and name HG2 ))
      4.600     2.600     1.400 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.10020E-02 ppm1      0.970 ppm2      2.428 CV     1
 OR { 1250}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 1251}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 79   and name HG3 ))
      3.700     1.700     1.700 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.19735E-02 ppm1      0.882 ppm2      2.151 CV     1
 ASSI { 1252}
   (( segid "    " and resid 66   and name HG3 ))
   (( segid "    " and resid 66   and name HB2 ))
      2.300     0.700     0.700 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.32632E-02 ppm1      0.983 ppm2      2.050 CV     1
 OR { 1252}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 1255}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 93   and name HA  ))
      2.500     0.800     0.800 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.33919E-02 ppm1      1.618 ppm2      4.071 CV     1
 ASSI { 1256}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 93   and name HA  ))
      2.000     0.500     0.500 peak  1256 spectrum    1 weight  0.10000E+01 volume  0.18026E-01 ppm1      0.951 ppm2      4.070 CV     1
 ASSI { 1257}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 93   and name HA  ))
      3.400     1.400     1.400 peak  1257 spectrum    1 weight  0.10000E+01 volume  0.63877E-02 ppm1      0.961 ppm2      4.070 CV     1
 ASSI { 1259}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HA  ))
      2.200     0.600     0.600 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.59442E-02 ppm1      0.976 ppm2      3.284 CV     1
 ASSI { 1260}
   (( segid "    " and resid 93   and name HG  ))
   (( segid "    " and resid 93   and name HA  ))
      3.800     1.800     1.800 peak  1260 spectrum    1 weight  0.10000E+01 volume  0.23493E-02 ppm1      1.748 ppm2      4.071 CV     1
 ASSI { 1261}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 194  and name HA  ))
      2.700     0.900     0.900 peak  1261 spectrum    1 weight  0.10000E+01 volume  0.29924E-02 ppm1      0.950 ppm2      4.736 CV     1
 ASSI { 1262}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 92   and name HA  ))
      3.500     1.500     1.500 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.17400E-02 ppm1      0.952 ppm2      4.578 CV     1
 ASSI { 1264}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 94   and name H   ))
      4.400     2.400     1.600 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.90044E-03 ppm1      1.623 ppm2      7.677 CV     1
 ASSI { 1265}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 94   and name H   ))
      4.400     2.400     1.600 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      0.952 ppm2      7.680 CV     1
 ASSI { 1266}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 94   and name H   ))
      3.600     1.600     1.600 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.14658E-02 ppm1      0.963 ppm2      7.677 CV     1
 ASSI { 1267}
   (( segid "    " and resid 93   and name HG  ))
   (( segid "    " and resid 94   and name H   ))
      5.000     3.100     1.000 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.84965E-03 ppm1      1.747 ppm2      7.681 CV     1
 ASSI { 1269}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 95   and name H   ))
      4.400     2.500     1.600 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      0.950 ppm2      7.994 CV     1
 ASSI { 1270}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 193  and name H   ))
      3.700     1.700     1.700 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.11137E-02 ppm1      0.954 ppm2      7.894 CV     1
 ASSI { 1271}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 93   and name H   ))
      2.500     0.800     0.800 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.38589E-02 ppm1      0.951 ppm2      8.495 CV     1
 ASSI { 1272}
   (( segid "    " and resid 93   and name HG  ))
   (( segid "    " and resid 93   and name H   ))
      3.700     1.700     1.700 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.23053E-02 ppm1      1.746 ppm2      8.495 CV     1
 ASSI { 1273}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 93   and name H   ))
      3.700     1.700     1.700 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.17670E-02 ppm1      1.616 ppm2      8.494 CV     1
 ASSI { 1275}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name H   ))
      2.900     1.000     1.000 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.19431E-02 ppm1      4.073 ppm2      8.493 CV     1
 ASSI { 1276}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 93   and name H   ))
      2.100     0.600     0.600 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.48203E-02 ppm1      0.964 ppm2      8.490 CV     1
 ASSI { 1277}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 67   and name H   ))
      2.800     1.000     1.000 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      0.973 ppm2      8.146 CV     1
 OR { 1277}
   (( segid "    " and resid 66   and name HG3 ))
   (( segid "    " and resid 67   and name H   ))
 ASSI { 1279}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 26   and name H   ))
      3.800     1.800     1.800 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.19566E-02 ppm1      0.976 ppm2      8.701 CV     1
 ASSI { 1280}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 195  and name H   ))
      3.000     1.100     1.100 peak  1280 spectrum    1 weight  0.10000E+01 volume  0.24474E-02 ppm1      0.951 ppm2      8.789 CV     1
 ASSI { 1281}
   (  segid "    " and resid 93   and name HD1%)
   (( segid "    " and resid 194  and name H   ))
      3.900     1.900     1.900 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      0.952 ppm2      8.646 CV     1
 ASSI { 1282}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 49   and name H   ))
      4.300     2.300     1.700 peak  1282 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      0.967 ppm2      9.116 CV     1
 ASSI { 1283}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name H   ))
      2.200     0.600     0.600 peak  1283 spectrum    1 weight  0.10000E+01 volume  0.57783E-02 ppm1      0.977 ppm2      9.459 CV     1
 ASSI { 1284}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 91   and name H   ))
      2.500     0.800     0.800 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.24745E-02 ppm1      5.054 ppm2      9.213 CV     1
 ASSI { 1285}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name H   ))
      3.100     1.200     1.200 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.10968E-02 ppm1      5.048 ppm2      8.814 CV     1
 ASSI { 1286}
   (( segid "    " and resid 90   and name HB  ))
   (( segid "    " and resid 90   and name H   ))
      2.700     0.900     0.900 peak  1286 spectrum    1 weight  0.10000E+01 volume  0.23594E-02 ppm1      1.657 ppm2      8.810 CV     1
 ASSI { 1287}
   (( segid "    " and resid 90   and name HB  ))
   (( segid "    " and resid 91   and name H   ))
      3.700     1.700     1.700 peak  1287 spectrum    1 weight  0.10000E+01 volume  0.12999E-02 ppm1      1.655 ppm2      9.200 CV     1
 ASSI { 1288}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 92   and name H   ))
      4.100     2.100     1.900 peak  1288 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      0.640 ppm2      8.922 CV     1
 ASSI { 1289}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 90   and name H   ))
      3.400     1.500     1.500 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.35170E-02 ppm1      0.641 ppm2      8.809 CV     1
 ASSI { 1290}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 91   and name H   ))
      2.400     0.700     0.700 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.46681E-02 ppm1      0.638 ppm2      9.209 CV     1
 ASSI { 1291}
   (( segid "    " and resid 90   and name HG12))
   (( segid "    " and resid 90   and name H   ))
      3.100     1.200     1.200 peak  1291 spectrum    1 weight  0.10000E+01 volume  0.95799E-03 ppm1      1.101 ppm2      8.808 CV     1
 ASSI { 1292}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 191  and name H   ))
      4.000     2.000     2.000 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      0.638 ppm2      8.433 CV     1
 ASSI { 1293}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 191  and name H   ))
      3.200     1.300     1.300 peak  1293 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      5.051 ppm2      8.431 CV     1
 ASSI { 1294}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 193  and name H   ))
      2.700     0.900     0.900 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.38726E-02 ppm1      0.639 ppm2      7.892 CV     1
 ASSI { 1295}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 90   and name HA  ))
      2.400     0.700     0.700 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.51015E-02 ppm1      0.639 ppm2      5.052 CV     1
 ASSI { 1297}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 192  and name HA  ))
      3.400     1.400     1.400 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.22003E-02 ppm1      0.639 ppm2      4.708 CV     1
 ASSI { 1298}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 92   and name HA  ))
      3.100     1.200     1.200 peak  1298 spectrum    1 weight  0.10000E+01 volume  0.22443E-02 ppm1      0.638 ppm2      4.579 CV     1
 ASSI { 1299}
   (( segid "    " and resid 90   and name HB  ))
   (( segid "    " and resid 89   and name HA  ))
      4.200     2.200     1.800 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.11814E-02 ppm1      1.651 ppm2      4.621 CV     1
 ASSI { 1300}
   (( segid "    " and resid 90   and name HB  ))
   (( segid "    " and resid 90   and name HA  ))
      3.100     1.200     1.200 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      1.651 ppm2      5.047 CV     1
 ASSI { 1301}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 192  and name HA  ))
      4.300     2.300     1.700 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.60592E-03 ppm1      5.048 ppm2      4.728 CV     1
 ASSI { 1302}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 89   and name HA  ))
      4.200     2.200     1.800 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      5.056 ppm2      4.639 CV     1
 ASSI { 1305}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 90   and name HB  ))
      2.000     0.500     0.500 peak  1305 spectrum    1 weight  0.10000E+01 volume  0.13490E-01 ppm1      0.639 ppm2      1.652 CV     1
 ASSI { 1306}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 98   and name HG3 ))
      3.700     1.700     1.700 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.39098E-02 ppm1      0.640 ppm2      1.373 CV     1
 ASSI { 1307}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 92   and name HB2 ))
      4.200     2.200     1.800 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.13439E-02 ppm1      0.639 ppm2      2.450 CV     1
 ASSI { 1309}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 90   and name HG13))
      2.000     0.500     0.500 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.97321E-02 ppm1      0.638 ppm2      1.207 CV     1
 ASSI { 1310}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 90   and name HG12))
      2.900     1.000     1.000 peak  1310 spectrum    1 weight  0.10000E+01 volume  0.85304E-02 ppm1      0.638 ppm2      1.104 CV     1
 ASSI { 1312}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 91   and name HB2 ))
      3.900     1.900     1.900 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      5.054 ppm2      1.364 CV     1
 ASSI { 1314}
   (( segid "    " and resid 90   and name HB  ))
   (( segid "    " and resid 90   and name HG13))
      2.400     0.700     0.700 peak  1314 spectrum    1 weight  0.10000E+01 volume  0.31922E-02 ppm1      1.657 ppm2      1.207 CV     1
 ASSI { 1315}
   (( segid "    " and resid 90   and name HB  ))
   (( segid "    " and resid 90   and name HG12))
      2.400     0.700     0.700 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.32090E-02 ppm1      1.658 ppm2      1.104 CV     1
 ASSI { 1321}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 8    and name HD1%)
      4.000     2.000     2.000 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.11475E-02 ppm1      5.330 ppm2      0.710 CV     1
 ASSI { 1324}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 7    and name HD3 ))
      4.200     2.200     1.800 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      5.332 ppm2      1.461 CV     1
 ASSI { 1325}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 7    and name HB3 ))
      4.500     2.500     1.500 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      5.342 ppm2      1.341 CV     1
 ASSI { 1327}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      2.900     1.100     1.100 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      5.333 ppm2      1.819 CV     1
 ASSI { 1328}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 80   and name HB2 ))
      3.000     1.100     1.100 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.22883E-02 ppm1      1.007 ppm2      1.999 CV     1
 ASSI { 1329}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name HB2 ))
      2.300     0.700     0.700 peak  1329 spectrum    1 weight  0.10000E+01 volume  0.50676E-02 ppm1      1.006 ppm2      1.822 CV     1
 ASSI { 1330}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 79   and name HB2 ))
      4.100     2.100     1.900 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.16282E-02 ppm1      1.007 ppm2      1.708 CV     1
 ASSI { 1331}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name HD3 ))
      3.000     1.100     1.100 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.47120E-02 ppm1      1.006 ppm2      1.464 CV     1
 ASSI { 1332}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name HB3 ))
      3.000     1.100     1.100 peak  1332 spectrum    1 weight  0.10000E+01 volume  0.38894E-02 ppm1      1.006 ppm2      1.331 CV     1
 ASSI { 1333}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name HG3 ))
      2.200     2.200     3.800 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.23086E-02 ppm1      1.011 ppm2      1.185 CV     1
 OR { 1333}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name HG2 ))
 ASSI { 1334}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 80   and name HG3 ))
      3.400     1.400     1.400 peak  1334 spectrum    1 weight  0.10000E+01 volume  0.19769E-02 ppm1      1.007 ppm2      2.402 CV     1
 ASSI { 1335}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name HE2 ))
      2.300     2.300     3.700 peak  1335 spectrum    1 weight  0.10000E+01 volume  0.19227E-02 ppm1      1.006 ppm2      2.798 CV     1
 OR { 1335}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name HE3 ))
 ASSI { 1336}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HB  ))
      2.100     0.600     0.600 peak  1336 spectrum    1 weight  0.10000E+01 volume  0.13649E-01 ppm1      1.006 ppm2      3.859 CV     1
 ASSI { 1337}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 52   and name HB2 ))
      2.800     0.900     0.900 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.43228E-02 ppm1      1.006 ppm2      3.668 CV     1
 ASSI { 1338}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 9    and name HB2 ))
      2.500     0.800     0.800 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.49694E-02 ppm1      1.007 ppm2      3.573 CV     1
 ASSI { 1340}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 77   and name HA  ))
      2.400     2.400     3.600 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.12796E-02 ppm1      1.009 ppm2      4.587 CV     1
 ASSI { 1341}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name HA  ))
      4.100     2.100     1.900 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.14827E-02 ppm1      1.007 ppm2      4.501 CV     1
 ASSI { 1342}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 79   and name HA  ))
      2.900     1.100     1.100 peak  1342 spectrum    1 weight  0.10000E+01 volume  0.35509E-02 ppm1      1.006 ppm2      4.906 CV     1
 ASSI { 1343}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HA  ))
      2.400     0.700     0.700 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.81650E-02 ppm1      1.006 ppm2      5.331 CV     1
 ASSI { 1344}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 80   and name HA  ))
      3.500     1.500     1.500 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      1.006 ppm2      5.183 CV     1
 ASSI { 1345}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 78   and name HA  ))
      3.400     1.400     1.400 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      3.861 ppm2      5.328 CV     1
 ASSI { 1346}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name H   ))
      3.500     1.600     1.600 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.44040E-02 ppm1      1.006 ppm2      8.144 CV     1
 ASSI { 1350}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 9    and name H   ))
      2.900     1.100     1.100 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.25185E-02 ppm1      1.006 ppm2      8.866 CV     1
 ASSI { 1351}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 7    and name H   ))
      3.900     1.900     1.900 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.20514E-02 ppm1      1.005 ppm2      8.671 CV     1
 ASSI { 1352}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 80   and name H   ))
      3.400     1.400     1.400 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.15402E-02 ppm1      1.008 ppm2      9.162 CV     1
 ASSI { 1353}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 79   and name H   ))
      2.300     0.700     0.700 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.89299E-02 ppm1      1.006 ppm2      9.050 CV     1
 ASSI { 1354}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 79   and name H   ))
      4.400     2.400     1.600 peak  1354 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      3.868 ppm2      9.043 CV     1
 ASSI { 1356}
   (( segid "    " and resid 76   and name HA3 ))
   (( segid "    " and resid 76   and name H   ))
      3.200     1.300     1.300 peak  1356 spectrum    1 weight  0.10000E+01 volume  0.20920E-02 ppm1      4.256 ppm2      9.305 CV     1
 ASSI { 1361}
   (( segid "    " and resid 76   and name HA2 ))
   (( segid "    " and resid 75   and name HA  ))
      4.100     2.100     1.900 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.10731E-02 ppm1      3.520 ppm2      4.715 CV     1
 ASSI { 1362}
   (( segid "    " and resid 76   and name HA2 ))
   (( segid "    " and resid 76   and name HA3 ))
      2.200     0.600     0.600 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.50777E-02 ppm1      3.516 ppm2      4.261 CV     1
 ASSI { 1365}
   (( segid "    " and resid 76   and name HA3 ))
   (( segid "    " and resid 77   and name HB2 ))
      4.300     2.300     1.700 peak  1365 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      4.257 ppm2      2.794 CV     1
 ASSI { 1368}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name H   ))
      3.400     1.400     1.400 peak  1368 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      4.005 ppm2      7.830 CV     1
 ASSI { 1371}
   (( segid "    " and resid 181  and name HA  ))
   (( segid "    " and resid 185  and name H   ))
      3.500     1.500     1.500 peak  1371 spectrum    1 weight  0.10000E+01 volume  0.10832E-02 ppm1      3.982 ppm2      7.342 CV     1
 ASSI { 1372}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 71   and name HD% )
      2.900     1.100     1.100 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.26099E-02 ppm1      3.998 ppm2      7.232 CV     1
 ASSI { 1373}
   (( segid "    " and resid 71   and name HB3 ))
   (  segid "    " and resid 71   and name HD% )
      3.000     1.100     1.100 peak  1373 spectrum    1 weight  0.10000E+01 volume  0.13608E-02 ppm1      3.153 ppm2      7.231 CV     1
 ASSI { 1378}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HB3 ))
      2.300     0.600     0.600 peak  1378 spectrum    1 weight  0.10000E+01 volume  0.12153E-02 ppm1      2.683 ppm2      3.146 CV     1
 ASSI { 1379}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB3 ))
      3.000     1.100     1.100 peak  1379 spectrum    1 weight  0.10000E+01 volume  0.17806E-02 ppm1      4.000 ppm2      3.158 CV     1
 ASSI { 1380}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.300     1.300     1.300 peak  1380 spectrum    1 weight  0.10000E+01 volume  0.15301E-02 ppm1      4.000 ppm2      2.675 CV     1
 ASSI { 1382}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HG3 ))
      3.800     1.800     1.800 peak  1382 spectrum    1 weight  0.10000E+01 volume  0.84965E-03 ppm1      3.993 ppm2      2.327 CV     1
 ASSI { 1383}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 73   and name HG  ))
      3.400     1.500     1.500 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.69395E-03 ppm1      2.683 ppm2      1.512 CV     1
 ASSI { 1384}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 73   and name HD2%)
      3.100     1.200     1.200 peak  1384 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      2.679 ppm2      0.824 CV     1
 OR { 1384}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 73   and name HD1%)
 ASSI { 1386}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 73   and name HD1%)
      4.500     2.600     1.500 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.16045E-02 ppm1      3.996 ppm2      0.821 CV     1
 ASSI { 1387}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 71   and name H   ))
      3.300     1.300     1.300 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      4.371 ppm2      7.559 CV     1
 ASSI { 1388}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 73   and name H   ))
      3.400     1.400     1.400 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.11306E-02 ppm1      4.379 ppm2      6.777 CV     1
 ASSI { 1391}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 21   and name HA  ))
      3.100     1.200     1.200 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.84288E-03 ppm1      2.766 ppm2      4.097 CV     1
 ASSI { 1394}
   (( segid "    " and resid 69   and name HB3 ))
   (( segid "    " and resid 69   and name HB2 ))
      2.000     0.500     0.500 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.56768E-02 ppm1      2.434 ppm2      2.764 CV     1
 ASSI { 1395}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB2 ))
      2.400     0.700     0.700 peak  1395 spectrum    1 weight  0.10000E+01 volume  0.60052E-02 ppm1      4.373 ppm2      2.765 CV     1
 ASSI { 1398}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 21   and name HB2 ))
      3.800     1.800     1.800 peak  1398 spectrum    1 weight  0.10000E+01 volume  0.14725E-02 ppm1      2.769 ppm2      2.099 CV     1
 ASSI { 1399}
   (( segid "    " and resid 69   and name HB3 ))
   (( segid "    " and resid 21   and name HB2 ))
      3.300     1.400     1.400 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.16519E-02 ppm1      2.439 ppm2      2.096 CV     1
 ASSI { 1400}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 68   and name HB2 ))
      4.100     2.100     1.900 peak  1400 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      2.776 ppm2      1.945 CV     1
 ASSI { 1401}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 67   and name HB% )
      4.700     2.700     1.300 peak  1401 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      2.760 ppm2      1.394 CV     1
 ASSI { 1402}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 67   and name HB% )
      4.600     2.600     1.400 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      4.385 ppm2      1.374 CV     1
 ASSI { 1404}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 4    and name HD2%)
      3.600     1.600     1.600 peak  1404 spectrum    1 weight  0.10000E+01 volume  0.16249E-02 ppm1      4.377 ppm2      0.704 CV     1
 OR { 1404}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 1405}
   (( segid "    " and resid 69   and name HB3 ))
   (  segid "    " and resid 4    and name HD2%)
      4.800     2.900     1.200 peak  1405 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      2.440 ppm2      0.701 CV     1
 OR { 1405}
   (( segid "    " and resid 69   and name HB3 ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 1407}
   (( segid "    " and resid 68   and name HB3 ))
   (  segid "    " and resid 68   and name HD2%)
      2.800     1.000     1.000 peak  1407 spectrum    1 weight  0.10000E+01 volume  0.19092E-02 ppm1      1.080 ppm2      0.307 CV     1
 OR { 1407}
   (( segid "    " and resid 68   and name HB3 ))
   (  segid "    " and resid 68   and name HD1%)
 ASSI { 1408}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 68   and name HD1%)
      3.100     1.200     1.200 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.15639E-02 ppm1      1.955 ppm2      0.309 CV     1
 OR { 1408}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 68   and name HD2%)
 ASSI { 1409}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 68   and name HD2%)
      2.600     0.800     0.800 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.27893E-02 ppm1      3.924 ppm2      0.298 CV     1
 OR { 1409}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 68   and name HD1%)
 ASSI { 1413}
   (( segid "    " and resid 68   and name HG  ))
   (  segid "    " and resid 68   and name HD1%)
      2.400     0.700     0.700 peak  1413 spectrum    1 weight  0.10000E+01 volume  0.36424E-02 ppm1      1.654 ppm2      0.315 CV     1
 OR { 1413}
   (( segid "    " and resid 68   and name HG  ))
   (  segid "    " and resid 68   and name HD2%)
 ASSI { 1414}
   (  segid "    " and resid 68   and name HD1%)
   (  segid "    " and resid 28   and name HB% )
      2.500     0.800     0.800 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.35274E-02 ppm1      0.326 ppm2      1.010 CV     1
 ASSI { 1416}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 68   and name HB3 ))
      2.400     0.700     0.700 peak  1416 spectrum    1 weight  0.10000E+01 volume  0.47019E-02 ppm1      0.295 ppm2      1.078 CV     1
 ASSI { 1418}
   (  segid "    " and resid 68   and name HD2%)
   (  segid "    " and resid 73   and name HD1%)
      2.400     0.700     0.700 peak  1418 spectrum    1 weight  0.10000E+01 volume  0.90958E-02 ppm1      0.295 ppm2      0.821 CV     1
 ASSI { 1419}
   (  segid "    " and resid 68   and name HD2%)
   (  segid "    " and resid 49   and name HD1%)
      2.100     0.600     0.600 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.89876E-02 ppm1      0.295 ppm2      0.731 CV     1
 ASSI { 1421}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 68   and name HG  ))
      2.400     0.700     0.700 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.46004E-02 ppm1      0.326 ppm2      1.652 CV     1
 ASSI { 1423}
   (  segid "    " and resid 68   and name HD1%)
   (  segid "    " and resid 79   and name HE% )
      2.900     1.100     1.100 peak  1423 spectrum    1 weight  0.10000E+01 volume  0.22951E-02 ppm1      0.327 ppm2      1.473 CV     1
 ASSI { 1424}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 68   and name HG  ))
      2.200     0.600     0.600 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.60458E-02 ppm1      0.295 ppm2      1.654 CV     1
 ASSI { 1425}
   (  segid "    " and resid 68   and name HD2%)
   (  segid "    " and resid 79   and name HE% )
      2.600     0.800     0.800 peak  1425 spectrum    1 weight  0.10000E+01 volume  0.59137E-02 ppm1      0.295 ppm2      1.474 CV     1
 ASSI { 1426}
   (  segid "    " and resid 68   and name HD2%)
   (  segid "    " and resid 67   and name HB% )
      3.400     1.400     1.400 peak  1426 spectrum    1 weight  0.10000E+01 volume  0.25861E-02 ppm1      0.295 ppm2      1.373 CV     1
 ASSI { 1427}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 68   and name HB2 ))
      3.300     1.400     1.400 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.35274E-02 ppm1      0.296 ppm2      1.943 CV     1
 ASSI { 1428}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 68   and name HB2 ))
      2.800     1.000     1.000 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      0.325 ppm2      1.942 CV     1
 ASSI { 1429}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB3 ))
      2.800     1.000     1.000 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.11780E-02 ppm1      3.915 ppm2      1.086 CV     1
 ASSI { 1430}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 66   and name HG2 ))
      3.800     1.800     1.800 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.10460E-02 ppm1      3.930 ppm2      0.993 CV     1
 ASSI { 1431}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HB3 ))
      2.300     0.700     0.700 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.11442E-02 ppm1      1.947 ppm2      1.086 CV     1
 ASSI { 1432}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HG  ))
      3.500     1.500     1.500 peak  1432 spectrum    1 weight  0.10000E+01 volume  0.91059E-03 ppm1      3.922 ppm2      1.650 CV     1
 ASSI { 1435}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 19   and name HB2 ))
      2.800     1.000     1.000 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.20074E-02 ppm1      0.326 ppm2      2.298 CV     1
 ASSI { 1436}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 25   and name HB  ))
      2.500     2.500     3.500 peak  1436 spectrum    1 weight  0.10000E+01 volume  0.11103E-02 ppm1      0.295 ppm2      2.751 CV     1
 ASSI { 1437}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 25   and name HA  ))
      2.900     1.100     1.100 peak  1437 spectrum    1 weight  0.10000E+01 volume  0.21394E-02 ppm1      0.295 ppm2      3.280 CV     1
 ASSI { 1438}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HA  ))
      3.600     1.600     1.600 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.82595E-03 ppm1      1.931 ppm2      3.929 CV     1
 ASSI { 1440}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 21   and name HA  ))
      3.700     1.700     1.700 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.11306E-02 ppm1      0.324 ppm2      4.100 CV     1
 ASSI { 1441}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 68   and name HA  ))
      2.100     0.500     0.500 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.85069E-02 ppm1      0.295 ppm2      3.920 CV     1
 ASSI { 1442}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 68   and name HA  ))
      3.500     1.500     1.500 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.35137E-02 ppm1      0.326 ppm2      3.924 CV     1
 ASSI { 1443}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 67   and name HA  ))
      4.000     2.000     2.000 peak  1443 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      0.296 ppm2      4.860 CV     1
 ASSI { 1444}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 67   and name HA  ))
      3.600     1.600     1.600 peak  1444 spectrum    1 weight  0.10000E+01 volume  0.13845E-02 ppm1      0.330 ppm2      4.846 CV     1
 ASSI { 1445}
   (  segid "    " and resid 68   and name HD1%)
   (  segid "    " and resid 19   and name HE% )
      4.100     2.100     1.900 peak  1445 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      0.327 ppm2      7.133 CV     1
 ASSI { 1447}
   (  segid "    " and resid 68   and name HD2%)
   (  segid "    " and resid 71   and name HD% )
      4.200     2.200     1.800 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.15436E-02 ppm1      0.294 ppm2      7.227 CV     1
 ASSI { 1448}
   (  segid "    " and resid 68   and name HD2%)
   (  segid "    " and resid 19   and name HD% )
      2.500     2.500     3.500 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      0.298 ppm2      7.059 CV     1
 ASSI { 1449}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 71   and name HD% )
      3.400     1.500     1.500 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.12390E-02 ppm1      3.918 ppm2      7.234 CV     1
 ASSI { 1450}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name H   ))
      3.100     1.200     1.200 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.62624E-03 ppm1      1.945 ppm2      8.360 CV     1
 ASSI { 1451}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 68   and name H   ))
      3.300     1.400     1.400 peak  1451 spectrum    1 weight  0.10000E+01 volume  0.33072E-02 ppm1      0.295 ppm2      8.351 CV     1
 ASSI { 1452}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 69   and name H   ))
      4.500     2.600     1.500 peak  1452 spectrum    1 weight  0.10000E+01 volume  0.14319E-02 ppm1      0.296 ppm2      8.082 CV     1
 ASSI { 1455}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name H   ))
      4.300     2.300     1.700 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      1.083 ppm2      8.335 CV     1
 ASSI { 1456}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 68   and name H   ))
      3.800     1.800     1.800 peak  1456 spectrum    1 weight  0.10000E+01 volume  0.23154E-02 ppm1      0.326 ppm2      8.351 CV     1
 ASSI { 1458}
   (  segid "    " and resid 68   and name HD2%)
   (( segid "    " and resid 25   and name H   ))
      3.700     1.700     1.700 peak  1458 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      0.296 ppm2      9.468 CV     1
 ASSI { 1459}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 25   and name H   ))
      4.400     2.400     1.600 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      1.394 ppm2      9.464 CV     1
 ASSI { 1461}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
      3.300     1.400     1.400 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.14624E-02 ppm1      4.861 ppm2      9.460 CV     1
 ASSI { 1462}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 68   and name H   ))
      2.500     0.800     0.800 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.52299E-02 ppm1      1.393 ppm2      8.353 CV     1
 ASSI { 1464}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 70   and name H   ))
      2.700     0.900     0.900 peak  1464 spectrum    1 weight  0.10000E+01 volume  0.28469E-02 ppm1      1.392 ppm2      7.897 CV     1
 ASSI { 1465}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 23   and name H   ))
      3.900     1.900     1.900 peak  1465 spectrum    1 weight  0.10000E+01 volume  0.12525E-02 ppm1      1.395 ppm2      7.722 CV     1
 ASSI { 1466}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 71   and name H   ))
      4.900     3.000     1.100 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      1.391 ppm2      7.568 CV     1
 ASSI { 1468}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 22   and name H   ))
      4.300     2.300     1.700 peak  1468 spectrum    1 weight  0.10000E+01 volume  0.13337E-02 ppm1      1.394 ppm2      7.383 CV     1
 ASSI { 1471}
   (  segid "    " and resid 67   and name HB% )
   (  segid "    " and resid 70   and name HD% )
      4.800     2.800     1.200 peak  1471 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      1.397 ppm2      6.060 CV     1
 ASSI { 1472}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 67   and name HA  ))
      2.100     0.500     0.500 peak  1472 spectrum    1 weight  0.10000E+01 volume  0.80396E-02 ppm1      1.393 ppm2      4.856 CV     1
 ASSI { 1473}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 24   and name HA  ))
      3.100     1.200     1.200 peak  1473 spectrum    1 weight  0.10000E+01 volume  0.35612E-02 ppm1      1.394 ppm2      4.712 CV     1
 ASSI { 1474}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
      2.200     0.600     0.600 peak  1474 spectrum    1 weight  0.10000E+01 volume  0.90214E-02 ppm1      1.393 ppm2      4.323 CV     1
 ASSI { 1475}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 22   and name HB3 ))
      3.600     1.700     1.700 peak  1475 spectrum    1 weight  0.10000E+01 volume  0.23594E-02 ppm1      1.394 ppm2      4.035 CV     1
 ASSI { 1476}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 70   and name HA  ))
      3.700     1.700     1.700 peak  1476 spectrum    1 weight  0.10000E+01 volume  0.28063E-02 ppm1      1.394 ppm2      3.919 CV     1
 ASSI { 1477}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 22   and name HB2 ))
      3.700     1.700     1.700 peak  1477 spectrum    1 weight  0.10000E+01 volume  0.22274E-02 ppm1      1.394 ppm2      3.796 CV     1
 ASSI { 1478}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 24   and name HA  ))
      2.000     0.500     0.500 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.25625E-02 ppm1      4.857 ppm2      4.715 CV     1
 ASSI { 1479}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 70   and name HB3 ))
      3.000     1.100     1.100 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.15165E-02 ppm1      1.395 ppm2      3.113 CV     1
 ASSI { 1480}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 70   and name HB2 ))
      3.000     1.200     1.200 peak  1480 spectrum    1 weight  0.10000E+01 volume  0.16519E-02 ppm1      1.392 ppm2      2.826 CV     1
 ASSI { 1483}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 69   and name HB3 ))
      3.700     1.700     1.700 peak  1483 spectrum    1 weight  0.10000E+01 volume  0.11442E-02 ppm1      1.393 ppm2      2.419 CV     1
 ASSI { 1484}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 66   and name HE3 ))
      4.600     2.700     1.400 peak  1484 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      1.391 ppm2      2.264 CV     1
 ASSI { 1485}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 24   and name HG3 ))
      2.900     1.100     1.100 peak  1485 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      4.862 ppm2      2.728 CV     1
 ASSI { 1486}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 24   and name HG2 ))
      4.700     2.800     1.300 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      4.862 ppm2      2.617 CV     1
 ASSI { 1488}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 68   and name HB2 ))
      3.800     1.800     1.800 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.19532E-02 ppm1      1.389 ppm2      1.940 CV     1
 ASSI { 1489}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 24   and name HB2 ))
      3.700     1.700     1.700 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      1.392 ppm2      1.720 CV     1
 ASSI { 1490}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 68   and name HG  ))
      4.200     2.200     1.800 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.16147E-02 ppm1      1.395 ppm2      1.648 CV     1
 ASSI { 1492}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 24   and name HB2 ))
      4.400     2.400     1.600 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      4.854 ppm2      1.703 CV     1
 ASSI { 1495}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 68   and name HD2%)
      4.800     2.900     1.200 peak  1495 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      4.850 ppm2      0.309 CV     1
 OR { 1495}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 68   and name HD1%)
 ASSI { 1496}
   (  segid "    " and resid 67   and name HB% )
   (  segid "    " and resid 68   and name HD2%)
      4.500     2.500     1.500 peak  1496 spectrum    1 weight  0.10000E+01 volume  0.15944E-02 ppm1      1.393 ppm2      0.306 CV     1
 OR { 1496}
   (  segid "    " and resid 67   and name HB% )
   (  segid "    " and resid 68   and name HD1%)
 ASSI { 1497}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 66   and name HG2 ))
      3.500     1.500     1.500 peak  1497 spectrum    1 weight  0.10000E+01 volume  0.24779E-02 ppm1      1.394 ppm2      0.985 CV     1
 ASSI { 1503}
   (  segid "    " and resid 64   and name HB% )
   (  segid "    " and resid 25   and name HG2%)
      4.200     2.200     1.800 peak  1503 spectrum    1 weight  0.10000E+01 volume  0.26944E-02 ppm1      1.520 ppm2      0.982 CV     1
 ASSI { 1505}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
      4.000     2.000     2.000 peak  1505 spectrum    1 weight  0.10000E+01 volume  0.15741E-02 ppm1      3.916 ppm2      0.982 CV     1
 ASSI { 1508}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 63   and name HG3 ))
      4.300     2.300     1.700 peak  1508 spectrum    1 weight  0.10000E+01 volume  0.15571E-02 ppm1      1.522 ppm2      2.278 CV     1
 ASSI { 1510}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 63   and name HB2 ))
      4.000     2.000     2.000 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.17806E-02 ppm1      1.518 ppm2      1.920 CV     1
 ASSI { 1511}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 24   and name HB3 ))
      4.400     2.400     1.600 peak  1511 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      1.527 ppm2      1.762 CV     1
 ASSI { 1512}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 26   and name HB2 ))
      3.600     1.600     1.600 peak  1512 spectrum    1 weight  0.10000E+01 volume  0.71020E-02 ppm1      1.521 ppm2      2.806 CV     1
 ASSI { 1513}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 24   and name HG2 ))
      3.800     1.800     1.800 peak  1513 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      1.523 ppm2      2.597 CV     1
 ASSI { 1514}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 25   and name HB  ))
      2.300     0.600     0.600 peak  1514 spectrum    1 weight  0.10000E+01 volume  0.19431E-02 ppm1      3.918 ppm2      2.750 CV     1
 ASSI { 1515}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 26   and name HB3 ))
      2.300     0.600     0.600 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.72679E-02 ppm1      1.521 ppm2      3.188 CV     1
 ASSI { 1516}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 65   and name HA2 ))
      3.400     1.500     1.500 peak  1516 spectrum    1 weight  0.10000E+01 volume  0.20649E-02 ppm1      1.522 ppm2      3.577 CV     1
 ASSI { 1517}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 64   and name HA  ))
      2.000     0.500     0.500 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.12582E-01 ppm1      1.521 ppm2      3.916 CV     1
 ASSI { 1518}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 26   and name HA  ))
      3.200     1.300     1.300 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.56362E-02 ppm1      1.521 ppm2      4.372 CV     1
 ASSI { 1519}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 63   and name HA  ))
      3.600     1.600     1.600 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.56023E-02 ppm1      1.521 ppm2      4.214 CV     1
 ASSI { 1521}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 63   and name HA  ))
      4.100     2.100     1.900 peak  1521 spectrum    1 weight  0.10000E+01 volume  0.95122E-03 ppm1      3.920 ppm2      4.211 CV     1
 ASSI { 1523}
   (  segid "    " and resid 64   and name HB% )
   (  segid "    " and resid 26   and name HE% )
      2.300     2.300     3.700 peak  1523 spectrum    1 weight  0.10000E+01 volume  0.15267E-02 ppm1      1.520 ppm2      6.786 CV     1
 ASSI { 1524}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 27   and name H   ))
      2.300     2.300     3.700 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.15639E-02 ppm1      1.522 ppm2      6.718 CV     1
 ASSI { 1525}
   (  segid "    " and resid 64   and name HB% )
   (  segid "    " and resid 26   and name HD% )
      2.400     0.700     0.700 peak  1525 spectrum    1 weight  0.10000E+01 volume  0.71932E-02 ppm1      1.521 ppm2      7.071 CV     1
 ASSI { 1526}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 66   and name H   ))
      3.700     1.800     1.800 peak  1526 spectrum    1 weight  0.10000E+01 volume  0.16215E-02 ppm1      1.520 ppm2      7.476 CV     1
 ASSI { 1527}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 64   and name H   ))
      2.100     0.500     0.500 peak  1527 spectrum    1 weight  0.10000E+01 volume  0.15280E-01 ppm1      1.521 ppm2      8.428 CV     1
 ASSI { 1528}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 65   and name H   ))
      2.500     0.800     0.800 peak  1528 spectrum    1 weight  0.10000E+01 volume  0.65399E-02 ppm1      1.522 ppm2      8.161 CV     1
 ASSI { 1529}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name H   ))
      2.900     1.000     1.000 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.18483E-02 ppm1      3.918 ppm2      8.426 CV     1
 ASSI { 1531}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 26   and name H   ))
      3.000     1.100     1.100 peak  1531 spectrum    1 weight  0.10000E+01 volume  0.48984E-02 ppm1      1.521 ppm2      8.706 CV     1
 ASSI { 1533}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
      4.000     2.000     2.000 peak  1533 spectrum    1 weight  0.10000E+01 volume  0.91398E-03 ppm1      3.923 ppm2      9.460 CV     1
 ASSI { 1534}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 25   and name H   ))
      4.900     3.000     1.100 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.10392E-02 ppm1      1.522 ppm2      9.456 CV     1
 ASSI { 1535}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name H   ))
      3.100     1.200     1.200 peak  1535 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      3.884 ppm2      8.792 CV     1
 ASSI { 1536}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name H   ))
      2.400     0.700     0.700 peak  1536 spectrum    1 weight  0.10000E+01 volume  0.22342E-02 ppm1      3.881 ppm2      8.484 CV     1
 ASSI { 1537}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 51   and name H   ))
      3.200     1.300     1.300 peak  1537 spectrum    1 weight  0.10000E+01 volume  0.32971E-02 ppm1      0.404 ppm2      8.449 CV     1
 ASSI { 1539}
   (( segid "    " and resid 62   and name HG  ))
   (( segid "    " and resid 62   and name H   ))
      2.600     0.800     0.800 peak  1539 spectrum    1 weight  0.10000E+01 volume  0.16147E-02 ppm1      0.678 ppm2      8.792 CV     1
 ASSI { 1540}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 50   and name H   ))
      4.500     2.600     1.500 peak  1540 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1     -0.160 ppm2      9.116 CV     1
 ASSI { 1541}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 62   and name H   ))
      3.100     1.200     1.200 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.38726E-02 ppm1     -0.161 ppm2      8.795 CV     1
 ASSI { 1542}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 62   and name H   ))
      3.300     1.300     1.300 peak  1542 spectrum    1 weight  0.10000E+01 volume  0.53348E-02 ppm1      0.403 ppm2      8.793 CV     1
 ASSI { 1543}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 50   and name H   ))
      3.900     1.900     1.900 peak  1543 spectrum    1 weight  0.10000E+01 volume  0.16790E-02 ppm1      0.401 ppm2      9.093 CV     1
 ASSI { 1545}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 52   and name H   ))
      5.300     3.600     0.700 peak  1545 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1     -0.156 ppm2      8.144 CV     1
 ASSI { 1546}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 52   and name H   ))
      4.800     2.900     1.200 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      0.406 ppm2      8.146 CV     1
 ASSI { 1547}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 61   and name HE3 ))
      4.500     2.500     1.500 peak  1547 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      0.403 ppm2      7.533 CV     1
 ASSI { 1548}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 71   and name H   ))
      4.200     2.200     1.800 peak  1548 spectrum    1 weight  0.10000E+01 volume  0.11408E-02 ppm1     -0.161 ppm2      7.554 CV     1
 ASSI { 1549}
   (  segid "    " and resid 62   and name HD2%)
   (  segid "    " and resid 71   and name HE% )
      3.100     1.200     1.200 peak  1549 spectrum    1 weight  0.10000E+01 volume  0.22951E-02 ppm1     -0.160 ppm2      6.838 CV     1
 ASSI { 1550}
   (  segid "    " and resid 62   and name HD1%)
   (  segid "    " and resid 71   and name HE% )
      4.400     2.400     1.600 peak  1550 spectrum    1 weight  0.10000E+01 volume  0.15131E-02 ppm1      0.403 ppm2      6.857 CV     1
 ASSI { 1551}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 49   and name HA  ))
      4.200     2.200     1.800 peak  1551 spectrum    1 weight  0.10000E+01 volume  0.14014E-02 ppm1      0.401 ppm2      5.446 CV     1
 ASSI { 1552}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 61   and name HA  ))
      2.300     2.300     3.700 peak  1552 spectrum    1 weight  0.10000E+01 volume  0.16452E-02 ppm1     -0.162 ppm2      4.880 CV     1
 ASSI { 1553}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 50   and name HA  ))
      2.300     2.300     3.700 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.17061E-02 ppm1     -0.161 ppm2      4.697 CV     1
 ASSI { 1554}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 79   and name HA  ))
      3.400     1.500     1.500 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.25558E-02 ppm1      0.403 ppm2      4.877 CV     1
 ASSI { 1555}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 50   and name HA  ))
      3.500     1.600     1.600 peak  1555 spectrum    1 weight  0.10000E+01 volume  0.19904E-02 ppm1      0.399 ppm2      4.702 CV     1
 ASSI { 1556}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 62   and name HA  ))
      2.100     0.600     0.600 peak  1556 spectrum    1 weight  0.10000E+01 volume  0.79414E-02 ppm1     -0.161 ppm2      3.884 CV     1
 ASSI { 1557}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 51   and name HA  ))
      4.200     2.200     1.800 peak  1557 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1     -0.164 ppm2      4.417 CV     1
 ASSI { 1558}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 51   and name HA  ))
      3.300     1.300     1.300 peak  1558 spectrum    1 weight  0.10000E+01 volume  0.14624E-02 ppm1      0.402 ppm2      4.411 CV     1
 ASSI { 1561}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 25   and name HA  ))
      5.100     3.200     0.900 peak  1561 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1     -0.159 ppm2      3.273 CV     1
 ASSI { 1562}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 71   and name HB3 ))
      3.300     1.400     1.400 peak  1562 spectrum    1 weight  0.10000E+01 volume  0.18584E-02 ppm1     -0.160 ppm2      3.162 CV     1
 ASSI { 1563}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 25   and name HA  ))
      4.400     2.400     1.600 peak  1563 spectrum    1 weight  0.10000E+01 volume  0.12390E-02 ppm1      0.405 ppm2      3.276 CV     1
 ASSI { 1564}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 71   and name HB3 ))
      3.900     1.900     1.900 peak  1564 spectrum    1 weight  0.10000E+01 volume  0.15267E-02 ppm1      0.402 ppm2      3.167 CV     1
 ASSI { 1565}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 71   and name HB2 ))
      3.100     1.200     1.200 peak  1565 spectrum    1 weight  0.10000E+01 volume  0.15368E-02 ppm1     -0.164 ppm2      2.676 CV     1
 ASSI { 1566}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 71   and name HB2 ))
      3.800     1.800     1.800 peak  1566 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      0.405 ppm2      2.686 CV     1
 ASSI { 1567}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 50   and name HB2 ))
      4.500     2.600     1.500 peak  1567 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      0.403 ppm2      2.409 CV     1
 ASSI { 1568}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB3 ))
      2.800     1.000     1.000 peak  1568 spectrum    1 weight  0.10000E+01 volume  0.81580E-03 ppm1      3.898 ppm2      1.432 CV     1
 ASSI { 1569}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HB3 ))
      2.200     0.600     0.600 peak  1569 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      1.188 ppm2      1.446 CV     1
 ASSI { 1570}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 79   and name HG3 ))
      2.700     0.900     0.900 peak  1570 spectrum    1 weight  0.10000E+01 volume  0.25354E-02 ppm1      0.403 ppm2      2.146 CV     1
 OR { 1570}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 1574}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 79   and name HG3 ))
      4.100     2.100     1.900 peak  1574 spectrum    1 weight  0.10000E+01 volume  0.12762E-02 ppm1     -0.162 ppm2      2.145 CV     1
 OR { 1574}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 1576}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 51   and name HG  ))
      2.400     0.700     0.700 peak  1576 spectrum    1 weight  0.10000E+01 volume  0.72036E-02 ppm1     -0.160 ppm2      1.310 CV     1
 ASSI { 1577}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 62   and name HB2 ))
      3.100     1.200     1.200 peak  1577 spectrum    1 weight  0.10000E+01 volume  0.41603E-02 ppm1     -0.160 ppm2      1.177 CV     1
 ASSI { 1578}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 51   and name HB2 ))
      1.900     0.500     0.500 peak  1578 spectrum    1 weight  0.10000E+01 volume  0.99962E-02 ppm1     -0.161 ppm2      0.969 CV     1
 ASSI { 1579}
   (  segid "    " and resid 62   and name HD2%)
   (  segid "    " and resid 60   and name HD1%)
      2.000     0.500     0.500 peak  1579 spectrum    1 weight  0.10000E+01 volume  0.17670E-01 ppm1     -0.160 ppm2      0.813 CV     1
 ASSI { 1580}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 62   and name HG  ))
      2.000     0.500     0.500 peak  1580 spectrum    1 weight  0.10000E+01 volume  0.10507E-01 ppm1     -0.160 ppm2      0.676 CV     1
 ASSI { 1581}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 49   and name HB3 ))
      1.900     0.500     0.500 peak  1581 spectrum    1 weight  0.10000E+01 volume  0.73424E-02 ppm1      0.403 ppm2      1.296 CV     1
 ASSI { 1582}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 62   and name HB2 ))
      2.300     0.700     0.700 peak  1582 spectrum    1 weight  0.10000E+01 volume  0.54196E-02 ppm1      0.403 ppm2      1.179 CV     1
 ASSI { 1589}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
      3.100     1.200     1.200 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      3.889 ppm2      1.177 CV     1
 ASSI { 1590}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
      3.700     1.700     1.700 peak  1590 spectrum    1 weight  0.10000E+01 volume  0.12491E-02 ppm1      3.888 ppm2      0.981 CV     1
 ASSI { 1592}
   (( segid "    " and resid 62   and name HG  ))
   (  segid "    " and resid 62   and name HD1%)
      2.300     0.700     0.700 peak  1592 spectrum    1 weight  0.10000E+01 volume  0.35475E-02 ppm1      0.663 ppm2      0.400 CV     1
 ASSI { 1593}
   (  segid "    " and resid 62   and name HD2%)
   (  segid "    " and resid 62   and name HD1%)
      1.800     0.400     0.400 peak  1593 spectrum    1 weight  0.10000E+01 volume  0.29717E-01 ppm1     -0.161 ppm2      0.401 CV     1
 ASSI { 1594}
   (  segid "    " and resid 62   and name HD2%)
   (  segid "    " and resid 68   and name HD2%)
      2.800     1.000     1.000 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.69733E-02 ppm1     -0.161 ppm2      0.301 CV     1
 ASSI { 1595}
   (( segid "    " and resid 62   and name HB3 ))
   (  segid "    " and resid 62   and name HD1%)
      3.200     1.300     1.300 peak  1595 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      1.434 ppm2      0.392 CV     1
 ASSI { 1596}
   (  segid "    " and resid 62   and name HD1%)
   (  segid "    " and resid 68   and name HD2%)
      2.000     0.500     0.500 peak  1596 spectrum    1 weight  0.10000E+01 volume  0.10555E-01 ppm1      0.404 ppm2      0.308 CV     1
 ASSI { 1597}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 62   and name HD1%)
      4.200     2.200     1.800 peak  1597 spectrum    1 weight  0.10000E+01 volume  0.14590E-02 ppm1      3.878 ppm2      0.402 CV     1
 ASSI { 1603}
   (( segid "    " and resid 62   and name HG  ))
   (( segid "    " and resid 61   and name HA  ))
      4.500     2.500     1.500 peak  1603 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      0.673 ppm2      4.870 CV     1
 ASSI { 1604}
   (( segid "    " and resid 62   and name HG  ))
   (( segid "    " and resid 62   and name HA  ))
      3.300     1.300     1.300 peak  1604 spectrum    1 weight  0.10000E+01 volume  0.14014E-02 ppm1      0.662 ppm2      3.871 CV     1
 ASSI { 1605}
   (( segid "    " and resid 62   and name HG  ))
   (( segid "    " and resid 62   and name HB3 ))
      2.900     1.100     1.100 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.18381E-02 ppm1      0.685 ppm2      1.450 CV     1
 ASSI { 1608}
   (( segid "    " and resid 62   and name HB3 ))
   (  segid "    " and resid 62   and name HD2%)
      3.100     1.200     1.200 peak  1608 spectrum    1 weight  0.10000E+01 volume  0.69395E-03 ppm1      1.442 ppm2     -0.167 CV     1
 ASSI { 1614}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 61   and name H   ))
      2.600     0.900     0.900 peak  1614 spectrum    1 weight  0.10000E+01 volume  0.36356E-02 ppm1      1.567 ppm2      8.463 CV     1
 ASSI { 1615}
   (( segid "    " and resid 60   and name HG12))
   (( segid "    " and resid 61   and name H   ))
      4.500     2.500     1.500 peak  1615 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      0.918 ppm2      8.448 CV     1
 ASSI { 1617}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 61   and name H   ))
      3.300     1.400     1.400 peak  1617 spectrum    1 weight  0.10000E+01 volume  0.63843E-02 ppm1      0.786 ppm2      8.465 CV     1
 ASSI { 1618}
   (( segid "    " and resid 192  and name HB3 ))
   (( segid "    " and resid 192  and name H   ))
      4.000     2.000     2.000 peak  1618 spectrum    1 weight  0.10000E+01 volume  0.10325E-02 ppm1      1.548 ppm2      9.094 CV     1
 ASSI { 1619}
   (( segid "    " and resid 192  and name HB3 ))
   (( segid "    " and resid 193  and name H   ))
      3.800     1.800     1.800 peak  1619 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      1.560 ppm2      7.897 CV     1
 ASSI { 1621}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 181  and name HE  ))
      3.900     1.900     1.900 peak  1621 spectrum    1 weight  0.10000E+01 volume  0.10460E-02 ppm1      0.784 ppm2      8.018 CV     1
 ASSI { 1623}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name H   ))
      3.000     1.100     1.100 peak  1623 spectrum    1 weight  0.10000E+01 volume  0.15707E-02 ppm1      4.487 ppm2      7.229 CV     1
 ASSI { 1625}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name H   ))
      3.400     1.500     1.500 peak  1625 spectrum    1 weight  0.10000E+01 volume  0.21462E-02 ppm1      1.568 ppm2      7.227 CV     1
 ASSI { 1626}
   (( segid "    " and resid 60   and name HG12))
   (( segid "    " and resid 60   and name H   ))
      3.000     1.100     1.100 peak  1626 spectrum    1 weight  0.10000E+01 volume  0.21191E-02 ppm1      0.921 ppm2      7.227 CV     1
 ASSI { 1627}
   (( segid "    " and resid 60   and name HG13))
   (( segid "    " and resid 60   and name H   ))
      2.700     0.900     0.900 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.23086E-02 ppm1      1.327 ppm2      7.229 CV     1
 ASSI { 1628}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 59   and name H   ))
      3.500     1.500     1.500 peak  1628 spectrum    1 weight  0.10000E+01 volume  0.19194E-02 ppm1      0.787 ppm2      7.326 CV     1
 ASSI { 1629}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name H   ))
      2.900     1.000     1.000 peak  1629 spectrum    1 weight  0.10000E+01 volume  0.59104E-02 ppm1      0.787 ppm2      7.233 CV     1
 ASSI { 1630}
   (  segid "    " and resid 60   and name HG2%)
   (  segid "    " and resid 71   and name HE% )
      3.200     1.300     1.300 peak  1630 spectrum    1 weight  0.10000E+01 volume  0.19295E-02 ppm1      0.787 ppm2      6.850 CV     1
 ASSI { 1631}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 50   and name HZ  ))
      4.900     3.000     1.100 peak  1631 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      0.786 ppm2      6.741 CV     1
 ASSI { 1632}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 71   and name HE% )
      2.800     1.000     1.000 peak  1632 spectrum    1 weight  0.10000E+01 volume  0.27960E-02 ppm1      0.833 ppm2      6.855 CV     1
 ASSI { 1633}
   (  segid "    " and resid 60   and name HG2%)
   (  segid "    " and resid 50   and name HE% )
      4.300     2.300     1.700 peak  1633 spectrum    1 weight  0.10000E+01 volume  0.10325E-02 ppm1      0.789 ppm2      6.496 CV     1
 ASSI { 1634}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 60   and name HA  ))
      4.100     2.100     1.900 peak  1634 spectrum    1 weight  0.10000E+01 volume  0.22172E-02 ppm1      0.834 ppm2      4.480 CV     1
 ASSI { 1635}
   (( segid "    " and resid 60   and name HG13))
   (( segid "    " and resid 60   and name HA  ))
      3.800     1.800     1.800 peak  1635 spectrum    1 weight  0.10000E+01 volume  0.98169E-03 ppm1      1.329 ppm2      4.485 CV     1
 ASSI { 1636}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 61   and name HA  ))
      4.600     2.600     1.400 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      0.788 ppm2      4.888 CV     1
 ASSI { 1637}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HA  ))
      2.400     0.700     0.700 peak  1637 spectrum    1 weight  0.10000E+01 volume  0.92209E-02 ppm1      0.787 ppm2      4.482 CV     1
 ASSI { 1638}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 36   and name HA  ))
      2.900     1.100     1.100 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.13676E-02 ppm1      0.915 ppm2      4.493 CV     1
 ASSI { 1639}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 62   and name HA  ))
      4.100     2.100     1.900 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.17332E-02 ppm1      0.787 ppm2      3.886 CV     1
 ASSI { 1640}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 59   and name HA3 ))
      3.800     1.800     1.800 peak  1640 spectrum    1 weight  0.10000E+01 volume  0.15842E-02 ppm1      0.789 ppm2      3.741 CV     1
 ASSI { 1641}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 59   and name HA2 ))
      3.700     1.700     1.700 peak  1641 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      0.784 ppm2      3.551 CV     1
 ASSI { 1642}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 61   and name HB2 ))
      4.900     2.900     1.100 peak  1642 spectrum    1 weight  0.10000E+01 volume  0.12051E-02 ppm1      0.784 ppm2      2.999 CV     1
 ASSI { 1643}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 71   and name HB3 ))
      3.400     1.400     1.400 peak  1643 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      0.835 ppm2      3.138 CV     1
 ASSI { 1644}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 60   and name HB  ))
      2.300     0.700     0.700 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.10602E-01 ppm1      0.833 ppm2      1.564 CV     1
 ASSI { 1645}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 60   and name HG13))
      2.000     0.500     0.500 peak  1645 spectrum    1 weight  0.10000E+01 volume  0.17704E-01 ppm1      0.833 ppm2      1.323 CV     1
 ASSI { 1650}
   (( segid "    " and resid 60   and name HG12))
   (( segid "    " and resid 60   and name HG13))
      1.700     0.300     0.500 peak  1650 spectrum    1 weight  0.10000E+01 volume  0.11235E-01 ppm1      0.920 ppm2      1.325 CV     1
 ASSI { 1651}
   (( segid "    " and resid 60   and name HG13))
   (( segid "    " and resid 60   and name HB  ))
      2.500     0.800     0.800 peak  1651 spectrum    1 weight  0.10000E+01 volume  0.39199E-02 ppm1      1.329 ppm2      1.558 CV     1
 ASSI { 1652}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HB  ))
      2.100     0.500     0.500 peak  1652 spectrum    1 weight  0.10000E+01 volume  0.18208E-01 ppm1      0.787 ppm2      1.563 CV     1
 ASSI { 1653}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HG13))
      2.800     1.000     1.000 peak  1653 spectrum    1 weight  0.10000E+01 volume  0.10335E-01 ppm1      0.787 ppm2      1.323 CV     1
 ASSI { 1654}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HG12))
      4.000     2.000     2.000 peak  1654 spectrum    1 weight  0.10000E+01 volume  0.96476E-03 ppm1      4.489 ppm2      0.921 CV     1
 ASSI { 1656}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HG12))
      2.800     1.000     1.000 peak  1656 spectrum    1 weight  0.10000E+01 volume  0.40081E-02 ppm1      1.563 ppm2      0.928 CV     1
 ASSI { 1657}
   (( segid "    " and resid 60   and name HG12))
   (  segid "    " and resid 60   and name HD1%)
      2.200     0.600     0.600 peak  1657 spectrum    1 weight  0.10000E+01 volume  0.11530E-01 ppm1      0.919 ppm2      0.826 CV     1
 OR { 1657}
   (( segid "    " and resid 60   and name HG12))
   (  segid "    " and resid 60   and name HG2%)
 ASSI { 1659}
   (( segid "    " and resid 60   and name HG13))
   (  segid "    " and resid 60   and name HD1%)
      2.300     0.600     0.600 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.11827E-01 ppm1      1.328 ppm2      0.826 CV     1
 OR { 1659}
   (( segid "    " and resid 60   and name HG13))
   (  segid "    " and resid 60   and name HG2%)
 ASSI { 1660}
   (( segid "    " and resid 60   and name HG13))
   (  segid "    " and resid 62   and name HD1%)
      4.400     2.400     1.600 peak  1660 spectrum    1 weight  0.10000E+01 volume  0.93429E-03 ppm1      1.328 ppm2      0.394 CV     1
 ASSI { 1661}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 62   and name HD1%)
      3.800     1.800     1.800 peak  1661 spectrum    1 weight  0.10000E+01 volume  0.24508E-02 ppm1      0.833 ppm2      0.404 CV     1
 ASSI { 1662}
   (( segid "    " and resid 60   and name HG12))
   (  segid "    " and resid 62   and name HD2%)
      4.300     2.300     1.700 peak  1662 spectrum    1 weight  0.10000E+01 volume  0.10426E-02 ppm1      0.919 ppm2     -0.160 CV     1
 ASSI { 1663}
   (( segid "    " and resid 60   and name HG13))
   (  segid "    " and resid 62   and name HD2%)
      3.100     1.200     1.200 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.19194E-02 ppm1      1.326 ppm2     -0.161 CV     1
 ASSI { 1665}
   (( segid "    " and resid 60   and name HB  ))
   (  segid "    " and resid 62   and name HD2%)
      3.600     1.600     1.600 peak  1665 spectrum    1 weight  0.10000E+01 volume  0.13202E-02 ppm1      1.567 ppm2     -0.164 CV     1
 ASSI { 1666}
   (( segid "    " and resid 60   and name HB  ))
   (  segid "    " and resid 60   and name HG2%)
      2.100     0.600     0.600 peak  1666 spectrum    1 weight  0.10000E+01 volume  0.13984E-01 ppm1      1.568 ppm2      0.803 CV     1
 OR { 1666}
   (( segid "    " and resid 60   and name HB  ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI { 1667}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB3 ))
      2.400     0.700     0.700 peak  1667 spectrum    1 weight  0.10000E+01 volume  0.62151E-02 ppm1      4.354 ppm2      2.363 CV     1
 ASSI { 1668}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      2.700     0.900     0.900 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.75318E-02 ppm1      4.353 ppm2      2.017 CV     1
 ASSI { 1676}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HA  ))
      4.100     2.100     1.900 peak  1676 spectrum    1 weight  0.10000E+01 volume  0.87335E-03 ppm1      4.937 ppm2      4.345 CV     1
 ASSI { 1677}
   (( segid "    " and resid 55   and name HB3 ))
   (( segid "    " and resid 56   and name HD3 ))
      2.900     1.100     1.100 peak  1677 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      2.443 ppm2      4.009 CV     1
 OR { 1677}
   (( segid "    " and resid 55   and name HB3 ))
   (( segid "    " and resid 56   and name HD2 ))
 ASSI { 1678}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HD2 ))
      2.500     0.800     0.800 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.52808E-02 ppm1      4.934 ppm2      4.036 CV     1
 ASSI { 1679}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HD3 ))
      2.500     0.800     0.800 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.55075E-02 ppm1      4.934 ppm2      3.988 CV     1
 ASSI { 1680}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB3 ))
      2.700     0.900     0.900 peak  1680 spectrum    1 weight  0.10000E+01 volume  0.26776E-02 ppm1      4.938 ppm2      2.452 CV     1
 ASSI { 1681}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB2 ))
      3.300     1.400     1.400 peak  1681 spectrum    1 weight  0.10000E+01 volume  0.19464E-02 ppm1      4.937 ppm2      2.876 CV     1
 ASSI { 1683}
   (( segid "    " and resid 55   and name HB3 ))
   (( segid "    " and resid 55   and name HB2 ))
      1.900     0.400     0.400 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.45089E-02 ppm1      2.459 ppm2      2.873 CV     1
 ASSI { 1688}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 55   and name H   ))
      4.300     2.300     1.700 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.17264E-02 ppm1      4.597 ppm2      9.281 CV     1
 ASSI { 1694}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 54   and name H   ))
      2.800     1.000     1.000 peak  1694 spectrum    1 weight  0.10000E+01 volume  0.71121E-02 ppm1      4.587 ppm2      8.263 CV     1
 ASSI { 1697}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.800     1.000     1.000 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.33581E-02 ppm1      4.587 ppm2      2.110 CV     1
 ASSI { 1698}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 53   and name HB2 ))
      2.200     0.600     0.600 peak  1698 spectrum    1 weight  0.10000E+01 volume  0.34664E-02 ppm1      2.612 ppm2      2.109 CV     1
 ASSI { 1700}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB3 ))
      3.100     1.200     1.200 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.27521E-02 ppm1      4.586 ppm2      2.614 CV     1
 ASSI { 1701}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 58   and name HB3 ))
      3.700     1.700     1.700 peak  1701 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      2.122 ppm2      1.909 CV     1
 ASSI { 1703}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 58   and name HB2 ))
      3.300     1.300     1.300 peak  1703 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      2.620 ppm2      1.725 CV     1
 ASSI { 1704}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 58   and name HB3 ))
      3.300     1.300     1.300 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      2.608 ppm2      1.899 CV     1
 ASSI { 1712}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 50   and name H   ))
      3.500     1.500     1.500 peak  1712 spectrum    1 weight  0.10000E+01 volume  0.49456E-02 ppm1      0.868 ppm2      9.128 CV     1
 ASSI { 1713}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 82   and name H   ))
      3.600     1.700     1.700 peak  1713 spectrum    1 weight  0.10000E+01 volume  0.25965E-02 ppm1      0.869 ppm2      8.682 CV     1
 ASSI { 1714}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 81   and name H   ))
      4.100     2.100     1.900 peak  1714 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      0.871 ppm2      8.557 CV     1
 ASSI { 1715}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 52   and name H   ))
      2.900     1.000     1.000 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.32532E-02 ppm1      0.727 ppm2      8.144 CV     1
 ASSI { 1716}
   (  segid "    " and resid 49   and name HD2%)
   (  segid "    " and resid 81   and name HD% )
      2.200     0.600     0.600 peak  1716 spectrum    1 weight  0.10000E+01 volume  0.58460E-02 ppm1      0.869 ppm2      6.815 CV     1
 ASSI { 1720}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 49   and name HA  ))
      2.000     0.500     0.500 peak  1720 spectrum    1 weight  0.10000E+01 volume  0.96205E-02 ppm1      0.869 ppm2      5.426 CV     1
 ASSI { 1721}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 8    and name HA  ))
      4.800     2.900     1.200 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.14319E-02 ppm1      0.867 ppm2      4.898 CV     1
 ASSI { 1722}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 29   and name HA  ))
      3.000     1.100     1.100 peak  1722 spectrum    1 weight  0.10000E+01 volume  0.15470E-02 ppm1      0.870 ppm2      3.935 CV     1
 ASSI { 1723}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 190  and name HB  ))
      3.300     1.300     1.300 peak  1723 spectrum    1 weight  0.10000E+01 volume  0.22409E-02 ppm1      0.698 ppm2      3.893 CV     1
 ASSI { 1724}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 81   and name HB3 ))
      4.300     2.300     1.700 peak  1724 spectrum    1 weight  0.10000E+01 volume  0.18618E-02 ppm1      0.869 ppm2      3.104 CV     1
 ASSI { 1725}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HG  ))
      3.500     1.600     1.600 peak  1725 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      5.435 ppm2      1.769 CV     1
 ASSI { 1726}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 132  and name HG3 ))
      2.700     0.900     0.900 peak  1726 spectrum    1 weight  0.10000E+01 volume  0.70477E-02 ppm1      0.698 ppm2      2.119 CV     1
 ASSI { 1728}
   (  segid "    " and resid 112  and name HD1%)
   (  segid "    " and resid 111  and name HE% )
      3.400     1.400     1.400 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.30195E-02 ppm1      0.746 ppm2      1.914 CV     1
 ASSI { 1729}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 81   and name HB2 ))
      3.200     1.300     1.300 peak  1729 spectrum    1 weight  0.10000E+01 volume  0.22172E-02 ppm1      0.871 ppm2      2.433 CV     1
 ASSI { 1730}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 79   and name HG2 ))
      3.200     1.300     1.300 peak  1730 spectrum    1 weight  0.10000E+01 volume  0.31177E-02 ppm1      0.868 ppm2      2.145 CV     1
 ASSI { 1733}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 49   and name HD1%)
      4.000     2.000     2.000 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.15571E-02 ppm1      5.432 ppm2      0.743 CV     1
 ASSI { 1734}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HB3 ))
      2.800     1.000     1.000 peak  1734 spectrum    1 weight  0.10000E+01 volume  0.10122E-02 ppm1      5.427 ppm2      1.282 CV     1
 ASSI { 1736}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HB2 ))
      1.800     0.400     0.400 peak  1736 spectrum    1 weight  0.10000E+01 volume  0.48069E-02 ppm1      1.293 ppm2      1.574 CV     1
 ASSI { 1745}
   (  segid "    " and resid 49   and name HD2%)
   (  segid "    " and resid 62   and name HD1%)
      3.900     1.900     1.900 peak  1745 spectrum    1 weight  0.10000E+01 volume  0.24982E-02 ppm1      0.868 ppm2      0.397 CV     1
 ASSI { 1746}
   (  segid "    " and resid 49   and name HD2%)
   (  segid "    " and resid 68   and name HD2%)
      4.000     2.000     2.000 peak  1746 spectrum    1 weight  0.10000E+01 volume  0.16587E-02 ppm1      0.866 ppm2      0.301 CV     1
 OR { 1746}
   (  segid "    " and resid 49   and name HD2%)
   (  segid "    " and resid 68   and name HD1%)
 ASSI { 1747}
   (  segid "    " and resid 49   and name HD2%)
   (  segid "    " and resid 32   and name HD1%)
      3.400     1.400     1.400 peak  1747 spectrum    1 weight  0.10000E+01 volume  0.20886E-02 ppm1      0.868 ppm2      0.112 CV     1
 ASSI { 1749}
   (  segid "    " and resid 49   and name HD2%)
   (  segid "    " and resid 62   and name HD2%)
      5.300     3.500     0.700 peak  1749 spectrum    1 weight  0.10000E+01 volume  0.10798E-02 ppm1      0.871 ppm2     -0.157 CV     1
 ASSI { 1750}
   (( segid "    " and resid 48   and name HA3 ))
   (( segid "    " and resid 48   and name HA2 ))
      2.200     0.600     0.600 peak  1750 spectrum    1 weight  0.10000E+01 volume  0.26200E-02 ppm1      4.474 ppm2      3.934 CV     1
 ASSI { 1752}
   (( segid "    " and resid 48   and name HA3 ))
   (( segid "    " and resid 61   and name HZ3 ))
      3.400     1.500     1.500 peak  1752 spectrum    1 weight  0.10000E+01 volume  0.58900E-03 ppm1      4.466 ppm2      6.607 CV     1
 ASSI { 1760}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 46   and name H   ))
      3.300     1.300     1.300 peak  1760 spectrum    1 weight  0.10000E+01 volume  0.19938E-02 ppm1      4.633 ppm2      7.857 CV     1
 ASSI { 1761}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 46   and name H   ))
      3.500     1.600     1.600 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.16181E-02 ppm1      2.760 ppm2      7.850 CV     1
 OR { 1761}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 46   and name H   ))
 ASSI { 1762}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HD21))
      3.000     1.100     1.100 peak  1762 spectrum    1 weight  0.10000E+01 volume  0.16147E-02 ppm1      2.750 ppm2      7.562 CV     1
 OR { 1762}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 45   and name HD21))
 ASSI { 1764}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 45   and name HA  ))
      2.500     0.800     0.800 peak  1764 spectrum    1 weight  0.10000E+01 volume  0.81885E-02 ppm1      2.759 ppm2      4.621 CV     1
 OR { 1764}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HA  ))
 ASSI { 1765}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 44   and name HA  ))
      3.800     1.800     1.800 peak  1765 spectrum    1 weight  0.10000E+01 volume  0.10291E-02 ppm1      4.623 ppm2      4.216 CV     1
 ASSI { 1766}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB3 ))
      2.200     0.600     0.600 peak  1766 spectrum    1 weight  0.10000E+01 volume  0.12650E-01 ppm1      4.625 ppm2      2.756 CV     1
 ASSI { 1768}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 43   and name HB2 ))
      4.400     2.400     1.600 peak  1768 spectrum    1 weight  0.10000E+01 volume  0.10426E-02 ppm1      4.624 ppm2      1.984 CV     1
 ASSI { 1769}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 42   and name HA3 ))
      2.100     0.600     0.600 peak  1769 spectrum    1 weight  0.10000E+01 volume  0.46715E-02 ppm1      4.259 ppm2      4.093 CV     1
 ASSI { 1771}
   (( segid "    " and resid 42   and name HA3 ))
   (( segid "    " and resid 43   and name HD3 ))
      2.500     0.800     0.800 peak  1771 spectrum    1 weight  0.10000E+01 volume  0.33175E-02 ppm1      4.094 ppm2      3.670 CV     1
 OR { 1771}
   (( segid "    " and resid 42   and name HA3 ))
   (( segid "    " and resid 43   and name HD2 ))
 ASSI { 1772}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HD2 ))
      3.600     1.600     1.600 peak  1772 spectrum    1 weight  0.10000E+01 volume  0.40621E-02 ppm1      4.262 ppm2      3.669 CV     1
 OR { 1772}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HD3 ))
 ASSI { 1773}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HB3 ))
      5.100     3.200     0.900 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      4.252 ppm2      2.327 CV     1
 ASSI { 1774}
   (( segid "    " and resid 42   and name HA3 ))
   (( segid "    " and resid 43   and name HB3 ))
      5.000     3.100     1.000 peak  1774 spectrum    1 weight  0.10000E+01 volume  0.60254E-03 ppm1      4.100 ppm2      2.320 CV     1
 ASSI { 1775}
   (( segid "    " and resid 42   and name HA3 ))
   (( segid "    " and resid 43   and name HG2 ))
      4.900     3.000     1.100 peak  1775 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      4.085 ppm2      1.976 CV     1
 OR { 1775}
   (( segid "    " and resid 42   and name HA3 ))
   (( segid "    " and resid 43   and name HG3 ))
 ASSI { 1776}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HG3 ))
      5.300     3.500     0.700 peak  1776 spectrum    1 weight  0.10000E+01 volume  0.14861E-02 ppm1      4.261 ppm2      1.969 CV     1
 OR { 1776}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI { 1777}
   (( segid "    " and resid 42   and name HA2 ))
   (  segid "    " and resid 41   and name HB% )
      4.500     2.600     1.500 peak  1777 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      4.247 ppm2      1.354 CV     1
 ASSI { 1779}
   (( segid "    " and resid 42   and name HA2 ))
   (  segid "    " and resid 47   and name HE% )
      5.500     3.800     0.500 peak  1779 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      4.265 ppm2      7.097 CV     1
 ASSI { 1782}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 42   and name H   ))
      2.700     0.900     0.900 peak  1782 spectrum    1 weight  0.10000E+01 volume  0.49661E-02 ppm1      4.228 ppm2      7.588 CV     1
 ASSI { 1784}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 41   and name H   ))
      2.300     0.600     0.600 peak  1784 spectrum    1 weight  0.10000E+01 volume  0.18913E-01 ppm1      1.354 ppm2      7.363 CV     1
 ASSI { 1786}
   (  segid "    " and resid 41   and name HB% )
   (  segid "    " and resid 47   and name HE% )
      3.000     1.100     1.100 peak  1786 spectrum    1 weight  0.10000E+01 volume  0.36119E-02 ppm1      1.354 ppm2      7.130 CV     1
 ASSI { 1787}
   (  segid "    " and resid 41   and name HB% )
   (  segid "    " and resid 81   and name HD% )
      4.100     2.100     1.900 peak  1787 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      1.353 ppm2      6.787 CV     1
 ASSI { 1788}
   (  segid "    " and resid 41   and name HB% )
   (  segid "    " and resid 47   and name HD% )
      4.200     2.200     1.800 peak  1788 spectrum    1 weight  0.10000E+01 volume  0.96476E-03 ppm1      1.353 ppm2      6.722 CV     1
 ASSI { 1789}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 39   and name HA  ))
      3.500     1.500     1.500 peak  1789 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1      1.359 ppm2      4.020 CV     1
 ASSI { 1790}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 41   and name HA  ))
      2.000     0.500     0.500 peak  1790 spectrum    1 weight  0.10000E+01 volume  0.26492E-01 ppm1      1.354 ppm2      4.225 CV     1
 ASSI { 1791}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 42   and name HA3 ))
      3.600     1.700     1.700 peak  1791 spectrum    1 weight  0.10000E+01 volume  0.12931E-02 ppm1      1.353 ppm2      4.126 CV     1
 ASSI { 1792}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 38   and name HA  ))
      3.300     1.300     1.300 peak  1792 spectrum    1 weight  0.10000E+01 volume  0.19363E-02 ppm1      1.353 ppm2      3.925 CV     1
 ASSI { 1794}
   (  segid "    " and resid 41   and name HB% )
   (  segid "    " and resid 10   and name HG2%)
      2.100     2.100     3.900 peak  1794 spectrum    1 weight  0.10000E+01 volume  0.27148E-02 ppm1      1.352 ppm2      0.853 CV     1
 ASSI { 1795}
   (  segid "    " and resid 41   and name HB% )
   (  segid "    " and resid 10   and name HD1%)
      2.200     2.200     3.800 peak  1795 spectrum    1 weight  0.10000E+01 volume  0.23120E-02 ppm1      1.354 ppm2      0.683 CV     1
 ASSI { 1796}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 40   and name HD1%)
      4.300     2.300     1.700 peak  1796 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      4.226 ppm2      0.848 CV     1
 ASSI { 1797}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
      3.800     1.800     1.800 peak  1797 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      4.228 ppm2      0.734 CV     1
 ASSI { 1798}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 42   and name H   ))
      3.200     3.200     2.800 peak  1798 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      0.735 ppm2      7.614 CV     1
 ASSI { 1801}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name H   ))
      3.200     1.300     1.300 peak  1801 spectrum    1 weight  0.10000E+01 volume  0.30229E-02 ppm1      1.696 ppm2      7.367 CV     1
 ASSI { 1802}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 42   and name H   ))
      3.500     1.500     1.500 peak  1802 spectrum    1 weight  0.10000E+01 volume  0.10426E-02 ppm1      4.217 ppm2      7.589 CV     1
 ASSI { 1804}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name H   ))
      2.900     1.000     1.000 peak  1804 spectrum    1 weight  0.10000E+01 volume  0.16722E-02 ppm1      4.218 ppm2      6.779 CV     1
 ASSI { 1807}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 39   and name H   ))
      3.500     1.500     1.500 peak  1807 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      0.844 ppm2      7.998 CV     1
 ASSI { 1808}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 39   and name H   ))
      4.100     2.100     1.900 peak  1808 spectrum    1 weight  0.10000E+01 volume  0.13134E-02 ppm1      0.736 ppm2      8.001 CV     1
 ASSI { 1810}
   (  segid "    " and resid 40   and name HD2%)
   (  segid "    " and resid 47   and name HD% )
      4.000     2.000     2.000 peak  1810 spectrum    1 weight  0.10000E+01 volume  0.18686E-02 ppm1      0.736 ppm2      6.736 CV     1
 ASSI { 1811}
   (  segid "    " and resid 40   and name HD2%)
   (  segid "    " and resid 81   and name HE% )
      4.800     2.900     1.200 peak  1811 spectrum    1 weight  0.10000E+01 volume  0.11645E-02 ppm1      0.735 ppm2      6.316 CV     1
 ASSI { 1813}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 37   and name HA  ))
      2.200     0.600     0.600 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.75217E-02 ppm1      0.845 ppm2      4.159 CV     1
 ASSI { 1816}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 38   and name HA  ))
      3.700     1.700     1.700 peak  1816 spectrum    1 weight  0.10000E+01 volume  0.12593E-02 ppm1      0.736 ppm2      3.947 CV     1
 ASSI { 1817}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 33   and name HA  ))
      2.100     2.100     3.900 peak  1817 spectrum    1 weight  0.10000E+01 volume  0.31583E-02 ppm1      0.736 ppm2      3.554 CV     1
 ASSI { 1818}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 38   and name HA  ))
      3.600     1.600     1.600 peak  1818 spectrum    1 weight  0.10000E+01 volume  0.11848E-02 ppm1      0.843 ppm2      3.944 CV     1
 ASSI { 1819}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 33   and name HA  ))
      2.700     0.900     0.900 peak  1819 spectrum    1 weight  0.10000E+01 volume  0.13879E-02 ppm1      0.842 ppm2      3.555 CV     1
 ASSI { 1820}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.500     1.500     1.500 peak  1820 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      4.220 ppm2      2.050 CV     1
 ASSI { 1822}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 40   and name HG  ))
      2.000     0.500     0.500 peak  1822 spectrum    1 weight  0.10000E+01 volume  0.15003E-01 ppm1      0.737 ppm2      1.610 CV     1
 ASSI { 1823}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 37   and name HB3 ))
      3.600     1.700     1.700 peak  1823 spectrum    1 weight  0.10000E+01 volume  0.24102E-02 ppm1      0.846 ppm2      2.255 CV     1
 ASSI { 1825}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HG  ))
      1.800     0.400     0.400 peak  1825 spectrum    1 weight  0.10000E+01 volume  0.19004E-01 ppm1      0.842 ppm2      1.591 CV     1
 ASSI { 1826}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 40   and name HB2 ))
      1.900     0.400     0.400 peak  1826 spectrum    1 weight  0.10000E+01 volume  0.50844E-02 ppm1      1.548 ppm2      1.695 CV     1
 ASSI { 1828}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.600     0.800     0.800 peak  1828 spectrum    1 weight  0.10000E+01 volume  0.33478E-02 ppm1      4.216 ppm2      1.689 CV     1
 ASSI { 1829}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB3 ))
      2.300     0.700     0.700 peak  1829 spectrum    1 weight  0.10000E+01 volume  0.44717E-02 ppm1      4.217 ppm2      1.543 CV     1
 ASSI { 1830}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB3 ))
      2.600     0.800     0.800 peak  1830 spectrum    1 weight  0.10000E+01 volume  0.20514E-02 ppm1      4.216 ppm2      1.346 CV     1
 ASSI { 1832}
   (( segid "    " and resid 40   and name HB3 ))
   (  segid "    " and resid 40   and name HD1%)
      2.500     0.800     0.800 peak  1832 spectrum    1 weight  0.10000E+01 volume  0.41908E-02 ppm1      1.547 ppm2      0.844 CV     1
 ASSI { 1833}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 40   and name HD1%)
      3.200     1.300     1.300 peak  1833 spectrum    1 weight  0.10000E+01 volume  0.48374E-02 ppm1      1.698 ppm2      0.845 CV     1
 ASSI { 1834}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
      2.900     1.100     1.100 peak  1834 spectrum    1 weight  0.10000E+01 volume  0.90483E-02 ppm1      4.218 ppm2      0.735 CV     1
 ASSI { 1836}
   (  segid "    " and resid 40   and name HD2%)
   (  segid "    " and resid 40   and name HD1%)
      1.800     0.400     0.400 peak  1836 spectrum    1 weight  0.10000E+01 volume  0.34273E-01 ppm1      0.737 ppm2      0.842 CV     1
 ASSI { 1838}
   (  segid "    " and resid 39   and name HB% )
   (  segid "    " and resid 32   and name HD1%)
      2.300     0.700     0.700 peak  1838 spectrum    1 weight  0.10000E+01 volume  0.74168E-02 ppm1      1.110 ppm2      0.110 CV     1
 ASSI { 1839}
   (  segid "    " and resid 39   and name HB% )
   (  segid "    " and resid 40   and name HD1%)
      2.400     0.700     0.700 peak  1839 spectrum    1 weight  0.10000E+01 volume  0.93902E-02 ppm1      1.109 ppm2      0.848 CV     1
 ASSI { 1841}
   (( segid "    " and resid 39   and name HA  ))
   (  segid "    " and resid 10   and name HG2%)
      3.000     1.100     1.100 peak  1841 spectrum    1 weight  0.10000E+01 volume  0.25625E-02 ppm1      4.022 ppm2      0.862 CV     1
 ASSI { 1844}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 36   and name HB  ))
      2.400     0.700     0.700 peak  1844 spectrum    1 weight  0.10000E+01 volume  0.49356E-02 ppm1      1.109 ppm2      1.866 CV     1
 ASSI { 1845}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 33   and name HB3 ))
      3.300     1.400     1.400 peak  1845 spectrum    1 weight  0.10000E+01 volume  0.48374E-02 ppm1      1.108 ppm2      1.689 CV     1
 ASSI { 1847}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 10   and name HG13))
      5.000     3.100     1.000 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      4.020 ppm2      1.580 CV     1
 ASSI { 1848}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 18   and name HB2 ))
      3.300     1.400     1.400 peak  1848 spectrum    1 weight  0.10000E+01 volume  0.82394E-02 ppm1      1.105 ppm2      1.587 CV     1
 ASSI { 1849}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 18   and name HB3 ))
      2.300     0.600     0.600 peak  1849 spectrum    1 weight  0.10000E+01 volume  0.74946E-02 ppm1      1.106 ppm2      1.455 CV     1
 ASSI { 1850}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 18   and name HG2 ))
      2.500     0.800     0.800 peak  1850 spectrum    1 weight  0.10000E+01 volume  0.83782E-02 ppm1      1.106 ppm2      2.025 CV     1
 ASSI { 1851}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 20   and name HG2 ))
      3.100     1.200     1.200 peak  1851 spectrum    1 weight  0.10000E+01 volume  0.25354E-02 ppm1      1.105 ppm2      2.355 CV     1
 ASSI { 1852}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid -1   and name HB2 ))
      1.900     1.900     4.100 peak  1852 spectrum    1 weight  0.10000E+01 volume  0.49185E-02 ppm1      1.106 ppm2      3.103 CV     1
 ASSI { 1853}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid -1   and name HB3 ))
      2.900     1.100     1.100 peak  1853 spectrum    1 weight  0.10000E+01 volume  0.21225E-02 ppm1      1.108 ppm2      2.986 CV     1
 ASSI { 1854}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 2    and name HA  ))
      3.300     1.300     1.300 peak  1854 spectrum    1 weight  0.10000E+01 volume  0.55313E-02 ppm1      1.106 ppm2      4.110 CV     1
 ASSI { 1855}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 21   and name HD3 ))
      3.800     1.800     1.800 peak  1855 spectrum    1 weight  0.10000E+01 volume  0.29348E-02 ppm1      1.106 ppm2      3.812 CV     1
 ASSI { 1856}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 33   and name HA  ))
      2.600     0.800     0.800 peak  1856 spectrum    1 weight  0.10000E+01 volume  0.54840E-02 ppm1      1.109 ppm2      3.557 CV     1
 ASSI { 1857}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 39   and name HA  ))
      2.000     0.500     0.500 peak  1857 spectrum    1 weight  0.10000E+01 volume  0.11347E-01 ppm1      1.110 ppm2      4.021 CV     1
 ASSI { 1859}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 20   and name HA  ))
      3.100     1.200     1.200 peak  1859 spectrum    1 weight  0.10000E+01 volume  0.34731E-02 ppm1      1.106 ppm2      4.655 CV     1
 ASSI { 1860}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid -1   and name HA  ))
      3.400     1.500     1.500 peak  1860 spectrum    1 weight  0.10000E+01 volume  0.15944E-02 ppm1      1.110 ppm2      4.522 CV     1
 ASSI { 1861}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 3    and name HA  ))
      2.000     0.500     0.500 peak  1861 spectrum    1 weight  0.10000E+01 volume  0.14729E-01 ppm1      1.105 ppm2      4.278 CV     1
 ASSI { 1862}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 18   and name HA  ))
      3.900     1.900     1.900 peak  1862 spectrum    1 weight  0.10000E+01 volume  0.22612E-02 ppm1      1.104 ppm2      5.261 CV     1
 ASSI { 1864}
   (  segid "    " and resid 39   and name HB% )
   (  segid "    " and resid 81   and name HE% )
      2.700     0.900     0.900 peak  1864 spectrum    1 weight  0.10000E+01 volume  0.38589E-02 ppm1      1.109 ppm2      6.309 CV     1
 ASSI { 1865}
   (  segid "    " and resid 39   and name HB% )
   (  segid "    " and resid 81   and name HD% )
      2.900     1.000     1.000 peak  1865 spectrum    1 weight  0.10000E+01 volume  0.25253E-02 ppm1      1.109 ppm2      6.812 CV     1
 ASSI { 1866}
   (( segid "    " and resid 39   and name HA  ))
   (  segid "    " and resid 81   and name HD% )
      3.000     1.100     1.100 peak  1866 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1      4.024 ppm2      6.809 CV     1
 ASSI { 1867}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 18   and name HE22))
      4.300     2.400     1.700 peak  1867 spectrum    1 weight  0.10000E+01 volume  0.19194E-02 ppm1      1.104 ppm2      6.681 CV     1
 ASSI { 1868}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 40   and name H   ))
      2.200     0.600     0.600 peak  1868 spectrum    1 weight  0.10000E+01 volume  0.44345E-02 ppm1      1.110 ppm2      7.370 CV     1
 ASSI { 1870}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 18   and name HE21))
      3.900     1.900     1.900 peak  1870 spectrum    1 weight  0.10000E+01 volume  0.35612E-02 ppm1      1.106 ppm2      7.209 CV     1
 ASSI { 1871}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 75   and name HD22))
      3.900     1.900     1.900 peak  1871 spectrum    1 weight  0.10000E+01 volume  0.11374E-02 ppm1      1.105 ppm2      7.054 CV     1
 ASSI { 1872}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 33   and name HE  ))
      3.700     1.800     1.800 peak  1872 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      1.108 ppm2      7.660 CV     1
 ASSI { 1873}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 39   and name H   ))
      2.100     0.600     0.600 peak  1873 spectrum    1 weight  0.10000E+01 volume  0.11384E-01 ppm1      1.110 ppm2      7.999 CV     1
 ASSI { 1874}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name H   ))
      2.600     0.900     0.900 peak  1874 spectrum    1 weight  0.10000E+01 volume  0.29686E-02 ppm1      4.022 ppm2      8.001 CV     1
 ASSI { 1875}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 19   and name H   ))
      3.000     1.100     1.100 peak  1875 spectrum    1 weight  0.10000E+01 volume  0.40181E-02 ppm1      1.106 ppm2      8.835 CV     1
 ASSI { 1876}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 4    and name H   ))
      2.600     0.800     0.800 peak  1876 spectrum    1 weight  0.10000E+01 volume  0.10930E-01 ppm1      1.105 ppm2      8.731 CV     1
 ASSI { 1877}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 20   and name H   ))
      4.000     2.000     2.000 peak  1877 spectrum    1 weight  0.10000E+01 volume  0.10426E-02 ppm1      1.107 ppm2      9.211 CV     1
 ASSI { 1878}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 38   and name H   ))
      4.300     2.300     1.700 peak  1878 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      1.109 ppm2      9.459 CV     1
 ASSI { 1879}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name H   ))
      2.700     0.900     0.900 peak  1879 spectrum    1 weight  0.10000E+01 volume  0.37202E-02 ppm1      3.925 ppm2      9.459 CV     1
 ASSI { 1883}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 38   and name H   ))
      3.200     1.300     1.300 peak  1883 spectrum    1 weight  0.10000E+01 volume  0.14048E-02 ppm1      2.229 ppm2      9.454 CV     1
 ASSI { 1884}
   (( segid "    " and resid 38   and name HG3 ))
   (( segid "    " and resid 38   and name H   ))
      3.800     1.800     1.800 peak  1884 spectrum    1 weight  0.10000E+01 volume  0.14454E-02 ppm1      2.435 ppm2      9.461 CV     1
 ASSI { 1885}
   (( segid "    " and resid 38   and name HG3 ))
   (( segid "    " and resid 39   and name H   ))
      4.700     2.800     1.300 peak  1885 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      2.411 ppm2      8.020 CV     1
 ASSI { 1886}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name H   ))
      3.200     1.300     1.300 peak  1886 spectrum    1 weight  0.10000E+01 volume  0.18110E-02 ppm1      3.924 ppm2      8.003 CV     1
 ASSI { 1889}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 22   and name H   ))
      3.600     1.600     1.600 peak  1889 spectrum    1 weight  0.10000E+01 volume  0.67702E-03 ppm1      1.908 ppm2      7.376 CV     1
 ASSI { 1890}
   (( segid "    " and resid 182  and name HG3 ))
   (( segid "    " and resid 183  and name H   ))
      3.700     1.700     1.700 peak  1890 spectrum    1 weight  0.10000E+01 volume  0.97153E-03 ppm1      2.226 ppm2      7.159 CV     1
 ASSI { 1893}
   (( segid "    " and resid 38   and name HG3 ))
   (( segid "    " and resid 38   and name HA  ))
      3.100     1.200     1.200 peak  1893 spectrum    1 weight  0.10000E+01 volume  0.28841E-02 ppm1      2.431 ppm2      3.920 CV     1
 ASSI { 1895}
   (( segid "    " and resid 38   and name HG3 ))
   (( segid "    " and resid 38   and name HG2 ))
      1.900     0.500     0.500 peak  1895 spectrum    1 weight  0.10000E+01 volume  0.82970E-02 ppm1      2.430 ppm2      2.233 CV     1
 ASSI { 1896}
   (( segid "    " and resid 38   and name HG3 ))
   (( segid "    " and resid 38   and name HB3 ))
      2.800     1.000     1.000 peak  1896 spectrum    1 weight  0.10000E+01 volume  0.29485E-02 ppm1      2.427 ppm2      1.914 CV     1
 ASSI { 1897}
   (( segid "    " and resid 38   and name HG3 ))
   (( segid "    " and resid 38   and name HB2 ))
      3.000     1.100     1.100 peak  1897 spectrum    1 weight  0.10000E+01 volume  0.28603E-02 ppm1      2.428 ppm2      1.792 CV     1
 ASSI { 1898}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 38   and name HB2 ))
      2.800     1.000     1.000 peak  1898 spectrum    1 weight  0.10000E+01 volume  0.28469E-02 ppm1      2.231 ppm2      1.793 CV     1
 ASSI { 1900}
   (( segid "    " and resid 182  and name HG3 ))
   (( segid "    " and resid 182  and name HG2 ))
      2.000     0.500     0.500 peak  1900 spectrum    1 weight  0.10000E+01 volume  0.59205E-02 ppm1      2.224 ppm2      2.565 CV     1
 ASSI { 1905}
   (( segid "    " and resid 38   and name HB3 ))
   (( segid "    " and resid 38   and name HG2 ))
      3.200     1.300     1.300 peak  1905 spectrum    1 weight  0.10000E+01 volume  0.18246E-02 ppm1      1.922 ppm2      2.233 CV     1
 ASSI { 1906}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HB3 ))
      1.900     0.400     0.400 peak  1906 spectrum    1 weight  0.10000E+01 volume  0.39571E-02 ppm1      1.901 ppm2      2.127 CV     1
 ASSI { 1908}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HG2 ))
      3.100     1.200     1.200 peak  1908 spectrum    1 weight  0.10000E+01 volume  0.43735E-02 ppm1      3.924 ppm2      2.237 CV     1
 ASSI { 1909}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB3 ))
      2.600     0.900     0.900 peak  1909 spectrum    1 weight  0.10000E+01 volume  0.40385E-02 ppm1      3.925 ppm2      1.921 CV     1
 ASSI { 1910}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
      2.900     1.100     1.100 peak  1910 spectrum    1 weight  0.10000E+01 volume  0.38827E-02 ppm1      3.924 ppm2      1.790 CV     1
 ASSI { 1911}
   (( segid "    " and resid 38   and name HB3 ))
   (( segid "    " and resid 38   and name HB2 ))
      2.300     0.600     0.600 peak  1911 spectrum    1 weight  0.10000E+01 volume  0.25524E-02 ppm1      1.922 ppm2      1.788 CV     1
 ASSI { 1913}
   (( segid "    " and resid 182  and name HG3 ))
   (  segid "    " and resid 179  and name HG2%)
      5.000     3.100     1.000 peak  1913 spectrum    1 weight  0.10000E+01 volume  0.75827E-03 ppm1      2.226 ppm2      1.180 CV     1
 ASSI { 1920}
   (( segid "    " and resid 38   and name HB3 ))
   (  segid "    " and resid 10   and name HD1%)
      3.700     1.700     1.700 peak  1920 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.922 ppm2      0.684 CV     1
 ASSI { 1921}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 10   and name HD1%)
      3.500     1.500     1.500 peak  1921 spectrum    1 weight  0.10000E+01 volume  0.62624E-03 ppm1      1.792 ppm2      0.680 CV     1
 ASSI { 1922}
   (( segid "    " and resid 38   and name HG2 ))
   (  segid "    " and resid 13   and name HG1%)
      3.500     1.600     1.600 peak  1922 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      2.225 ppm2      0.907 CV     1
 ASSI { 1925}
   (( segid "    " and resid 37   and name HB2 ))
   (  segid "    " and resid 40   and name HD1%)
      4.100     2.100     1.900 peak  1925 spectrum    1 weight  0.10000E+01 volume  0.13270E-02 ppm1      1.815 ppm2      0.841 CV     1
 ASSI { 1926}
   (( segid "    " and resid 37   and name HD2 ))
   (  segid "    " and resid 36   and name HG2%)
      3.500     1.500     1.500 peak  1926 spectrum    1 weight  0.10000E+01 volume  0.23594E-02 ppm1      3.752 ppm2      0.840 CV     1
 OR { 1926}
   (( segid "    " and resid 37   and name HD3 ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 1927}
   (( segid "    " and resid 37   and name HD2 ))
   (  segid "    " and resid 10   and name HD1%)
      4.200     2.200     1.800 peak  1927 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      3.741 ppm2      0.669 CV     1
 ASSI { 1929}
   (( segid "    " and resid 37   and name HG2 ))
   (  segid "    " and resid 40   and name HD2%)
      4.700     2.800     1.300 peak  1929 spectrum    1 weight  0.10000E+01 volume  0.76843E-03 ppm1      2.034 ppm2      0.736 CV     1
 ASSI { 1930}
   (( segid "    " and resid 37   and name HG3 ))
   (  segid "    " and resid 36   and name HG2%)
      5.100     3.200     0.900 peak  1930 spectrum    1 weight  0.10000E+01 volume  0.11408E-02 ppm1      1.911 ppm2      0.848 CV     1
 ASSI { 1931}
   (( segid "    " and resid 37   and name HG3 ))
   (  segid "    " and resid 40   and name HD2%)
      5.000     3.100     1.000 peak  1931 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      1.899 ppm2      0.743 CV     1
 ASSI { 1932}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
      3.800     1.800     1.800 peak  1932 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      4.157 ppm2      0.732 CV     1
 ASSI { 1934}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HB3 ))
      2.400     0.700     0.700 peak  1934 spectrum    1 weight  0.10000E+01 volume  0.50844E-02 ppm1      4.156 ppm2      2.252 CV     1
 ASSI { 1936}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HG3 ))
      3.700     1.700     1.700 peak  1936 spectrum    1 weight  0.10000E+01 volume  0.29180E-02 ppm1      4.155 ppm2      1.899 CV     1
 ASSI { 1937}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HB2 ))
      2.900     1.000     1.000 peak  1937 spectrum    1 weight  0.10000E+01 volume  0.38522E-02 ppm1      4.155 ppm2      1.806 CV     1
 ASSI { 1938}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 40   and name HG  ))
      4.000     2.000     2.000 peak  1938 spectrum    1 weight  0.10000E+01 volume  0.17467E-02 ppm1      4.153 ppm2      1.608 CV     1
 ASSI { 1939}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HG2 ))
      2.400     0.700     0.700 peak  1939 spectrum    1 weight  0.10000E+01 volume  0.46172E-02 ppm1      1.808 ppm2      2.026 CV     1
 ASSI { 1940}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HB3 ))
      1.900     0.400     0.400 peak  1940 spectrum    1 weight  0.10000E+01 volume  0.86692E-02 ppm1      1.809 ppm2      2.251 CV     1
 ASSI { 1944}
   (( segid "    " and resid 37   and name HD3 ))
   (( segid "    " and resid 37   and name HB2 ))
      4.100     2.100     1.900 peak  1944 spectrum    1 weight  0.10000E+01 volume  0.16655E-02 ppm1      3.751 ppm2      1.801 CV     1
 OR { 1944}
   (( segid "    " and resid 37   and name HD2 ))
   (( segid "    " and resid 37   and name HB2 ))
 ASSI { 1946}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 56   and name HB3 ))
      2.300     0.700     0.700 peak  1946 spectrum    1 weight  0.10000E+01 volume  0.82156E-02 ppm1      2.026 ppm2      2.358 CV     1
 OR { 1946}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HB3 ))
 ASSI { 1947}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HB3 ))
      3.000     1.200     1.200 peak  1947 spectrum    1 weight  0.10000E+01 volume  0.44006E-02 ppm1      2.027 ppm2      2.253 CV     1
 ASSI { 1948}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 37   and name HB3 ))
      2.500     0.800     0.800 peak  1948 spectrum    1 weight  0.10000E+01 volume  0.38049E-02 ppm1      1.902 ppm2      2.252 CV     1
 ASSI { 1950}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HA  ))
      4.000     2.000     2.000 peak  1950 spectrum    1 weight  0.10000E+01 volume  0.80567E-03 ppm1      4.161 ppm2      3.920 CV     1
 ASSI { 1951}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HD3 ))
      3.600     1.600     1.600 peak  1951 spectrum    1 weight  0.10000E+01 volume  0.16045E-02 ppm1      4.154 ppm2      3.741 CV     1
 OR { 1951}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HD2 ))
 ASSI { 1952}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HD2 ))
      3.400     1.500     1.500 peak  1952 spectrum    1 weight  0.10000E+01 volume  0.23527E-02 ppm1      2.255 ppm2      3.750 CV     1
 OR { 1952}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HD3 ))
 ASSI { 1953}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HD3 ))
      3.900     1.900     1.900 peak  1953 spectrum    1 weight  0.10000E+01 volume  0.23933E-02 ppm1      1.808 ppm2      3.749 CV     1
 ASSI { 1956}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HA  ))
      3.600     1.600     1.600 peak  1956 spectrum    1 weight  0.10000E+01 volume  0.32090E-02 ppm1      2.027 ppm2      4.147 CV     1
 ASSI { 1957}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HD3 ))
      2.500     0.800     0.800 peak  1957 spectrum    1 weight  0.10000E+01 volume  0.51454E-02 ppm1      2.027 ppm2      3.748 CV     1
 OR { 1957}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HD2 ))
 ASSI { 1960}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 36   and name HA  ))
      5.500     3.800     0.500 peak  1960 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      1.801 ppm2      4.512 CV     1
 ASSI { 1963}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 36   and name HA  ))
      4.700     2.800     1.300 peak  1963 spectrum    1 weight  0.10000E+01 volume  0.12694E-02 ppm1      2.025 ppm2      4.501 CV     1
 ASSI { 1964}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 36   and name HA  ))
      5.000     3.100     1.000 peak  1964 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      1.909 ppm2      4.511 CV     1
 ASSI { 1965}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 40   and name H   ))
      3.900     1.900     1.900 peak  1965 spectrum    1 weight  0.10000E+01 volume  0.14014E-02 ppm1      4.154 ppm2      7.368 CV     1
 ASSI { 1966}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 39   and name H   ))
      3.400     1.500     1.500 peak  1966 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      4.157 ppm2      7.995 CV     1
 ASSI { 1967}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HE  ))
      2.900     1.100     1.100 peak  1967 spectrum    1 weight  0.10000E+01 volume  0.90044E-03 ppm1      1.814 ppm2      7.377 CV     1
 OR { 1967}
   (( segid "    " and resid 86   and name HB3 ))
   (( segid "    " and resid 86   and name HE  ))
 ASSI { 1968}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 58   and name H   ))
      4.400     2.400     1.600 peak  1968 spectrum    1 weight  0.10000E+01 volume  0.69056E-03 ppm1      1.812 ppm2      8.008 CV     1
 ASSI { 1971}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 38   and name H   ))
      4.600     2.700     1.400 peak  1971 spectrum    1 weight  0.10000E+01 volume  0.83273E-03 ppm1      1.913 ppm2      9.460 CV     1
 ASSI { 1972}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 38   and name H   ))
      3.200     1.300     1.300 peak  1972 spectrum    1 weight  0.10000E+01 volume  0.11848E-02 ppm1      2.025 ppm2      9.452 CV     1
 ASSI { 1974}
   (( segid "    " and resid 37   and name HD2 ))
   (( segid "    " and resid 38   and name H   ))
      3.300     1.400     1.400 peak  1974 spectrum    1 weight  0.10000E+01 volume  0.90044E-03 ppm1      3.750 ppm2      9.452 CV     1
 OR { 1974}
   (( segid "    " and resid 37   and name HD3 ))
   (( segid "    " and resid 38   and name H   ))
 ASSI { 1975}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 38   and name H   ))
      3.300     1.400     1.400 peak  1975 spectrum    1 weight  0.10000E+01 volume  0.16384E-02 ppm1      1.804 ppm2      9.458 CV     1
 ASSI { 1976}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 38   and name H   ))
      4.100     2.100     1.900 peak  1976 spectrum    1 weight  0.10000E+01 volume  0.12186E-02 ppm1      2.252 ppm2      9.457 CV     1
 ASSI { 1977}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name H   ))
      3.100     1.200     1.200 peak  1977 spectrum    1 weight  0.10000E+01 volume  0.16790E-02 ppm1      4.153 ppm2      9.456 CV     1
 ASSI { 1978}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 38   and name H   ))
      2.400     0.700     0.700 peak  1978 spectrum    1 weight  0.10000E+01 volume  0.56362E-02 ppm1      0.834 ppm2      9.458 CV     1
 ASSI { 1979}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 38   and name H   ))
      2.600     2.600     3.400 peak  1979 spectrum    1 weight  0.10000E+01 volume  0.90382E-03 ppm1      0.662 ppm2      9.459 CV     1
 ASSI { 1983}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name H   ))
      3.600     1.700     1.700 peak  1983 spectrum    1 weight  0.10000E+01 volume  0.33276E-02 ppm1      0.663 ppm2      7.977 CV     1
 ASSI { 1985}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 39   and name H   ))
      2.500     0.800     0.800 peak  1985 spectrum    1 weight  0.10000E+01 volume  0.62828E-02 ppm1      0.834 ppm2      7.996 CV     1
 ASSI { 1986}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 35   and name H   ))
      4.600     2.700     1.400 peak  1986 spectrum    1 weight  0.10000E+01 volume  0.76504E-03 ppm1      1.862 ppm2      7.526 CV     1
 ASSI { 1987}
   (( segid "    " and resid 126  and name HG2 ))
   (  segid "    " and resid 199  and name HD% )
      4.200     2.200     1.800 peak  1987 spectrum    1 weight  0.10000E+01 volume  0.14116E-02 ppm1      1.845 ppm2      6.941 CV     1
 ASSI { 1988}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 81   and name HD% )
      2.500     2.500     3.500 peak  1988 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      0.665 ppm2      6.816 CV     1
 ASSI { 1989}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 35   and name H   ))
      2.600     2.600     3.400 peak  1989 spectrum    1 weight  0.10000E+01 volume  0.91398E-03 ppm1      0.837 ppm2      7.521 CV     1
 ASSI { 1990}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 40   and name H   ))
      4.300     2.300     1.700 peak  1990 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      0.832 ppm2      7.372 CV     1
 ASSI { 1991}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 36   and name HA  ))
      2.300     0.700     0.700 peak  1991 spectrum    1 weight  0.10000E+01 volume  0.56194E-02 ppm1      0.835 ppm2      4.505 CV     1
 ASSI { 1992}
   (( segid "    " and resid 36   and name HG13))
   (( segid "    " and resid 36   and name HA  ))
      3.400     1.500     1.500 peak  1992 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      1.492 ppm2      4.501 CV     1
 ASSI { 1993}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HA  ))
      3.700     1.700     1.700 peak  1993 spectrum    1 weight  0.10000E+01 volume  0.28774E-02 ppm1      0.661 ppm2      4.503 CV     1
 ASSI { 1995}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 37   and name HD2 ))
      4.600     2.600     1.400 peak  1995 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      1.857 ppm2      3.764 CV     1
 ASSI { 1996}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HD2 ))
      2.400     0.700     0.700 peak  1996 spectrum    1 weight  0.10000E+01 volume  0.41435E-02 ppm1      4.508 ppm2      3.749 CV     1
 OR { 1996}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HD3 ))
 ASSI { 1997}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 37   and name HD2 ))
      2.300     2.300     3.700 peak  1997 spectrum    1 weight  0.10000E+01 volume  0.16282E-02 ppm1      0.661 ppm2      3.750 CV     1
 ASSI { 1998}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 33   and name HA  ))
      2.400     2.400     3.600 peak  1998 spectrum    1 weight  0.10000E+01 volume  0.12829E-02 ppm1      0.662 ppm2      3.556 CV     1
 ASSI { 1999}
   (( segid "    " and resid 36   and name HG13))
   (( segid "    " and resid 37   and name HD2 ))
      4.900     3.100     1.100 peak  1999 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      1.475 ppm2      3.722 CV     1
 ASSI { 2000}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
      4.300     2.300     1.700 peak  2000 spectrum    1 weight  0.10000E+01 volume  0.10968E-02 ppm1      0.832 ppm2      4.025 CV     1
 ASSI { 2001}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 38   and name HA  ))
      3.900     1.900     1.900 peak  2001 spectrum    1 weight  0.10000E+01 volume  0.21902E-02 ppm1      0.833 ppm2      3.925 CV     1
 ASSI { 2002}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 37   and name HD2 ))
      2.900     1.000     1.000 peak  2002 spectrum    1 weight  0.10000E+01 volume  0.45260E-02 ppm1      0.835 ppm2      3.751 CV     1
 ASSI { 2003}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 15   and name HE3 ))
      3.600     1.600     1.600 peak  2003 spectrum    1 weight  0.10000E+01 volume  0.75489E-03 ppm1      0.834 ppm2      2.813 CV     1
 ASSI { 2004}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 32   and name HA  ))
      3.600     1.600     1.600 peak  2004 spectrum    1 weight  0.10000E+01 volume  0.18313E-02 ppm1      0.664 ppm2      3.229 CV     1
 ASSI { 2006}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB  ))
      2.900     1.100     1.100 peak  2006 spectrum    1 weight  0.10000E+01 volume  0.18381E-02 ppm1      4.513 ppm2      1.892 CV     1
 ASSI { 2007}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 36   and name HG13))
      2.700     0.900     0.900 peak  2007 spectrum    1 weight  0.10000E+01 volume  0.14658E-02 ppm1      1.866 ppm2      1.479 CV     1
 ASSI { 2008}
   (( segid "    " and resid 189  and name HG2 ))
   (( segid "    " and resid 189  and name HG3 ))
      2.100     0.600     0.600 peak  2008 spectrum    1 weight  0.10000E+01 volume  0.32227E-02 ppm1      1.857 ppm2      1.992 CV     1
 ASSI { 2009}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 35   and name HG3 ))
      4.000     2.000     2.000 peak  2009 spectrum    1 weight  0.10000E+01 volume  0.14590E-02 ppm1      1.863 ppm2      1.682 CV     1
 OR { 2009}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI { 2010}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 15   and name HB3 ))
      3.200     1.300     1.300 peak  2010 spectrum    1 weight  0.10000E+01 volume  0.41840E-02 ppm1      0.835 ppm2      1.685 CV     1
 ASSI { 2011}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 10   and name HG13))
      3.300     1.300     1.300 peak  2011 spectrum    1 weight  0.10000E+01 volume  0.36256E-02 ppm1      0.836 ppm2      1.579 CV     1
 ASSI { 2012}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 36   and name HG13))
      3.200     1.200     1.200 peak  2012 spectrum    1 weight  0.10000E+01 volume  0.46849E-02 ppm1      0.834 ppm2      1.479 CV     1
 ASSI { 2013}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 36   and name HB  ))
      2.100     0.500     0.500 peak  2013 spectrum    1 weight  0.10000E+01 volume  0.92346E-02 ppm1      0.834 ppm2      1.874 CV     1
 ASSI { 2014}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 38   and name HG2 ))
      3.300     1.300     1.300 peak  2014 spectrum    1 weight  0.10000E+01 volume  0.19803E-02 ppm1      0.833 ppm2      2.237 CV     1
 ASSI { 2015}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 37   and name HG2 ))
      4.100     2.100     1.900 peak  2015 spectrum    1 weight  0.10000E+01 volume  0.18821E-02 ppm1      0.835 ppm2      2.021 CV     1
 ASSI { 2016}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 8    and name HB  ))
      2.600     0.800     0.800 peak  2016 spectrum    1 weight  0.10000E+01 volume  0.39672E-02 ppm1      0.661 ppm2      2.071 CV     1
 ASSI { 2017}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 15   and name HB3 ))
      2.200     0.600     0.600 peak  2017 spectrum    1 weight  0.10000E+01 volume  0.10836E-01 ppm1      0.662 ppm2      1.677 CV     1
 ASSI { 2021}
   (( segid "    " and resid 36   and name HB  ))
   (  segid "    " and resid 32   and name HG2%)
      4.100     2.100     1.900 peak  2021 spectrum    1 weight  0.10000E+01 volume  0.17230E-02 ppm1      1.863 ppm2      0.753 CV     1
 ASSI { 2024}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 36   and name HG2%)
      1.900     0.400     0.400 peak  2024 spectrum    1 weight  0.10000E+01 volume  0.20453E-01 ppm1      0.663 ppm2      0.840 CV     1
 ASSI { 2026}
   (  segid "    " and resid 36   and name HG2%)
   (  segid "    " and resid 39   and name HB% )
      2.900     1.000     1.000 peak  2026 spectrum    1 weight  0.10000E+01 volume  0.53010E-02 ppm1      0.835 ppm2      1.109 CV     1
 ASSI { 2028}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 32   and name HD1%)
      2.300     0.700     0.700 peak  2028 spectrum    1 weight  0.10000E+01 volume  0.76233E-02 ppm1      0.662 ppm2      0.110 CV     1
 ASSI { 2030}
   (  segid "    " and resid 36   and name HG2%)
   (  segid "    " and resid 32   and name HD1%)
      3.600     1.600     1.600 peak  2030 spectrum    1 weight  0.10000E+01 volume  0.24136E-02 ppm1      0.834 ppm2      0.113 CV     1
 ASSI { 2031}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HG12))
      4.800     2.900     1.200 peak  2031 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      4.334 ppm2      0.855 CV     1
 ASSI { 2033}
   (( segid "    " and resid 91   and name HD2 ))
   (  segid "    " and resid 97   and name HG1%)
      4.600     2.600     1.400 peak  2033 spectrum    1 weight  0.10000E+01 volume  0.15165E-02 ppm1      2.993 ppm2      0.818 CV     1
 ASSI { 2039}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HD3 ))
      4.200     2.200     1.800 peak  2039 spectrum    1 weight  0.10000E+01 volume  0.12085E-02 ppm1      1.885 ppm2      3.106 CV     1
 ASSI { 2041}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 35   and name HD3 ))
      4.200     2.200     1.800 peak  2041 spectrum    1 weight  0.10000E+01 volume  0.60592E-03 ppm1      1.705 ppm2      3.120 CV     1
 ASSI { 2042}
   (( segid "    " and resid 35   and name HD3 ))
   (( segid "    " and resid 35   and name HD2 ))
      1.300     0.200     0.900 peak  2042 spectrum    1 weight  0.10000E+01 volume  0.38018E-01 ppm1      3.119 ppm2      3.010 CV     1
 ASSI { 2044}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 34   and name HG3 ))
      4.200     2.200     1.800 peak  2044 spectrum    1 weight  0.10000E+01 volume  0.78197E-03 ppm1      3.006 ppm2      2.415 CV     1
 ASSI { 2045}
   (( segid "    " and resid 8    and name HG13))
   (( segid "    " and resid 81   and name HB2 ))
      3.900     1.900     1.900 peak  2045 spectrum    1 weight  0.10000E+01 volume  0.11645E-02 ppm1      1.648 ppm2      2.428 CV     1
 ASSI { 2048}
   (( segid "    " and resid 35   and name HG3 ))
   (( segid "    " and resid 35   and name HD2 ))
      2.400     0.700     0.700 peak  2048 spectrum    1 weight  0.10000E+01 volume  0.45937E-02 ppm1      1.647 ppm2      3.004 CV     1
 OR { 2048}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HD2 ))
 ASSI { 2049}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 87   and name HD2 ))
      4.000     2.000     2.000 peak  2049 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      1.683 ppm2      3.653 CV     1
 ASSI { 2052}
   (( segid "    " and resid 35   and name HD3 ))
   (( segid "    " and resid 35   and name HA  ))
      3.800     1.800     1.800 peak  2052 spectrum    1 weight  0.10000E+01 volume  0.43295E-02 ppm1      3.119 ppm2      4.327 CV     1
 ASSI { 2053}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HA  ))
      3.200     1.300     1.300 peak  2053 spectrum    1 weight  0.10000E+01 volume  0.39098E-02 ppm1      3.009 ppm2      4.326 CV     1
 ASSI { 2057}
   (( segid "    " and resid 35   and name HD3 ))
   (( segid "    " and resid 35   and name H   ))
      3.500     1.600     1.600 peak  2057 spectrum    1 weight  0.10000E+01 volume  0.14962E-02 ppm1      3.116 ppm2      7.519 CV     1
 ASSI { 2058}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name H   ))
      2.700     0.900     0.900 peak  2058 spectrum    1 weight  0.10000E+01 volume  0.15470E-02 ppm1      3.009 ppm2      7.523 CV     1
 ASSI { 2059}
   (( segid "    " and resid 35   and name HG3 ))
   (( segid "    " and resid 35   and name H   ))
      2.300     0.600     0.600 peak  2059 spectrum    1 weight  0.10000E+01 volume  0.33175E-02 ppm1      1.650 ppm2      7.520 CV     1
 OR { 2059}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name H   ))
 ASSI { 2060}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 36   and name H   ))
      4.400     2.400     1.600 peak  2060 spectrum    1 weight  0.10000E+01 volume  0.75827E-03 ppm1      1.684 ppm2      7.970 CV     1
 ASSI { 2061}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 32   and name H   ))
      4.100     2.100     1.900 peak  2061 spectrum    1 weight  0.10000E+01 volume  0.25998E-02 ppm1      0.111 ppm2      8.091 CV     1
 ASSI { 2065}
   (( segid "    " and resid 32   and name HG13))
   (( segid "    " and resid 32   and name H   ))
      4.500     2.600     1.500 peak  2065 spectrum    1 weight  0.10000E+01 volume  0.72103E-03 ppm1      0.982 ppm2      8.092 CV     1
 OR { 2065}
   (( segid "    " and resid 32   and name HG12))
   (( segid "    " and resid 32   and name H   ))
 ASSI { 2066}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 32   and name H   ))
      2.500     0.800     0.800 peak  2066 spectrum    1 weight  0.10000E+01 volume  0.22172E-02 ppm1      0.737 ppm2      8.087 CV     1
 ASSI { 2067}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 29   and name H   ))
      4.200     2.200     1.800 peak  2067 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      0.743 ppm2      8.212 CV     1
 ASSI { 2068}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 33   and name H   ))
      4.400     2.400     1.600 peak  2068 spectrum    1 weight  0.10000E+01 volume  0.18110E-02 ppm1      0.113 ppm2      7.459 CV     1
 ASSI { 2069}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 33   and name H   ))
      2.700     0.900     0.900 peak  2069 spectrum    1 weight  0.10000E+01 volume  0.11848E-02 ppm1      0.734 ppm2      7.456 CV     1
 ASSI { 2071}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 19   and name HZ  ))
      3.500     1.500     1.500 peak  2071 spectrum    1 weight  0.10000E+01 volume  0.26709E-02 ppm1      0.737 ppm2      6.966 CV     1
 ASSI { 2072}
   (  segid "    " and resid 32   and name HD1%)
   (  segid "    " and resid 81   and name HD% )
      2.600     0.800     0.800 peak  2072 spectrum    1 weight  0.10000E+01 volume  0.26911E-02 ppm1      0.109 ppm2      6.812 CV     1
 ASSI { 2076}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 81   and name HA  ))
      4.400     2.400     1.600 peak  2076 spectrum    1 weight  0.10000E+01 volume  0.83611E-03 ppm1      0.736 ppm2      5.424 CV     1
 ASSI { 2077}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 28   and name HA  ))
      3.700     1.700     1.700 peak  2077 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      0.746 ppm2      4.221 CV     1
 ASSI { 2078}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 29   and name HA  ))
      2.400     0.700     0.700 peak  2078 spectrum    1 weight  0.10000E+01 volume  0.29857E-02 ppm1      0.737 ppm2      3.928 CV     1
 ASSI { 2079}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 39   and name HA  ))
      4.300     2.300     1.700 peak  2079 spectrum    1 weight  0.10000E+01 volume  0.90382E-03 ppm1      0.108 ppm2      4.009 CV     1
 ASSI { 2080}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 29   and name HA  ))
      4.100     2.100     1.900 peak  2080 spectrum    1 weight  0.10000E+01 volume  0.16045E-02 ppm1      0.115 ppm2      3.926 CV     1
 ASSI { 2081}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 33   and name HA  ))
      4.300     2.300     1.700 peak  2081 spectrum    1 weight  0.10000E+01 volume  0.12051E-02 ppm1      0.112 ppm2      3.557 CV     1
 ASSI { 2082}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 32   and name HA  ))
      3.300     1.300     1.300 peak  2082 spectrum    1 weight  0.10000E+01 volume  0.45089E-02 ppm1      0.111 ppm2      3.227 CV     1
 ASSI { 2083}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 81   and name HB3 ))
      3.500     1.500     1.500 peak  2083 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      0.111 ppm2      3.106 CV     1
 ASSI { 2084}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 32   and name HA  ))
      4.700     2.700     1.300 peak  2084 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      1.960 ppm2      3.223 CV     1
 ASSI { 2085}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 32   and name HA  ))
      3.300     1.300     1.300 peak  2085 spectrum    1 weight  0.10000E+01 volume  0.28976E-02 ppm1      0.738 ppm2      3.225 CV     1
 ASSI { 2086}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 81   and name HB3 ))
      4.600     2.600     1.400 peak  2086 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      0.738 ppm2      3.099 CV     1
 ASSI { 2087}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 29   and name HB2 ))
      4.600     2.600     1.400 peak  2087 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      0.741 ppm2      2.990 CV     1
 ASSI { 2088}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 81   and name HB2 ))
      3.100     1.200     1.200 peak  2088 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      0.111 ppm2      2.442 CV     1
 ASSI { 2089}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 81   and name HB2 ))
      3.900     1.900     1.900 peak  2089 spectrum    1 weight  0.10000E+01 volume  0.12119E-02 ppm1      0.739 ppm2      2.447 CV     1
 ASSI { 2090}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 36   and name HB  ))
      4.200     2.200     1.800 peak  2090 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      3.234 ppm2      1.873 CV     1
 ASSI { 2091}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HB  ))
      3.200     1.300     1.300 peak  2091 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      3.240 ppm2      1.589 CV     1
 ASSI { 2092}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HG13))
      3.100     1.200     1.200 peak  2092 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      3.242 ppm2      0.981 CV     1
 OR { 2092}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HG12))
 ASSI { 2093}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 8    and name HB  ))
      4.000     2.000     2.000 peak  2093 spectrum    1 weight  0.10000E+01 volume  0.13845E-02 ppm1      0.111 ppm2      2.072 CV     1
 ASSI { 2094}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 36   and name HB  ))
      3.100     1.200     1.200 peak  2094 spectrum    1 weight  0.10000E+01 volume  0.27148E-02 ppm1      0.114 ppm2      1.881 CV     1
 ASSI { 2095}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 8    and name HG13))
      2.200     0.600     0.600 peak  2095 spectrum    1 weight  0.10000E+01 volume  0.46376E-02 ppm1      0.112 ppm2      1.682 CV     1
 ASSI { 2097}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 36   and name HG13))
      3.500     1.600     1.600 peak  2097 spectrum    1 weight  0.10000E+01 volume  0.28063E-02 ppm1      0.111 ppm2      1.489 CV     1
 ASSI { 2098}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 31   and name HB2 ))
      3.400     1.400     1.400 peak  2098 spectrum    1 weight  0.10000E+01 volume  0.43838E-02 ppm1      0.737 ppm2      1.960 CV     1
 ASSI { 2099}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 33   and name HB2 ))
      4.100     2.100     1.900 peak  2099 spectrum    1 weight  0.10000E+01 volume  0.12119E-02 ppm1      0.739 ppm2      1.786 CV     1
 ASSI { 2101}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 32   and name HB  ))
      2.300     0.700     0.700 peak  2101 spectrum    1 weight  0.10000E+01 volume  0.39300E-02 ppm1      0.737 ppm2      1.565 CV     1
 ASSI { 2102}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 39   and name HB% )
      3.400     1.500     1.500 peak  2102 spectrum    1 weight  0.10000E+01 volume  0.15064E-02 ppm1      0.735 ppm2      1.105 CV     1
 ASSI { 2103}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 32   and name HG12))
      2.300     0.700     0.700 peak  2103 spectrum    1 weight  0.10000E+01 volume  0.50811E-02 ppm1      0.739 ppm2      0.991 CV     1
 OR { 2103}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 32   and name HG13))
 ASSI { 2104}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 49   and name HD2%)
      2.400     0.700     0.700 peak  2104 spectrum    1 weight  0.10000E+01 volume  0.84087E-02 ppm1      0.738 ppm2      0.867 CV     1
 ASSI { 2108}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 32   and name HG12))
      2.400     0.700     0.700 peak  2108 spectrum    1 weight  0.10000E+01 volume  0.32260E-02 ppm1      0.111 ppm2      0.984 CV     1
 OR { 2108}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 32   and name HG13))
 ASSI { 2113}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 32   and name HD1%)
      2.200     0.600     0.600 peak  2113 spectrum    1 weight  0.10000E+01 volume  0.80228E-02 ppm1      0.738 ppm2      0.110 CV     1
 ASSI { 2115}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 32   and name HD1%)
      2.900     1.000     1.000 peak  2115 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      1.568 ppm2      0.115 CV     1
 ASSI { 2117}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 111  and name HG3 ))
      1.900     0.400     0.400 peak  2117 spectrum    1 weight  0.10000E+01 volume  0.45260E-02 ppm1      2.574 ppm2      2.242 CV     1
 ASSI { 2118}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HG2 ))
      3.000     1.100     1.100 peak  2118 spectrum    1 weight  0.10000E+01 volume  0.16587E-02 ppm1      3.875 ppm2      2.722 CV     1
 ASSI { 2119}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HG3 ))
      3.300     1.400     1.400 peak  2119 spectrum    1 weight  0.10000E+01 volume  0.19498E-02 ppm1      3.872 ppm2      2.524 CV     1
 ASSI { 2120}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 34   and name HG3 ))
      4.400     2.400     1.600 peak  2120 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      3.872 ppm2      2.422 CV     1
 ASSI { 2121}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB3 ))
      2.900     1.100     1.100 peak  2121 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      3.875 ppm2      2.327 CV     1
 ASSI { 2123}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name H   ))
      3.000     1.100     1.100 peak  2123 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      3.870 ppm2      8.330 CV     1
 ASSI { 2129}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 33   and name H   ))
      4.600     2.700     1.400 peak  2129 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      3.921 ppm2      7.452 CV     1
 ASSI { 2134}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 81   and name HD% )
      4.400     2.400     1.600 peak  2134 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      3.926 ppm2      6.823 CV     1
 ASSI { 2140}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HB3 ))
      2.500     0.800     0.800 peak  2140 spectrum    1 weight  0.10000E+01 volume  0.15910E-02 ppm1      2.972 ppm2      3.210 CV     1
 ASSI { 2141}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HB3 ))
      3.200     1.300     1.300 peak  2141 spectrum    1 weight  0.10000E+01 volume  0.15368E-02 ppm1      3.930 ppm2      3.215 CV     1
 ASSI { 2142}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HB2 ))
      3.100     1.200     1.200 peak  2142 spectrum    1 weight  0.10000E+01 volume  0.12423E-02 ppm1      3.925 ppm2      2.967 CV     1
 ASSI { 2144}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 32   and name HB  ))
      4.000     2.000     2.000 peak  2144 spectrum    1 weight  0.10000E+01 volume  0.11103E-02 ppm1      3.929 ppm2      1.570 CV     1
 ASSI { 2145}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 28   and name HB% )
      3.900     1.900     1.900 peak  2145 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      3.932 ppm2      1.003 CV     1
 ASSI { 2151}
   (  segid "    " and resid 28   and name HB% )
   (  segid "    " and resid 49   and name HD1%)
      2.000     0.500     0.500 peak  2151 spectrum    1 weight  0.10000E+01 volume  0.10595E-01 ppm1      1.013 ppm2      0.740 CV     1
 ASSI { 2152}
   (  segid "    " and resid 28   and name HB% )
   (  segid "    " and resid 68   and name HD1%)
      2.300     0.700     0.700 peak  2152 spectrum    1 weight  0.10000E+01 volume  0.70105E-02 ppm1      1.013 ppm2      0.307 CV     1
 OR { 2152}
   (  segid "    " and resid 28   and name HB% )
   (  segid "    " and resid 68   and name HD2%)
 ASSI { 2154}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 68   and name HG  ))
      3.300     1.400     1.400 peak  2154 spectrum    1 weight  0.10000E+01 volume  0.19972E-02 ppm1      1.012 ppm2      1.668 CV     1
 ASSI { 2155}
   (  segid "    " and resid 28   and name HB% )
   (  segid "    " and resid 79   and name HE% )
      2.800     1.000     1.000 peak  2155 spectrum    1 weight  0.10000E+01 volume  0.32395E-02 ppm1      1.014 ppm2      1.473 CV     1
 ASSI { 2156}
   (  segid "    " and resid 28   and name HB% )
   (  segid "    " and resid 23   and name HG2%)
      2.400     0.700     0.700 peak  2156 spectrum    1 weight  0.10000E+01 volume  0.80905E-02 ppm1      1.013 ppm2      1.365 CV     1
 ASSI { 2158}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 31   and name HB3 ))
      4.800     2.900     1.200 peak  2158 spectrum    1 weight  0.10000E+01 volume  0.86319E-03 ppm1      4.241 ppm2      2.326 CV     1
 ASSI { 2159}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 27   and name HB3 ))
      3.700     1.700     1.700 peak  2159 spectrum    1 weight  0.10000E+01 volume  0.25795E-02 ppm1      1.013 ppm2      2.610 CV     1
 ASSI { 2162}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 25   and name HA  ))
      2.500     0.800     0.800 peak  2162 spectrum    1 weight  0.10000E+01 volume  0.51521E-02 ppm1      1.013 ppm2      3.281 CV     1
 ASSI { 2164}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 28   and name HA  ))
      2.100     0.600     0.600 peak  2164 spectrum    1 weight  0.10000E+01 volume  0.69495E-02 ppm1      1.013 ppm2      4.239 CV     1
 ASSI { 2166}
   (  segid "    " and resid 28   and name HB% )
   (  segid "    " and resid 19   and name HE% )
      2.700     0.900     0.900 peak  2166 spectrum    1 weight  0.10000E+01 volume  0.37202E-02 ppm1      1.013 ppm2      7.122 CV     1
 ASSI { 2167}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 19   and name HZ  ))
      3.600     1.600     1.600 peak  2167 spectrum    1 weight  0.10000E+01 volume  0.14251E-02 ppm1      1.011 ppm2      6.973 CV     1
 ASSI { 2170}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 29   and name H   ))
      2.600     0.800     0.800 peak  2170 spectrum    1 weight  0.10000E+01 volume  0.35984E-02 ppm1      1.013 ppm2      8.216 CV     1
 ASSI { 2171}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 32   and name H   ))
      4.000     2.000     2.000 peak  2171 spectrum    1 weight  0.10000E+01 volume  0.80905E-03 ppm1      1.014 ppm2      8.102 CV     1
 ASSI { 2172}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 28   and name H   ))
      2.300     0.600     0.600 peak  2172 spectrum    1 weight  0.10000E+01 volume  0.67906E-02 ppm1      1.012 ppm2      8.613 CV     1
 ASSI { 2173}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 31   and name H   ))
      3.500     1.500     1.500 peak  2173 spectrum    1 weight  0.10000E+01 volume  0.74473E-03 ppm1      4.249 ppm2      8.337 CV     1
 ASSI { 2179}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 26   and name H   ))
      2.700     0.900     0.900 peak  2179 spectrum    1 weight  0.10000E+01 volume  0.21191E-02 ppm1      3.190 ppm2      8.703 CV     1
 ASSI { 2183}
   (( segid "    " and resid 71   and name HB3 ))
   (( segid "    " and resid 73   and name H   ))
      3.400     1.500     1.500 peak  2183 spectrum    1 weight  0.10000E+01 volume  0.11137E-02 ppm1      3.191 ppm2      6.790 CV     1
 ASSI { 2186}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HB3 ))
      2.700     0.900     0.900 peak  2186 spectrum    1 weight  0.10000E+01 volume  0.34664E-02 ppm1      4.378 ppm2      3.193 CV     1
 ASSI { 2187}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 64   and name HA  ))
      4.000     2.000     2.000 peak  2187 spectrum    1 weight  0.10000E+01 volume  0.11712E-02 ppm1      4.382 ppm2      3.916 CV     1
 ASSI { 2188}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HB3 ))
      2.100     0.500     0.500 peak  2188 spectrum    1 weight  0.10000E+01 volume  0.38083E-02 ppm1      2.815 ppm2      3.186 CV     1
 ASSI { 2189}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 64   and name HA  ))
      3.600     1.600     1.600 peak  2189 spectrum    1 weight  0.10000E+01 volume  0.11103E-02 ppm1      3.184 ppm2      3.912 CV     1
 ASSI { 2190}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 24   and name HG2 ))
      3.900     1.900     1.900 peak  2190 spectrum    1 weight  0.10000E+01 volume  0.98169E-03 ppm1      3.191 ppm2      2.608 CV     1
 ASSI { 2191}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 24   and name HG2 ))
      4.500     2.500     1.500 peak  2191 spectrum    1 weight  0.10000E+01 volume  0.10325E-02 ppm1      4.387 ppm2      2.608 CV     1
 ASSI { 2192}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HB2 ))
      2.900     1.000     1.000 peak  2192 spectrum    1 weight  0.10000E+01 volume  0.26471E-02 ppm1      4.381 ppm2      2.812 CV     1
 ASSI { 2200}
   (  segid "    " and resid 25   and name HG2%)
   (  segid "    " and resid 62   and name HD2%)
      3.500     1.500     1.500 peak  2200 spectrum    1 weight  0.10000E+01 volume  0.43195E-02 ppm1      0.978 ppm2     -0.163 CV     1
 ASSI { 2207}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB  ))
      3.200     1.300     1.300 peak  2207 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1      3.280 ppm2      2.750 CV     1
 ASSI { 2209}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 64   and name HA  ))
      4.800     2.900     1.200 peak  2209 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      3.286 ppm2      3.905 CV     1
 ASSI { 2211}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 67   and name HA  ))
      2.600     2.600     3.400 peak  2211 spectrum    1 weight  0.10000E+01 volume  0.21868E-02 ppm1      0.972 ppm2      4.858 CV     1
 ASSI { 2214}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 63   and name HA  ))
      3.300     1.400     1.400 peak  2214 spectrum    1 weight  0.10000E+01 volume  0.10934E-02 ppm1      0.970 ppm2      4.217 CV     1
 ASSI { 2216}
   (  segid "    " and resid 93   and name HD2%)
   (  segid "    " and resid 127  and name HE% )
      2.700     0.900     0.900 peak  2216 spectrum    1 weight  0.10000E+01 volume  0.34529E-02 ppm1      0.960 ppm2      6.638 CV     1
 ASSI { 2217}
   (( segid "    " and resid 66   and name HG3 ))
   (  segid "    " and resid 71   and name HE% )
      2.500     0.800     0.800 peak  2217 spectrum    1 weight  0.10000E+01 volume  0.28063E-02 ppm1      0.970 ppm2      6.858 CV     1
 OR { 2217}
   (( segid "    " and resid 66   and name HG2 ))
   (  segid "    " and resid 71   and name HE% )
 ASSI { 2218}
   (( segid "    " and resid 66   and name HG3 ))
   (  segid "    " and resid 71   and name HD% )
      3.000     1.100     1.100 peak  2218 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      0.972 ppm2      7.239 CV     1
 OR { 2218}
   (( segid "    " and resid 66   and name HG2 ))
   (  segid "    " and resid 71   and name HD% )
 ASSI { 2220}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 26   and name H   ))
      3.500     1.500     1.500 peak  2220 spectrum    1 weight  0.10000E+01 volume  0.82257E-03 ppm1      3.288 ppm2      8.705 CV     1
 ASSI { 2222}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 26   and name H   ))
      2.900     1.100     1.100 peak  2222 spectrum    1 weight  0.10000E+01 volume  0.29586E-02 ppm1      0.759 ppm2      8.710 CV     1
 ASSI { 2223}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 28   and name H   ))
      3.800     1.800     1.800 peak  2223 spectrum    1 weight  0.10000E+01 volume  0.15842E-02 ppm1      0.756 ppm2      8.619 CV     1
 ASSI { 2225}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 131  and name HE  ))
      3.400     1.400     1.400 peak  2225 spectrum    1 weight  0.10000E+01 volume  0.20344E-02 ppm1      0.751 ppm2      9.031 CV     1
 ASSI { 2226}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name H   ))
      3.000     1.100     1.100 peak  2226 spectrum    1 weight  0.10000E+01 volume  0.68718E-03 ppm1      2.734 ppm2      9.447 CV     1
 ASSI { 2227}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
      2.900     1.000     1.000 peak  2227 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      3.287 ppm2      9.460 CV     1
 ASSI { 2228}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 25   and name H   ))
      3.800     1.800     1.800 peak  2228 spectrum    1 weight  0.10000E+01 volume  0.23628E-02 ppm1      0.756 ppm2      9.459 CV     1
 ASSI { 2230}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 29   and name H   ))
      4.600     2.700     1.400 peak  2230 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1      1.367 ppm2      8.210 CV     1
 ASSI { 2231}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 28   and name H   ))
      2.500     0.800     0.800 peak  2231 spectrum    1 weight  0.10000E+01 volume  0.40011E-02 ppm1      1.366 ppm2      8.613 CV     1
 ASSI { 2232}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 24   and name H   ))
      2.500     0.800     0.800 peak  2232 spectrum    1 weight  0.10000E+01 volume  0.44177E-02 ppm1      1.365 ppm2      9.135 CV     1
 ASSI { 2233}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name H   ))
      2.900     1.000     1.000 peak  2233 spectrum    1 weight  0.10000E+01 volume  0.40993E-02 ppm1      3.894 ppm2      9.135 CV     1
 ASSI { 2234}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 23   and name H   ))
      2.800     1.000     1.000 peak  2234 spectrum    1 weight  0.10000E+01 volume  0.25490E-02 ppm1      1.366 ppm2      7.713 CV     1
 ASSI { 2235}
   (( segid "    " and resid 23   and name HB  ))
   (( segid "    " and resid 23   and name H   ))
      2.800     1.000     1.000 peak  2235 spectrum    1 weight  0.10000E+01 volume  0.12423E-02 ppm1      3.937 ppm2      7.716 CV     1
 ASSI { 2236}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name H   ))
      3.100     1.200     1.200 peak  2236 spectrum    1 weight  0.10000E+01 volume  0.15910E-02 ppm1      3.895 ppm2      7.719 CV     1
 ASSI { 2237}
   (  segid "    " and resid 23   and name HG2%)
   (  segid "    " and resid 19   and name HD% )
      3.000     1.100     1.100 peak  2237 spectrum    1 weight  0.10000E+01 volume  0.35917E-02 ppm1      1.365 ppm2      7.062 CV     1
 ASSI { 2238}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 27   and name H   ))
      3.000     1.200     1.200 peak  2238 spectrum    1 weight  0.10000E+01 volume  0.41670E-02 ppm1      1.366 ppm2      6.724 CV     1
 ASSI { 2239}
   (( segid "    " and resid 23   and name HB  ))
   (( segid "    " and resid 27   and name H   ))
      4.700     2.800     1.300 peak  2239 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      3.940 ppm2      6.731 CV     1
 ASSI { 2240}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 27   and name H   ))
      4.300     2.300     1.700 peak  2240 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      3.903 ppm2      6.733 CV     1
 ASSI { 2241}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 19   and name HA  ))
      4.000     2.000     2.000 peak  2241 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      1.366 ppm2      4.861 CV     1
 ASSI { 2242}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 24   and name HA  ))
      3.600     1.600     1.600 peak  2242 spectrum    1 weight  0.10000E+01 volume  0.13947E-02 ppm1      1.368 ppm2      4.704 CV     1
 ASSI { 2243}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 27   and name HA  ))
      4.400     2.400     1.600 peak  2243 spectrum    1 weight  0.10000E+01 volume  0.13168E-02 ppm1      1.363 ppm2      4.644 CV     1
 ASSI { 2244}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 28   and name HA  ))
      3.000     1.100     1.100 peak  2244 spectrum    1 weight  0.10000E+01 volume  0.23256E-02 ppm1      1.366 ppm2      4.239 CV     1
 ASSI { 2245}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 23   and name HB  ))
      2.100     0.500     0.500 peak  2245 spectrum    1 weight  0.10000E+01 volume  0.96476E-02 ppm1      1.366 ppm2      3.911 CV     1
 OR { 2245}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 23   and name HA  ))
 ASSI { 2246}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 25   and name HA  ))
      3.800     1.800     1.800 peak  2246 spectrum    1 weight  0.10000E+01 volume  0.10460E-02 ppm1      1.366 ppm2      3.286 CV     1
 ASSI { 2247}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 27   and name HB3 ))
      2.200     0.600     0.600 peak  2247 spectrum    1 weight  0.10000E+01 volume  0.69361E-02 ppm1      1.367 ppm2      2.603 CV     1
 ASSI { 2248}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 27   and name HB3 ))
      3.500     1.500     1.500 peak  2248 spectrum    1 weight  0.10000E+01 volume  0.14014E-02 ppm1      3.903 ppm2      2.611 CV     1
 OR { 2248}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 2251}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 20   and name HB2 ))
      4.000     2.000     2.000 peak  2251 spectrum    1 weight  0.10000E+01 volume  0.13710E-02 ppm1      1.365 ppm2      1.885 CV     1
 ASSI { 2252}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 68   and name HG  ))
      2.900     1.100     1.100 peak  2252 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      1.367 ppm2      1.679 CV     1
 ASSI { 2253}
   (( segid "    " and resid 23   and name HB  ))
   (( segid "    " and resid 68   and name HG  ))
      4.400     2.400     1.600 peak  2253 spectrum    1 weight  0.10000E+01 volume  0.56871E-03 ppm1      3.940 ppm2      1.661 CV     1
 ASSI { 2254}
   (( segid "    " and resid 23   and name HB  ))
   (  segid "    " and resid 23   and name HG2%)
      2.600     0.800     0.800 peak  2254 spectrum    1 weight  0.10000E+01 volume  0.20141E-02 ppm1      3.931 ppm2      1.367 CV     1
 ASSI { 2255}
   (( segid "    " and resid 23   and name HA  ))
   (  segid "    " and resid 23   and name HG2%)
      3.100     1.200     1.200 peak  2255 spectrum    1 weight  0.10000E+01 volume  0.40758E-02 ppm1      3.895 ppm2      1.365 CV     1
 ASSI { 2257}
   (( segid "    " and resid 23   and name HB  ))
   (  segid "    " and resid 28   and name HB% )
      4.800     2.800     1.200 peak  2257 spectrum    1 weight  0.10000E+01 volume  0.56532E-03 ppm1      3.943 ppm2      1.008 CV     1
 ASSI { 2258}
   (  segid "    " and resid 23   and name HG2%)
   (  segid "    " and resid 49   and name HD1%)
      4.200     2.300     1.800 peak  2258 spectrum    1 weight  0.10000E+01 volume  0.16993E-02 ppm1      1.366 ppm2      0.731 CV     1
 ASSI { 2259}
   (( segid "    " and resid 23   and name HA  ))
   (  segid "    " and resid 28   and name HB% )
      5.000     3.100     1.000 peak  2259 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      3.904 ppm2      1.003 CV     1
 ASSI { 2260}
   (  segid "    " and resid 23   and name HG2%)
   (  segid "    " and resid 68   and name HD1%)
      2.700     0.900     0.900 peak  2260 spectrum    1 weight  0.10000E+01 volume  0.36863E-02 ppm1      1.365 ppm2      0.320 CV     1
 ASSI { 2261}
   (( segid "    " and resid 23   and name HA  ))
   (  segid "    " and resid 68   and name HD1%)
      5.000     3.100     1.000 peak  2261 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      3.899 ppm2      0.302 CV     1
 OR { 2261}
   (( segid "    " and resid 23   and name HA  ))
   (  segid "    " and resid 68   and name HD2%)
 ASSI { 2262}
   (( segid "    " and resid 23   and name HB  ))
   (  segid "    " and resid 68   and name HD1%)
      3.900     1.900     1.900 peak  2262 spectrum    1 weight  0.10000E+01 volume  0.11780E-02 ppm1      3.941 ppm2      0.326 CV     1
 ASSI { 2267}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HB3 ))
      2.000     0.500     0.500 peak  2267 spectrum    1 weight  0.10000E+01 volume  0.72847E-02 ppm1      3.801 ppm2      4.036 CV     1
 ASSI { 2268}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HA  ))
      2.700     0.900     0.900 peak  2268 spectrum    1 weight  0.10000E+01 volume  0.41096E-02 ppm1      4.039 ppm2      4.320 CV     1
 ASSI { 2270}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      2.700     0.900     0.900 peak  2270 spectrum    1 weight  0.10000E+01 volume  0.40825E-02 ppm1      4.321 ppm2      3.797 CV     1
 ASSI { 2272}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 67   and name HA  ))
      4.600     2.600     1.400 peak  2272 spectrum    1 weight  0.10000E+01 volume  0.57210E-03 ppm1      4.316 ppm2      4.849 CV     1
 ASSI { 2274}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name H   ))
      3.400     1.400     1.400 peak  2274 spectrum    1 weight  0.10000E+01 volume  0.16587E-02 ppm1      4.041 ppm2      7.386 CV     1
 ASSI { 2275}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name H   ))
      3.000     1.100     1.100 peak  2275 spectrum    1 weight  0.10000E+01 volume  0.22071E-02 ppm1      4.321 ppm2      7.382 CV     1
 ASSI { 2277}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 23   and name H   ))
      4.300     2.300     1.700 peak  2277 spectrum    1 weight  0.10000E+01 volume  0.73119E-03 ppm1      3.804 ppm2      7.716 CV     1
 ASSI { 2278}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 69   and name H   ))
      3.400     1.500     1.500 peak  2278 spectrum    1 weight  0.10000E+01 volume  0.11374E-02 ppm1      4.327 ppm2      8.103 CV     1
 ASSI { 2280}
   (( segid "    " and resid 72   and name HG3 ))
   (( segid "    " and resid 72   and name H   ))
      2.400     0.700     0.700 peak  2280 spectrum    1 weight  0.10000E+01 volume  0.45226E-02 ppm1      2.341 ppm2      7.827 CV     1
 ASSI { 2283}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 22   and name H   ))
      4.200     2.200     1.800 peak  2283 spectrum    1 weight  0.10000E+01 volume  0.73796E-03 ppm1      3.811 ppm2      7.376 CV     1
 ASSI { 2284}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 22   and name H   ))
      4.600     2.700     1.400 peak  2284 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      1.950 ppm2      7.379 CV     1
 ASSI { 2285}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 22   and name H   ))
      3.400     1.400     1.400 peak  2285 spectrum    1 weight  0.10000E+01 volume  0.87335E-03 ppm1      2.153 ppm2      7.379 CV     1
 ASSI { 2286}
   (( segid "    " and resid 72   and name HG3 ))
   (( segid "    " and resid 73   and name H   ))
      2.400     2.400     3.600 peak  2286 spectrum    1 weight  0.10000E+01 volume  0.13811E-02 ppm1      2.339 ppm2      6.775 CV     1
 ASSI { 2287}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 73   and name H   ))
      2.400     2.400     3.600 peak  2287 spectrum    1 weight  0.10000E+01 volume  0.13540E-02 ppm1      2.279 ppm2      6.777 CV     1
 ASSI { 2289}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 20   and name HA  ))
      2.900     1.000     1.000 peak  2289 spectrum    1 weight  0.10000E+01 volume  0.19194E-02 ppm1      3.809 ppm2      4.656 CV     1
 ASSI { 2290}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 20   and name HA  ))
      4.700     2.700     1.300 peak  2290 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      2.136 ppm2      4.650 CV     1
 ASSI { 2292}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 72   and name HA  ))
      2.700     0.900     0.900 peak  2292 spectrum    1 weight  0.10000E+01 volume  0.55483E-02 ppm1      2.278 ppm2      4.079 CV     1
 ASSI { 2293}
   (( segid "    " and resid -2   and name HB3 ))
   (( segid "    " and resid -2   and name HA  ))
      2.100     0.500     0.500 peak  2293 spectrum    1 weight  0.10000E+01 volume  0.13314E-01 ppm1      2.093 ppm2      4.252 CV     1
 ASSI { 2294}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HA  ))
      3.900     1.900     1.900 peak  2294 spectrum    1 weight  0.10000E+01 volume  0.95122E-03 ppm1      3.903 ppm2      4.102 CV     1
 ASSI { 2295}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 22   and name HA  ))
      4.100     2.100     1.900 peak  2295 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      2.152 ppm2      4.281 CV     1
 ASSI { 2296}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HA  ))
      3.900     1.900     1.900 peak  2296 spectrum    1 weight  0.10000E+01 volume  0.16181E-02 ppm1      2.150 ppm2      4.101 CV     1
 ASSI { 2299}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HD3 ))
      1.900     0.400     0.400 peak  2299 spectrum    1 weight  0.10000E+01 volume  0.39031E-02 ppm1      3.877 ppm2      3.805 CV     1
 ASSI { 2300}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HD2 ))
      2.400     0.700     0.700 peak  2300 spectrum    1 weight  0.10000E+01 volume  0.29384E-02 ppm1      2.149 ppm2      3.874 CV     1
 ASSI { 2301}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HD3 ))
      3.100     1.200     1.200 peak  2301 spectrum    1 weight  0.10000E+01 volume  0.25761E-02 ppm1      2.146 ppm2      3.817 CV     1
 ASSI { 2302}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HD3 ))
      2.600     0.800     0.800 peak  2302 spectrum    1 weight  0.10000E+01 volume  0.26234E-02 ppm1      1.947 ppm2      3.856 CV     1
 OR { 2302}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HD2 ))
 ASSI { 2303}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB3 ))
      2.500     0.800     0.800 peak  2303 spectrum    1 weight  0.10000E+01 volume  0.29686E-02 ppm1      4.103 ppm2      2.343 CV     1
 ASSI { 2304}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB2 ))
      3.100     1.200     1.200 peak  2304 spectrum    1 weight  0.10000E+01 volume  0.24407E-02 ppm1      4.103 ppm2      2.104 CV     1
 ASSI { 2305}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HG3 ))
      3.600     1.600     1.600 peak  2305 spectrum    1 weight  0.10000E+01 volume  0.22511E-02 ppm1      4.103 ppm2      1.947 CV     1
 ASSI { 2309}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 21   and name HB3 ))
      3.200     1.300     1.300 peak  2309 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      3.804 ppm2      2.354 CV     1
 ASSI { 2311}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HG3 ))
      1.800     0.400     0.400 peak  2311 spectrum    1 weight  0.10000E+01 volume  0.78840E-02 ppm1      2.148 ppm2      1.944 CV     1
 ASSI { 2312}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HG2 ))
      1.900     0.400     0.400 peak  2312 spectrum    1 weight  0.10000E+01 volume  0.83037E-02 ppm1      1.948 ppm2      2.140 CV     1
 OR { 2312}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 2313}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HB3 ))
      3.100     1.200     1.200 peak  2313 spectrum    1 weight  0.10000E+01 volume  0.35747E-02 ppm1      2.149 ppm2      2.342 CV     1
 ASSI { 2316}
   (( segid "    " and resid -2   and name HB3 ))
   (( segid "    " and resid -2   and name HG2 ))
      2.900     1.000     1.000 peak  2316 spectrum    1 weight  0.10000E+01 volume  0.52943E-02 ppm1      2.089 ppm2      1.699 CV     1
 ASSI { 2317}
   (( segid "    " and resid -2   and name HB3 ))
   (( segid "    " and resid -2   and name HB2 ))
      1.400     0.300     0.800 peak  2317 spectrum    1 weight  0.10000E+01 volume  0.41610E-01 ppm1      2.093 ppm2      1.600 CV     1
 ASSI { 2318}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 4    and name HG  ))
      3.700     1.700     1.700 peak  2318 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      3.825 ppm2      1.483 CV     1
 ASSI { 2319}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 4    and name HG  ))
      3.900     1.900     1.900 peak  2319 spectrum    1 weight  0.10000E+01 volume  0.12220E-02 ppm1      1.940 ppm2      1.475 CV     1
 ASSI { 2320}
   (( segid "    " and resid 21   and name HD2 ))
   (  segid "    " and resid 3    and name HB% )
      4.600     2.700     1.400 peak  2320 spectrum    1 weight  0.10000E+01 volume  0.10798E-02 ppm1      3.884 ppm2      1.101 CV     1
 ASSI { 2323}
   (( segid "    " and resid 21   and name HG3 ))
   (  segid "    " and resid 2    and name HG1%)
      3.600     1.600     1.600 peak  2323 spectrum    1 weight  0.10000E+01 volume  0.20886E-02 ppm1      1.948 ppm2      0.864 CV     1
 OR { 2323}
   (( segid "    " and resid 21   and name HG3 ))
   (  segid "    " and resid 2    and name HG2%)
 ASSI { 2324}
   (( segid "    " and resid 21   and name HG3 ))
   (  segid "    " and resid 4    and name HD1%)
      3.300     1.400     1.400 peak  2324 spectrum    1 weight  0.10000E+01 volume  0.26166E-02 ppm1      1.951 ppm2      0.702 CV     1
 ASSI { 2326}
   (( segid "    " and resid 21   and name HD2 ))
   (  segid "    " and resid 4    and name HD1%)
      4.700     2.800     1.300 peak  2326 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      3.888 ppm2      0.695 CV     1
 OR { 2326}
   (( segid "    " and resid 21   and name HD2 ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI { 2327}
   (( segid "    " and resid 21   and name HD3 ))
   (  segid "    " and resid 4    and name HD1%)
      3.600     1.600     1.600 peak  2327 spectrum    1 weight  0.10000E+01 volume  0.86658E-03 ppm1      3.816 ppm2      0.692 CV     1
 OR { 2327}
   (( segid "    " and resid 21   and name HD3 ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI { 2328}
   (( segid "    " and resid 21   and name HB3 ))
   (  segid "    " and resid 2    and name HG1%)
      5.000     3.200     1.000 peak  2328 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      2.347 ppm2      0.832 CV     1
 OR { 2328}
   (( segid "    " and resid 21   and name HB3 ))
   (  segid "    " and resid 2    and name HG2%)
 ASSI { 2329}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 68   and name HB3 ))
      4.200     2.200     1.800 peak  2329 spectrum    1 weight  0.10000E+01 volume  0.84965E-03 ppm1      4.105 ppm2      1.102 CV     1
 ASSI { 2330}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 4    and name HD2%)
      2.800     1.000     1.000 peak  2330 spectrum    1 weight  0.10000E+01 volume  0.33175E-02 ppm1      4.104 ppm2      0.700 CV     1
 OR { 2330}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 2333}
   (( segid "    " and resid 21   and name HG2 ))
   (  segid "    " and resid 4    and name HD1%)
      4.500     2.600     1.500 peak  2333 spectrum    1 weight  0.10000E+01 volume  0.11137E-02 ppm1      2.147 ppm2      0.704 CV     1
 ASSI { 2334}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 20   and name H   ))
      3.900     1.900     1.900 peak  2334 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      2.127 ppm2      9.205 CV     1
 ASSI { 2335}
   (( segid "    " and resid 20   and name HG3 ))
   (( segid "    " and resid 20   and name H   ))
      2.400     0.700     0.700 peak  2335 spectrum    1 weight  0.10000E+01 volume  0.49118E-02 ppm1      2.364 ppm2      9.212 CV     1
 OR { 2335}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 20   and name H   ))
 ASSI { 2336}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 22   and name H   ))
      4.600     2.700     1.400 peak  2336 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      2.367 ppm2      7.380 CV     1
 OR { 2336}
   (( segid "    " and resid 20   and name HG3 ))
   (( segid "    " and resid 22   and name H   ))
 ASSI { 2337}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 22   and name H   ))
      3.300     1.400     1.400 peak  2337 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      2.127 ppm2      7.385 CV     1
 ASSI { 2338}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 20   and name HA  ))
      2.700     0.900     0.900 peak  2338 spectrum    1 weight  0.10000E+01 volume  0.31211E-02 ppm1      2.367 ppm2      4.659 CV     1
 OR { 2338}
   (( segid "    " and resid 20   and name HG3 ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI { 2339}
   (( segid "    " and resid 20   and name HG3 ))
   (( segid "    " and resid 19   and name HA  ))
      4.000     2.000     2.000 peak  2339 spectrum    1 weight  0.10000E+01 volume  0.16282E-02 ppm1      2.368 ppm2      4.844 CV     1
 ASSI { 2341}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name HD2 ))
      2.200     0.600     0.600 peak  2341 spectrum    1 weight  0.10000E+01 volume  0.34325E-02 ppm1      4.670 ppm2      3.890 CV     1
 ASSI { 2342}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 21   and name HD2 ))
      3.300     1.300     1.300 peak  2342 spectrum    1 weight  0.10000E+01 volume  0.24271E-02 ppm1      2.363 ppm2      3.882 CV     1
 ASSI { 2343}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 21   and name HD2 ))
      2.600     0.900     0.900 peak  2343 spectrum    1 weight  0.10000E+01 volume  0.14928E-02 ppm1      2.123 ppm2      3.887 CV     1
 ASSI { 2345}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HB3 ))
      2.600     0.800     0.800 peak  2345 spectrum    1 weight  0.10000E+01 volume  0.19701E-02 ppm1      4.648 ppm2      2.138 CV     1
 ASSI { 2348}
   (( segid "    " and resid 20   and name HG3 ))
   (( segid "    " and resid 20   and name HB2 ))
      2.400     0.700     0.700 peak  2348 spectrum    1 weight  0.10000E+01 volume  0.70310E-02 ppm1      2.362 ppm2      1.894 CV     1
 OR { 2348}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 20   and name HB2 ))
 ASSI { 2351}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 68   and name HD1%)
      4.800     2.800     1.200 peak  2351 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      4.851 ppm2      0.325 CV     1
 ASSI { 2354}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 19   and name HB2 ))
      2.400     0.700     0.700 peak  2354 spectrum    1 weight  0.10000E+01 volume  0.12220E-02 ppm1      2.934 ppm2      2.289 CV     1
 ASSI { 2355}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      3.300     1.300     1.300 peak  2355 spectrum    1 weight  0.10000E+01 volume  0.19904E-02 ppm1      4.852 ppm2      2.299 CV     1
 ASSI { 2357}
   (( segid "    " and resid 19   and name HB2 ))
   (  segid "    " and resid 31   and name HE% )
      5.500     3.800     0.500 peak  2357 spectrum    1 weight  0.10000E+01 volume  0.72780E-03 ppm1      2.281 ppm2      2.038 CV     1
 ASSI { 2359}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB3 ))
      2.700     0.900     0.900 peak  2359 spectrum    1 weight  0.10000E+01 volume  0.19431E-02 ppm1      4.853 ppm2      2.943 CV     1
 ASSI { 2365}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 20   and name H   ))
      4.200     2.200     1.800 peak  2365 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      2.290 ppm2      9.220 CV     1
 ASSI { 2369}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name H   ))
      2.400     0.700     0.700 peak  2369 spectrum    1 weight  0.10000E+01 volume  0.38659E-02 ppm1      4.849 ppm2      9.209 CV     1
 ASSI { 2371}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 19   and name H   ))
      3.300     1.400     1.400 peak  2371 spectrum    1 weight  0.10000E+01 volume  0.46275E-02 ppm1      2.025 ppm2      8.840 CV     1
 OR { 2371}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 2372}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 4    and name H   ))
      3.700     1.700     1.700 peak  2372 spectrum    1 weight  0.10000E+01 volume  0.10325E-02 ppm1      2.026 ppm2      8.729 CV     1
 OR { 2372}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 4    and name H   ))
 ASSI { 2373}
   (( segid "    " and resid 101  and name HB3 ))
   (( segid "    " and resid 102  and name H   ))
      3.600     1.600     1.600 peak  2373 spectrum    1 weight  0.10000E+01 volume  0.11983E-02 ppm1      1.593 ppm2      8.836 CV     1
 ASSI { 2375}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 19   and name H   ))
      2.400     0.700     0.700 peak  2375 spectrum    1 weight  0.10000E+01 volume  0.37845E-02 ppm1      5.269 ppm2      8.838 CV     1
 ASSI { 2376}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 5    and name H   ))
      3.700     1.700     1.700 peak  2376 spectrum    1 weight  0.10000E+01 volume  0.10054E-02 ppm1      2.021 ppm2      8.661 CV     1
 ASSI { 2377}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 18   and name H   ))
      3.100     1.200     1.200 peak  2377 spectrum    1 weight  0.10000E+01 volume  0.57478E-02 ppm1      2.027 ppm2      7.663 CV     1
 OR { 2377}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 18   and name H   ))
 ASSI { 2379}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name H   ))
      4.100     2.100     1.900 peak  2379 spectrum    1 weight  0.10000E+01 volume  0.13676E-02 ppm1      1.449 ppm2      7.663 CV     1
 ASSI { 2380}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name H   ))
      3.100     1.200     1.200 peak  2380 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      5.268 ppm2      7.662 CV     1
 ASSI { 2381}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 18   and name HE21))
      2.300     0.600     0.600 peak  2381 spectrum    1 weight  0.10000E+01 volume  0.59104E-02 ppm1      2.024 ppm2      7.207 CV     1
 OR { 2381}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 18   and name HE21))
 ASSI { 2383}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 75   and name HD22))
      3.800     1.800     1.800 peak  2383 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1      2.020 ppm2      7.062 CV     1
 OR { 2383}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 75   and name HD22))
 ASSI { 2387}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 18   and name HA  ))
      2.000     0.500     0.500 peak  2387 spectrum    1 weight  0.10000E+01 volume  0.77587E-02 ppm1      2.025 ppm2      5.266 CV     1
 ASSI { 2390}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 5    and name HA  ))
      2.000     0.500     0.500 peak  2390 spectrum    1 weight  0.10000E+01 volume  0.48880E-02 ppm1      2.024 ppm2      4.888 CV     1
 ASSI { 2391}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
      3.400     1.500     1.500 peak  2391 spectrum    1 weight  0.10000E+01 volume  0.14184E-02 ppm1      2.020 ppm2      4.713 CV     1
 OR { 2391}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 4    and name HA  ))
 ASSI { 2392}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 5    and name HA  ))
      4.900     3.000     1.100 peak  2392 spectrum    1 weight  0.10000E+01 volume  0.74811E-03 ppm1      1.443 ppm2      4.899 CV     1
 ASSI { 2393}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 5    and name HA  ))
      2.900     1.000     1.000 peak  2393 spectrum    1 weight  0.10000E+01 volume  0.19160E-02 ppm1      5.269 ppm2      4.885 CV     1
 ASSI { 2394}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 17   and name HA  ))
      3.800     1.800     1.800 peak  2394 spectrum    1 weight  0.10000E+01 volume  0.21529E-02 ppm1      2.026 ppm2      4.379 CV     1
 OR { 2394}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 2395}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 3    and name HA  ))
      4.000     2.000     2.000 peak  2395 spectrum    1 weight  0.10000E+01 volume  0.12390E-02 ppm1      2.027 ppm2      4.283 CV     1
 OR { 2395}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 3    and name HA  ))
 ASSI { 2396}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 5    and name HB2 ))
      5.500     3.700     0.500 peak  2396 spectrum    1 weight  0.10000E+01 volume  0.61608E-03 ppm1      5.271 ppm2      3.547 CV     1
 ASSI { 2397}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 5    and name HB3 ))
      3.400     1.400     1.400 peak  2397 spectrum    1 weight  0.10000E+01 volume  0.28469E-02 ppm1      2.023 ppm2      3.578 CV     1
 OR { 2397}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 5    and name HB2 ))
 OR { 2397}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 5    and name HB3 ))
 ASSI { 2400}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG3 ))
      2.500     0.800     0.800 peak  2400 spectrum    1 weight  0.10000E+01 volume  0.34155E-02 ppm1      5.270 ppm2      2.024 CV     1
 OR { 2400}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 2401}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
      3.100     1.200     1.200 peak  2401 spectrum    1 weight  0.10000E+01 volume  0.23290E-02 ppm1      5.268 ppm2      1.583 CV     1
 ASSI { 2402}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name HB2 ))
      2.000     0.500     0.500 peak  2402 spectrum    1 weight  0.10000E+01 volume  0.52299E-02 ppm1      1.448 ppm2      1.588 CV     1
 ASSI { 2403}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 18   and name HB2 ))
      2.400     0.700     0.700 peak  2403 spectrum    1 weight  0.10000E+01 volume  0.10328E-01 ppm1      2.025 ppm2      1.588 CV     1
 OR { 2403}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI { 2404}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 18   and name HB3 ))
      2.000     0.500     0.500 peak  2404 spectrum    1 weight  0.10000E+01 volume  0.11682E-01 ppm1      2.025 ppm2      1.449 CV     1
 OR { 2404}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 2406}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
      2.900     1.000     1.000 peak  2406 spectrum    1 weight  0.10000E+01 volume  0.21563E-02 ppm1      5.268 ppm2      1.452 CV     1
 ASSI { 2411}
   (( segid "    " and resid 18   and name HG3 ))
   (  segid "    " and resid 16   and name HG2%)
      3.200     1.300     1.300 peak  2411 spectrum    1 weight  0.10000E+01 volume  0.21529E-02 ppm1      2.027 ppm2      0.927 CV     1
 ASSI { 2412}
   (( segid "    " and resid 18   and name HG3 ))
   (  segid "    " and resid 6    and name HD1%)
      4.500     2.600     1.500 peak  2412 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      2.025 ppm2      0.710 CV     1
 OR { 2412}
   (( segid "    " and resid 18   and name HG2 ))
   (  segid "    " and resid 6    and name HD1%)
 ASSI { 2413}
   (( segid "    " and resid 101  and name HB3 ))
   (  segid "    " and resid 102  and name HG2%)
      4.800     2.900     1.200 peak  2413 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      1.570 ppm2      0.702 CV     1
 ASSI { 2414}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 6    and name HD1%)
      4.300     2.300     1.700 peak  2414 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      5.278 ppm2      0.716 CV     1
 ASSI { 2415}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name H   ))
      3.000     1.100     1.100 peak  2415 spectrum    1 weight  0.10000E+01 volume  0.16824E-02 ppm1      4.383 ppm2      9.139 CV     1
 ASSI { 2416}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name H   ))
      3.100     1.200     1.200 peak  2416 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      1.467 ppm2      9.147 CV     1
 OR { 2416}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 17   and name H   ))
 ASSI { 2417}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 17   and name H   ))
      4.800     2.800     1.200 peak  2417 spectrum    1 weight  0.10000E+01 volume  0.14285E-02 ppm1      1.686 ppm2      9.139 CV     1
 ASSI { 2418}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 32   and name H   ))
      2.900     1.000     1.000 peak  2418 spectrum    1 weight  0.10000E+01 volume  0.37574E-02 ppm1      1.684 ppm2      8.089 CV     1
 ASSI { 2419}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 36   and name H   ))
      4.000     2.000     2.000 peak  2419 spectrum    1 weight  0.10000E+01 volume  0.20480E-02 ppm1      1.682 ppm2      7.977 CV     1
 ASSI { 2420}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 31   and name H   ))
      3.900     1.900     1.900 peak  2420 spectrum    1 weight  0.10000E+01 volume  0.18754E-02 ppm1      1.684 ppm2      8.327 CV     1
 ASSI { 2422}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 18   and name H   ))
      2.900     1.100     1.100 peak  2422 spectrum    1 weight  0.10000E+01 volume  0.19058E-02 ppm1      1.479 ppm2      7.664 CV     1
 ASSI { 2423}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 18   and name H   ))
      2.900     1.000     1.000 peak  2423 spectrum    1 weight  0.10000E+01 volume  0.38049E-02 ppm1      1.684 ppm2      7.657 CV     1
 ASSI { 2424}
   (( segid "    " and resid 17   and name HB3 ))
   (  segid "    " and resid 19   and name HE% )
      3.100     1.200     1.200 peak  2424 spectrum    1 weight  0.10000E+01 volume  0.13676E-02 ppm1      1.468 ppm2      7.132 CV     1
 OR { 2424}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 19   and name HE% )
 ASSI { 2425}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 19   and name HZ  ))
      3.300     1.400     1.400 peak  2425 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      1.475 ppm2      6.964 CV     1
 OR { 2425}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 19   and name HZ  ))
 ASSI { 2426}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 19   and name HE% )
      2.400     0.700     0.700 peak  2426 spectrum    1 weight  0.10000E+01 volume  0.75961E-02 ppm1      1.684 ppm2      7.124 CV     1
 ASSI { 2427}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 19   and name HZ  ))
      2.500     0.800     0.800 peak  2427 spectrum    1 weight  0.10000E+01 volume  0.63639E-02 ppm1      1.685 ppm2      6.967 CV     1
 ASSI { 2428}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 17   and name HA  ))
      3.400     1.400     1.400 peak  2428 spectrum    1 weight  0.10000E+01 volume  0.43634E-02 ppm1      1.683 ppm2      4.368 CV     1
 ASSI { 2430}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 31   and name HA  ))
      3.600     1.600     1.600 peak  2430 spectrum    1 weight  0.10000E+01 volume  0.29213E-02 ppm1      1.684 ppm2      3.874 CV     1
 ASSI { 2431}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 32   and name HA  ))
      2.200     0.600     0.600 peak  2431 spectrum    1 weight  0.10000E+01 volume  0.10020E-01 ppm1      1.684 ppm2      3.227 CV     1
 ASSI { 2432}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 35   and name HD3 ))
      2.300     0.700     0.700 peak  2432 spectrum    1 weight  0.10000E+01 volume  0.50201E-02 ppm1      1.684 ppm2      3.118 CV     1
 ASSI { 2433}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 35   and name HD2 ))
      3.300     1.400     1.400 peak  2433 spectrum    1 weight  0.10000E+01 volume  0.51216E-02 ppm1      1.683 ppm2      3.010 CV     1
 ASSI { 2434}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 31   and name HB3 ))
      2.600     0.800     0.800 peak  2434 spectrum    1 weight  0.10000E+01 volume  0.49624E-02 ppm1      1.683 ppm2      2.331 CV     1
 ASSI { 2435}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 17   and name HG2 ))
      2.600     0.900     0.900 peak  2435 spectrum    1 weight  0.10000E+01 volume  0.10396E-01 ppm1      1.684 ppm2      2.124 CV     1
 ASSI { 2437}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 31   and name HB2 ))
      2.300     0.700     0.700 peak  2437 spectrum    1 weight  0.10000E+01 volume  0.93633E-02 ppm1      1.684 ppm2      1.983 CV     1
 ASSI { 2438}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HG2 ))
      2.700     0.900     0.900 peak  2438 spectrum    1 weight  0.10000E+01 volume  0.26877E-02 ppm1      1.483 ppm2      2.082 CV     1
 OR { 2438}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 17   and name HG2 ))
 OR { 2438}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HG3 ))
 OR { 2438}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 17   and name HG3 ))
 ASSI { 2443}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
      4.200     2.200     1.800 peak  2443 spectrum    1 weight  0.10000E+01 volume  0.13642E-02 ppm1      4.380 ppm2      1.586 CV     1
 ASSI { 2444}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB3 ))
      2.600     0.900     0.900 peak  2444 spectrum    1 weight  0.10000E+01 volume  0.41535E-02 ppm1      4.382 ppm2      1.473 CV     1
 OR { 2444}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 2445}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 16   and name HG2%)
      4.500     2.600     1.500 peak  2445 spectrum    1 weight  0.10000E+01 volume  0.74811E-03 ppm1      1.464 ppm2      0.933 CV     1
 ASSI { 2446}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 8    and name HD1%)
      3.500     1.500     1.500 peak  2446 spectrum    1 weight  0.10000E+01 volume  0.18415E-02 ppm1      1.477 ppm2      0.726 CV     1
 ASSI { 2447}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 17   and name HB3 ))
      1.800     0.400     0.400 peak  2447 spectrum    1 weight  0.10000E+01 volume  0.17240E-01 ppm1      1.684 ppm2      1.471 CV     1
 ASSI { 2449}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 32   and name HD1%)
      3.200     1.200     1.200 peak  2449 spectrum    1 weight  0.10000E+01 volume  0.59476E-02 ppm1      1.684 ppm2      0.110 CV     1
 ASSI { 2452}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 16   and name H   ))
      3.600     1.600     1.600 peak  2452 spectrum    1 weight  0.10000E+01 volume  0.41740E-02 ppm1      0.930 ppm2      8.595 CV     1
 ASSI { 2453}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 17   and name H   ))
      2.600     0.900     0.900 peak  2453 spectrum    1 weight  0.10000E+01 volume  0.89671E-02 ppm1      0.930 ppm2      9.138 CV     1
 ASSI { 2456}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 7    and name HA  ))
      3.100     1.200     1.200 peak  2456 spectrum    1 weight  0.10000E+01 volume  0.35002E-02 ppm1      0.931 ppm2      4.498 CV     1
 ASSI { 2457}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 17   and name HA  ))
      3.200     1.200     1.200 peak  2457 spectrum    1 weight  0.10000E+01 volume  0.23256E-02 ppm1      0.930 ppm2      4.382 CV     1
 ASSI { 2460}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 16   and name HB  ))
      2.200     0.600     0.600 peak  2460 spectrum    1 weight  0.10000E+01 volume  0.16709E-01 ppm1      0.931 ppm2      3.867 CV     1
 ASSI { 2461}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 5    and name HB3 ))
      2.600     0.900     0.900 peak  2461 spectrum    1 weight  0.10000E+01 volume  0.49929E-02 ppm1      0.931 ppm2      3.559 CV     1
 ASSI { 2462}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 7    and name HE3 ))
      2.200     2.200     3.800 peak  2462 spectrum    1 weight  0.10000E+01 volume  0.20412E-02 ppm1      0.931 ppm2      2.798 CV     1
 OR { 2462}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 7    and name HE2 ))
 ASSI { 2464}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 17   and name HB2 ))
      3.400     1.400     1.400 peak  2464 spectrum    1 weight  0.10000E+01 volume  0.48779E-02 ppm1      0.930 ppm2      1.466 CV     1
 OR { 2464}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 17   and name HB3 ))
 ASSI { 2465}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 16   and name HG2%)
      2.800     1.000     1.000 peak  2465 spectrum    1 weight  0.10000E+01 volume  0.31989E-02 ppm1      4.953 ppm2      0.925 CV     1
 ASSI { 2468}
   (( segid "    " and resid 14   and name HB  ))
   (  segid "    " and resid 14   and name HG2%)
      2.300     0.700     0.700 peak  2468 spectrum    1 weight  0.10000E+01 volume  0.85947E-02 ppm1      1.795 ppm2      0.712 CV     1
 ASSI { 2471}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 14   and name HB  ))
      2.000     0.500     0.500 peak  2471 spectrum    1 weight  0.10000E+01 volume  0.22765E-01 ppm1      0.780 ppm2      1.792 CV     1
 ASSI { 2472}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 7    and name HB3 ))
      3.600     1.600     1.600 peak  2472 spectrum    1 weight  0.10000E+01 volume  0.29790E-02 ppm1      0.778 ppm2      1.336 CV     1
 ASSI { 2475}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 9    and name HB2 ))
      3.600     1.600     1.600 peak  2475 spectrum    1 weight  0.10000E+01 volume  0.46477E-02 ppm1      0.780 ppm2      3.575 CV     1
 ASSI { 2476}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 13   and name HA  ))
      3.300     1.400     1.400 peak  2476 spectrum    1 weight  0.10000E+01 volume  0.30568E-02 ppm1      0.778 ppm2      4.222 CV     1
 ASSI { 2477}
   (( segid "    " and resid 14   and name HB  ))
   (( segid "    " and resid 13   and name HA  ))
      3.600     1.700     1.700 peak  2477 spectrum    1 weight  0.10000E+01 volume  0.13608E-02 ppm1      1.799 ppm2      4.220 CV     1
 ASSI { 2478}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 13   and name HA  ))
      4.100     2.100     1.900 peak  2478 spectrum    1 weight  0.10000E+01 volume  0.70749E-03 ppm1      4.981 ppm2      4.230 CV     1
 ASSI { 2479}
   (( segid "    " and resid 14   and name HB  ))
   (( segid "    " and resid 14   and name HA  ))
      2.800     1.000     1.000 peak  2479 spectrum    1 weight  0.10000E+01 volume  0.17027E-02 ppm1      1.796 ppm2      4.993 CV     1
 ASSI { 2480}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 9    and name HA  ))
      2.600     0.900     0.900 peak  2480 spectrum    1 weight  0.10000E+01 volume  0.17704E-02 ppm1      4.997 ppm2      5.292 CV     1
 ASSI { 2481}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 14   and name HA  ))
      2.900     1.100     1.100 peak  2481 spectrum    1 weight  0.10000E+01 volume  0.72237E-02 ppm1      0.780 ppm2      4.993 CV     1
 ASSI { 2482}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 9    and name HA  ))
      3.800     1.800     1.800 peak  2482 spectrum    1 weight  0.10000E+01 volume  0.47324E-02 ppm1      0.779 ppm2      5.296 CV     1
 ASSI { 2483}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 14   and name H   ))
      2.100     0.500     0.500 peak  2483 spectrum    1 weight  0.10000E+01 volume  0.87844E-02 ppm1      0.821 ppm2      8.209 CV     1
 ASSI { 2484}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 14   and name H   ))
      2.300     0.700     0.700 peak  2484 spectrum    1 weight  0.10000E+01 volume  0.69971E-02 ppm1      0.779 ppm2      8.208 CV     1
 ASSI { 2485}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 13   and name H   ))
      3.600     1.600     1.600 peak  2485 spectrum    1 weight  0.10000E+01 volume  0.49017E-02 ppm1      0.820 ppm2      8.086 CV     1
 ASSI { 2487}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name H   ))
      2.900     1.000     1.000 peak  2487 spectrum    1 weight  0.10000E+01 volume  0.12017E-02 ppm1      4.997 ppm2      8.209 CV     1
 ASSI { 2489}
   (( segid "    " and resid 14   and name HB  ))
   (( segid "    " and resid 15   and name H   ))
      4.300     2.300     1.700 peak  2489 spectrum    1 weight  0.10000E+01 volume  0.12762E-02 ppm1      1.789 ppm2      8.898 CV     1
 ASSI { 2490}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 15   and name H   ))
      3.200     1.300     1.300 peak  2490 spectrum    1 weight  0.10000E+01 volume  0.67162E-02 ppm1      0.780 ppm2      8.892 CV     1
 ASSI { 2491}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 186  and name H   ))
      3.000     1.100     1.100 peak  2491 spectrum    1 weight  0.10000E+01 volume  0.58393E-02 ppm1      0.753 ppm2      8.800 CV     1
 ASSI { 2492}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 10   and name H   ))
      4.600     2.600     1.400 peak  2492 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      2.183 ppm2      8.894 CV     1
 ASSI { 2493}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 10   and name H   ))
      4.300     2.300     1.700 peak  2493 spectrum    1 weight  0.10000E+01 volume  0.58900E-03 ppm1      4.229 ppm2      8.894 CV     1
 ASSI { 2494}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 10   and name H   ))
      3.000     1.100     1.100 peak  2494 spectrum    1 weight  0.10000E+01 volume  0.24542E-02 ppm1      0.916 ppm2      8.888 CV     1
 ASSI { 2495}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 12   and name H   ))
      4.300     2.300     1.700 peak  2495 spectrum    1 weight  0.10000E+01 volume  0.13642E-02 ppm1      0.916 ppm2      8.770 CV     1
 ASSI { 2496}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 38   and name H   ))
      4.400     2.400     1.600 peak  2496 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      0.912 ppm2      9.460 CV     1
 ASSI { 2497}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 14   and name H   ))
      3.100     1.200     1.200 peak  2497 spectrum    1 weight  0.10000E+01 volume  0.56429E-02 ppm1      0.915 ppm2      8.209 CV     1
 ASSI { 2498}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 13   and name H   ))
      2.100     0.600     0.600 peak  2498 spectrum    1 weight  0.10000E+01 volume  0.12044E-01 ppm1      0.915 ppm2      8.085 CV     1
 ASSI { 2501}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 14   and name H   ))
      2.200     0.600     0.600 peak  2501 spectrum    1 weight  0.10000E+01 volume  0.92922E-02 ppm1      4.221 ppm2      8.205 CV     1
 ASSI { 2503}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 13   and name HA  ))
      2.800     1.000     1.000 peak  2503 spectrum    1 weight  0.10000E+01 volume  0.12102E-01 ppm1      0.915 ppm2      4.219 CV     1
 ASSI { 2504}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 9    and name HA  ))
      4.600     2.700     1.400 peak  2504 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      0.917 ppm2      5.286 CV     1
 ASSI { 2505}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 10   and name HA  ))
      3.600     1.600     1.600 peak  2505 spectrum    1 weight  0.10000E+01 volume  0.15876E-02 ppm1      0.917 ppm2      4.648 CV     1
 ASSI { 2506}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 14   and name HA  ))
      3.800     1.800     1.800 peak  2506 spectrum    1 weight  0.10000E+01 volume  0.13913E-02 ppm1      0.822 ppm2      4.992 CV     1
 ASSI { 2507}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name HA  ))
      3.700     1.700     1.700 peak  2507 spectrum    1 weight  0.10000E+01 volume  0.18720E-02 ppm1      0.820 ppm2      4.672 CV     1
 ASSI { 2508}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 9    and name HA  ))
      5.100     3.200     0.900 peak  2508 spectrum    1 weight  0.10000E+01 volume  0.90044E-03 ppm1      0.821 ppm2      5.285 CV     1
 ASSI { 2509}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 13   and name HA  ))
      2.900     1.100     1.100 peak  2509 spectrum    1 weight  0.10000E+01 volume  0.21157E-02 ppm1      2.181 ppm2      4.220 CV     1
 ASSI { 2510}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 13   and name HA  ))
      2.400     0.700     0.700 peak  2510 spectrum    1 weight  0.10000E+01 volume  0.10453E-01 ppm1      0.821 ppm2      4.219 CV     1
 ASSI { 2512}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 11   and name HA3 ))
      4.100     2.100     1.900 peak  2512 spectrum    1 weight  0.10000E+01 volume  0.12017E-02 ppm1      0.914 ppm2      3.664 CV     1
 ASSI { 2514}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 15   and name HE2 ))
      3.100     1.200     1.200 peak  2514 spectrum    1 weight  0.10000E+01 volume  0.31821E-02 ppm1      0.915 ppm2      2.817 CV     1
 ASSI { 2515}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 12   and name HB2 ))
      2.000     2.000     4.000 peak  2515 spectrum    1 weight  0.10000E+01 volume  0.38659E-02 ppm1      0.821 ppm2      2.904 CV     1
 ASSI { 2516}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name HE2 ))
      2.500     0.800     0.800 peak  2516 spectrum    1 weight  0.10000E+01 volume  0.54736E-02 ppm1      0.821 ppm2      2.803 CV     1
 OR { 2516}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name HE3 ))
 ASSI { 2518}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 13   and name HB  ))
      2.000     0.500     0.500 peak  2518 spectrum    1 weight  0.10000E+01 volume  0.17955E-01 ppm1      0.821 ppm2      2.181 CV     1
 ASSI { 2519}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 38   and name HG3 ))
      3.600     1.600     1.600 peak  2519 spectrum    1 weight  0.10000E+01 volume  0.17602E-02 ppm1      0.823 ppm2      2.426 CV     1
 ASSI { 2520}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 38   and name HG3 ))
      2.900     1.000     1.000 peak  2520 spectrum    1 weight  0.10000E+01 volume  0.36323E-02 ppm1      0.915 ppm2      2.428 CV     1
 ASSI { 2521}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 13   and name HB  ))
      2.100     0.500     0.500 peak  2521 spectrum    1 weight  0.10000E+01 volume  0.18198E-01 ppm1      0.916 ppm2      2.181 CV     1
 ASSI { 2522}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 10   and name HB  ))
      2.500     0.800     0.800 peak  2522 spectrum    1 weight  0.10000E+01 volume  0.45156E-02 ppm1      0.916 ppm2      1.805 CV     1
 ASSI { 2523}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 15   and name HD3 ))
      3.800     1.800     1.800 peak  2523 spectrum    1 weight  0.10000E+01 volume  0.18178E-02 ppm1      0.917 ppm2      1.676 CV     1
 ASSI { 2524}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 10   and name HG13))
      3.300     1.400     1.400 peak  2524 spectrum    1 weight  0.10000E+01 volume  0.28875E-02 ppm1      0.914 ppm2      1.576 CV     1
 ASSI { 2525}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 15   and name HB2 ))
      3.400     1.500     1.500 peak  2525 spectrum    1 weight  0.10000E+01 volume  0.24034E-02 ppm1      0.912 ppm2      1.479 CV     1
 ASSI { 2526}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 15   and name HG2 ))
      2.800     1.000     1.000 peak  2526 spectrum    1 weight  0.10000E+01 volume  0.27014E-02 ppm1      0.912 ppm2      1.312 CV     1
 ASSI { 2527}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 15   and name HG3 ))
      3.600     1.600     1.600 peak  2527 spectrum    1 weight  0.10000E+01 volume  0.18686E-02 ppm1      0.914 ppm2      1.233 CV     1
 ASSI { 2528}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 38   and name HB3 ))
      3.200     1.300     1.300 peak  2528 spectrum    1 weight  0.10000E+01 volume  0.18584E-02 ppm1      0.917 ppm2      1.915 CV     1
 ASSI { 2529}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name HD3 ))
      2.900     1.100     1.100 peak  2529 spectrum    1 weight  0.10000E+01 volume  0.36220E-02 ppm1      0.820 ppm2      1.680 CV     1
 ASSI { 2531}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name HB2 ))
      3.600     1.700     1.700 peak  2531 spectrum    1 weight  0.10000E+01 volume  0.29857E-02 ppm1      0.819 ppm2      1.479 CV     1
 ASSI { 2532}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name HG2 ))
      2.500     0.800     0.800 peak  2532 spectrum    1 weight  0.10000E+01 volume  0.48880E-02 ppm1      0.820 ppm2      1.299 CV     1
 ASSI { 2533}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name HG3 ))
      3.300     1.300     1.300 peak  2533 spectrum    1 weight  0.10000E+01 volume  0.50539E-02 ppm1      0.821 ppm2      1.242 CV     1
 ASSI { 2540}
   (( segid "    " and resid 11   and name HA2 ))
   (( segid "    " and resid 11   and name HA3 ))
      2.100     0.600     0.600 peak  2540 spectrum    1 weight  0.10000E+01 volume  0.46309E-02 ppm1      3.962 ppm2      3.675 CV     1
 ASSI { 2551}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 10   and name H   ))
      3.100     1.200     1.200 peak  2551 spectrum    1 weight  0.10000E+01 volume  0.10731E-02 ppm1      1.811 ppm2      8.889 CV     1
 ASSI { 2552}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 38   and name H   ))
      4.100     2.100     1.900 peak  2552 spectrum    1 weight  0.10000E+01 volume  0.96476E-03 ppm1      0.688 ppm2      9.458 CV     1
 ASSI { 2553}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name H   ))
      3.600     1.600     1.600 peak  2553 spectrum    1 weight  0.10000E+01 volume  0.25287E-02 ppm1      0.688 ppm2      8.887 CV     1
 ASSI { 2555}
   (( segid "    " and resid 10   and name HG13))
   (( segid "    " and resid 10   and name H   ))
      2.800     1.000     1.000 peak  2555 spectrum    1 weight  0.10000E+01 volume  0.13608E-02 ppm1      1.583 ppm2      8.883 CV     1
 ASSI { 2556}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 11   and name H   ))
      5.100     3.300     0.900 peak  2556 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      0.685 ppm2      9.107 CV     1
 ASSI { 2557}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 81   and name H   ))
      3.700     1.700     1.700 peak  2557 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      4.622 ppm2      8.543 CV     1
 ASSI { 2558}
   (( segid "    " and resid 10   and name HG13))
   (( segid "    " and resid 81   and name H   ))
      4.000     2.000     2.000 peak  2558 spectrum    1 weight  0.10000E+01 volume  0.61947E-03 ppm1      1.585 ppm2      8.542 CV     1
 ASSI { 2559}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 81   and name H   ))
      4.300     2.300     1.700 peak  2559 spectrum    1 weight  0.10000E+01 volume  0.97153E-03 ppm1      0.874 ppm2      8.558 CV     1
 ASSI { 2560}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name H   ))
      3.600     1.600     1.600 peak  2560 spectrum    1 weight  0.10000E+01 volume  0.33852E-02 ppm1      0.872 ppm2      8.887 CV     1
 ASSI { 2561}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 11   and name H   ))
      3.300     1.400     1.400 peak  2561 spectrum    1 weight  0.10000E+01 volume  0.28435E-02 ppm1      0.873 ppm2      9.101 CV     1
 ASSI { 2563}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 13   and name H   ))
      4.000     2.000     2.000 peak  2563 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      0.875 ppm2      8.087 CV     1
 ASSI { 2564}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 13   and name H   ))
      4.400     2.400     1.600 peak  2564 spectrum    1 weight  0.10000E+01 volume  0.56871E-03 ppm1      1.826 ppm2      8.082 CV     1
 ASSI { 2565}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name H   ))
      3.000     1.100     1.100 peak  2565 spectrum    1 weight  0.10000E+01 volume  0.15267E-02 ppm1      4.627 ppm2      8.894 CV     1
 ASSI { 2566}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 39   and name H   ))
      3.100     1.200     1.200 peak  2566 spectrum    1 weight  0.10000E+01 volume  0.25727E-02 ppm1      0.688 ppm2      7.997 CV     1
 ASSI { 2567}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 81   and name H   ))
      4.300     2.300     1.700 peak  2567 spectrum    1 weight  0.10000E+01 volume  0.10832E-02 ppm1      0.688 ppm2      8.547 CV     1
 ASSI { 2569}
   (  segid "    " and resid 10   and name HG2%)
   (  segid "    " and resid 81   and name HD% )
      3.300     1.300     1.300 peak  2569 spectrum    1 weight  0.10000E+01 volume  0.28299E-02 ppm1      0.872 ppm2      6.812 CV     1
 ASSI { 2570}
   (( segid "    " and resid 10   and name HG12))
   (  segid "    " and resid 81   and name HD% )
      4.000     2.000     2.000 peak  2570 spectrum    1 weight  0.10000E+01 volume  0.10392E-02 ppm1      1.189 ppm2      6.817 CV     1
 ASSI { 2571}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 81   and name HD% )
      3.400     1.500     1.500 peak  2571 spectrum    1 weight  0.10000E+01 volume  0.46681E-02 ppm1      0.687 ppm2      6.813 CV     1
 ASSI { 2572}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 47   and name HE% )
      4.200     2.300     1.800 peak  2572 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      0.682 ppm2      7.081 CV     1
 ASSI { 2574}
   (( segid "    " and resid 10   and name HG13))
   (  segid "    " and resid 81   and name HD% )
      5.200     3.400     0.800 peak  2574 spectrum    1 weight  0.10000E+01 volume  0.84288E-03 ppm1      1.572 ppm2      6.806 CV     1
 ASSI { 2575}
   (  segid "    " and resid 10   and name HG2%)
   (  segid "    " and resid 81   and name HE% )
      4.600     2.600     1.400 peak  2575 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      0.871 ppm2      6.311 CV     1
 ASSI { 2576}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 81   and name HE% )
      4.300     2.400     1.700 peak  2576 spectrum    1 weight  0.10000E+01 volume  0.14387E-02 ppm1      0.684 ppm2      6.309 CV     1
 ASSI { 2577}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 10   and name HA  ))
      3.300     1.400     1.400 peak  2577 spectrum    1 weight  0.10000E+01 volume  0.11916E-02 ppm1      1.820 ppm2      4.620 CV     1
 ASSI { 2578}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HA  ))
      4.000     2.000     2.000 peak  2578 spectrum    1 weight  0.10000E+01 volume  0.21022E-02 ppm1      0.689 ppm2      4.622 CV     1
 ASSI { 2579}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 36   and name HA  ))
      4.500     2.600     1.500 peak  2579 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      0.682 ppm2      4.505 CV     1
 ASSI { 2580}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 81   and name HA  ))
      5.000     3.100     1.000 peak  2580 spectrum    1 weight  0.10000E+01 volume  0.84288E-03 ppm1      0.688 ppm2      5.414 CV     1
 ASSI { 2581}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 9    and name HA  ))
      4.800     2.900     1.200 peak  2581 spectrum    1 weight  0.10000E+01 volume  0.73119E-03 ppm1      0.688 ppm2      5.292 CV     1
 ASSI { 2582}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 14   and name HA  ))
      4.300     2.300     1.700 peak  2582 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      0.685 ppm2      4.979 CV     1
 ASSI { 2583}
   (( segid "    " and resid 10   and name HG12))
   (( segid "    " and resid 10   and name HA  ))
      2.900     1.100     1.100 peak  2583 spectrum    1 weight  0.10000E+01 volume  0.11949E-02 ppm1      1.187 ppm2      4.615 CV     1
 ASSI { 2584}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HA  ))
      2.600     0.800     0.800 peak  2584 spectrum    1 weight  0.10000E+01 volume  0.48407E-02 ppm1      0.872 ppm2      4.622 CV     1
 ASSI { 2585}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 9    and name HA  ))
      5.000     3.100     1.000 peak  2585 spectrum    1 weight  0.10000E+01 volume  0.10968E-02 ppm1      0.868 ppm2      5.303 CV     1
 ASSI { 2587}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 39   and name HA  ))
      2.200     0.600     0.600 peak  2587 spectrum    1 weight  0.10000E+01 volume  0.39166E-02 ppm1      0.689 ppm2      4.020 CV     1
 ASSI { 2588}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 81   and name HB3 ))
      3.800     1.800     1.800 peak  2588 spectrum    1 weight  0.10000E+01 volume  0.14048E-02 ppm1      0.872 ppm2      3.101 CV     1
 ASSI { 2589}
   (( segid "    " and resid 10   and name HG12))
   (( segid "    " and resid 81   and name HB3 ))
      2.700     0.900     0.900 peak  2589 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1      1.194 ppm2      3.113 CV     1
 ASSI { 2590}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 81   and name HB3 ))
      3.000     1.200     1.200 peak  2590 spectrum    1 weight  0.10000E+01 volume  0.24102E-02 ppm1      0.688 ppm2      3.101 CV     1
 ASSI { 2591}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 33   and name HA  ))
      4.900     2.900     1.100 peak  2591 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      0.686 ppm2      3.561 CV     1
 ASSI { 2592}
   (( segid "    " and resid 178  and name HG2 ))
   (( segid "    " and resid 178  and name HD2 ))
      3.200     1.300     1.300 peak  2592 spectrum    1 weight  0.10000E+01 volume  0.13574E-02 ppm1      1.606 ppm2      3.081 CV     1
 OR { 2592}
   (( segid "    " and resid 178  and name HG2 ))
   (( segid "    " and resid 178  and name HD3 ))
 ASSI { 2593}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 38   and name HG3 ))
      4.200     2.200     1.800 peak  2593 spectrum    1 weight  0.10000E+01 volume  0.57210E-03 ppm1      1.814 ppm2      2.421 CV     1
 ASSI { 2596}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HG13))
      3.200     1.300     1.300 peak  2596 spectrum    1 weight  0.10000E+01 volume  0.12694E-02 ppm1      4.623 ppm2      1.577 CV     1
 ASSI { 2597}
   (( segid "    " and resid 10   and name HG12))
   (( segid "    " and resid 81   and name HB2 ))
      4.200     2.300     1.800 peak  2597 spectrum    1 weight  0.10000E+01 volume  0.75150E-03 ppm1      1.181 ppm2      2.441 CV     1
 ASSI { 2598}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 10   and name HG12))
      3.200     1.300     1.300 peak  2598 spectrum    1 weight  0.10000E+01 volume  0.16079E-02 ppm1      1.819 ppm2      1.180 CV     1
 ASSI { 2600}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 38   and name HG2 ))
      3.600     1.600     1.600 peak  2600 spectrum    1 weight  0.10000E+01 volume  0.18043E-02 ppm1      0.687 ppm2      2.180 CV     1
 ASSI { 2601}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 8    and name HB  ))
      3.600     1.700     1.700 peak  2601 spectrum    1 weight  0.10000E+01 volume  0.17433E-02 ppm1      0.688 ppm2      2.085 CV     1
 ASSI { 2602}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HB  ))
      2.300     0.600     0.600 peak  2602 spectrum    1 weight  0.10000E+01 volume  0.86829E-02 ppm1      0.688 ppm2      1.819 CV     1
 ASSI { 2603}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HG13))
      2.100     0.500     0.500 peak  2603 spectrum    1 weight  0.10000E+01 volume  0.93429E-02 ppm1      0.688 ppm2      1.582 CV     1
 ASSI { 2604}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 10   and name HG12))
      2.100     0.600     0.600 peak  2604 spectrum    1 weight  0.10000E+01 volume  0.84154E-02 ppm1      0.687 ppm2      1.184 CV     1
 ASSI { 2605}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 39   and name HB% )
      2.300     0.700     0.700 peak  2605 spectrum    1 weight  0.10000E+01 volume  0.98709E-02 ppm1      0.687 ppm2      1.111 CV     1
 ASSI { 2606}
   (( segid "    " and resid 10   and name HG13))
   (( segid "    " and resid 10   and name HG12))
      1.700     0.400     0.500 peak  2606 spectrum    1 weight  0.10000E+01 volume  0.59613E-02 ppm1      1.584 ppm2      1.185 CV     1
 ASSI { 2607}
   (( segid "    " and resid 10   and name HG13))
   (( segid "    " and resid 10   and name HB  ))
      2.500     0.800     0.800 peak  2607 spectrum    1 weight  0.10000E+01 volume  0.26438E-02 ppm1      1.579 ppm2      1.815 CV     1
 ASSI { 2610}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HB  ))
      2.200     0.600     0.600 peak  2610 spectrum    1 weight  0.10000E+01 volume  0.11638E-01 ppm1      0.872 ppm2      1.817 CV     1
 ASSI { 2612}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HG13))
      3.200     1.300     1.300 peak  2612 spectrum    1 weight  0.10000E+01 volume  0.56362E-02 ppm1      0.872 ppm2      1.582 CV     1
 ASSI { 2614}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HG12))
      2.300     0.700     0.700 peak  2614 spectrum    1 weight  0.10000E+01 volume  0.69090E-02 ppm1      0.872 ppm2      1.187 CV     1
 ASSI { 2618}
   (  segid "    " and resid 10   and name HG2%)
   (  segid "    " and resid 10   and name HD1%)
      2.100     0.500     0.500 peak  2618 spectrum    1 weight  0.10000E+01 volume  0.16032E-01 ppm1      0.871 ppm2      0.684 CV     1
 ASSI { 2625}
   (  segid "    " and resid 10   and name HG2%)
   (  segid "    " and resid 32   and name HD1%)
      4.800     2.900     1.200 peak  2625 spectrum    1 weight  0.10000E+01 volume  0.17535E-02 ppm1      0.871 ppm2      0.109 CV     1
 ASSI { 2626}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 32   and name HD1%)
      2.400     0.700     0.700 peak  2626 spectrum    1 weight  0.10000E+01 volume  0.72814E-02 ppm1      0.687 ppm2      0.109 CV     1
 ASSI { 2628}
   (( segid "    " and resid 9    and name HB3 ))
   (  segid "    " and resid 14   and name HG1%)
      4.300     2.300     1.700 peak  2628 spectrum    1 weight  0.10000E+01 volume  0.24880E-02 ppm1      3.665 ppm2      0.771 CV     1
 ASSI { 2631}
   (( segid "    " and resid 9    and name HB3 ))
   (  segid "    " and resid 78   and name HG2%)
      3.400     1.500     1.500 peak  2631 spectrum    1 weight  0.10000E+01 volume  0.21665E-02 ppm1      3.663 ppm2      1.004 CV     1
 ASSI { 2633}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 80   and name HG2 ))
      4.800     2.900     1.200 peak  2633 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      3.580 ppm2      2.020 CV     1
 ASSI { 2637}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 9    and name HB2 ))
      1.900     0.400     0.400 peak  2637 spectrum    1 weight  0.10000E+01 volume  0.83071E-02 ppm1      3.662 ppm2      3.575 CV     1
 ASSI { 2641}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name HA  ))
      3.300     1.400     1.400 peak  2641 spectrum    1 weight  0.10000E+01 volume  0.10392E-02 ppm1      3.671 ppm2      4.620 CV     1
 ASSI { 2642}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 14   and name HA  ))
      4.800     2.800     1.200 peak  2642 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      3.664 ppm2      4.985 CV     1
 ASSI { 2643}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 8    and name HA  ))
      4.900     3.000     1.100 peak  2643 spectrum    1 weight  0.10000E+01 volume  0.10223E-02 ppm1      3.664 ppm2      4.932 CV     1
 ASSI { 2644}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 8    and name HA  ))
      4.500     2.600     1.500 peak  2644 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      3.574 ppm2      4.933 CV     1
 ASSI { 2646}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 9    and name HA  ))
      3.100     1.200     1.200 peak  2646 spectrum    1 weight  0.10000E+01 volume  0.16621E-02 ppm1      3.664 ppm2      5.293 CV     1
 ASSI { 2647}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 80   and name HA  ))
      3.500     1.500     1.500 peak  2647 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      3.665 ppm2      5.176 CV     1
 ASSI { 2648}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name HA  ))
      2.800     1.000     1.000 peak  2648 spectrum    1 weight  0.10000E+01 volume  0.18618E-02 ppm1      3.578 ppm2      5.294 CV     1
 ASSI { 2649}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 80   and name HA  ))
      3.800     1.800     1.800 peak  2649 spectrum    1 weight  0.10000E+01 volume  0.12457E-02 ppm1      3.580 ppm2      5.167 CV     1
 ASSI { 2650}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 81   and name H   ))
      4.900     3.000     1.100 peak  2650 spectrum    1 weight  0.10000E+01 volume  0.68718E-03 ppm1      3.576 ppm2      8.549 CV     1
 ASSI { 2651}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 81   and name H   ))
      4.600     2.600     1.400 peak  2651 spectrum    1 weight  0.10000E+01 volume  0.69395E-03 ppm1      3.670 ppm2      8.537 CV     1
 ASSI { 2653}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name H   ))
      2.600     0.900     0.900 peak  2653 spectrum    1 weight  0.10000E+01 volume  0.27994E-02 ppm1      3.579 ppm2      8.870 CV     1
 ASSI { 2657}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 6    and name H   ))
      4.000     2.000     2.000 peak  2657 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      0.709 ppm2      8.895 CV     1
 ASSI { 2661}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 76   and name H   ))
      2.900     1.000     1.000 peak  2661 spectrum    1 weight  0.10000E+01 volume  0.27725E-02 ppm1      0.882 ppm2      9.305 CV     1
 ASSI { 2662}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 77   and name H   ))
      2.600     0.900     0.900 peak  2662 spectrum    1 weight  0.10000E+01 volume  0.57987E-02 ppm1      0.883 ppm2      8.085 CV     1
 ASSI { 2663}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 77   and name H   ))
      4.400     2.400     1.600 peak  2663 spectrum    1 weight  0.10000E+01 volume  0.91736E-03 ppm1      0.708 ppm2      8.081 CV     1
 ASSI { 2664}
   (  segid "    " and resid 6    and name HD1%)
   (  segid "    " and resid 19   and name HD% )
      2.500     0.800     0.800 peak  2664 spectrum    1 weight  0.10000E+01 volume  0.42856E-02 ppm1      0.708 ppm2      7.063 CV     1
 ASSI { 2665}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 73   and name H   ))
      4.500     2.500     1.500 peak  2665 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      0.881 ppm2      6.783 CV     1
 ASSI { 2666}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 6    and name HA  ))
      4.000     2.000     2.000 peak  2666 spectrum    1 weight  0.10000E+01 volume  0.21089E-02 ppm1      0.708 ppm2      4.966 CV     1
 ASSI { 2670}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 6    and name HA  ))
      2.300     0.600     0.600 peak  2670 spectrum    1 weight  0.10000E+01 volume  0.74269E-02 ppm1      0.882 ppm2      4.973 CV     1
 ASSI { 2672}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 74   and name HA  ))
      3.400     1.500     1.500 peak  2672 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      0.882 ppm2      4.475 CV     1
 ASSI { 2673}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 19   and name HB2 ))
      3.300     1.300     1.300 peak  2673 spectrum    1 weight  0.10000E+01 volume  0.10426E-02 ppm1      0.709 ppm2      2.293 CV     1
 ASSI { 2674}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 79   and name HG3 ))
      3.300     1.300     1.300 peak  2674 spectrum    1 weight  0.10000E+01 volume  0.23222E-02 ppm1      0.708 ppm2      2.139 CV     1
 OR { 2674}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 2675}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 19   and name HB3 ))
      4.500     2.500     1.500 peak  2675 spectrum    1 weight  0.10000E+01 volume  0.10731E-02 ppm1      0.713 ppm2      2.931 CV     1
 ASSI { 2676}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 4    and name HB2 ))
      2.500     0.800     0.800 peak  2676 spectrum    1 weight  0.10000E+01 volume  0.72137E-02 ppm1      0.709 ppm2      1.555 CV     1
 ASSI { 2677}
   (  segid "    " and resid 6    and name HD1%)
   (  segid "    " and resid 79   and name HE% )
      2.400     2.400     3.600 peak  2677 spectrum    1 weight  0.10000E+01 volume  0.10670E-01 ppm1      0.709 ppm2      1.474 CV     1
 ASSI { 2679}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 68   and name HB3 ))
      3.200     1.300     1.300 peak  2679 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      0.707 ppm2      1.098 CV     1
 ASSI { 2681}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HB3 ))
      2.600     0.800     0.800 peak  2681 spectrum    1 weight  0.10000E+01 volume  0.72780E-03 ppm1      1.318 ppm2      1.659 CV     1
 ASSI { 2683}
   (( segid "    " and resid 6    and name HB2 ))
   (  segid "    " and resid 6    and name HD1%)
      3.100     1.200     1.200 peak  2683 spectrum    1 weight  0.10000E+01 volume  0.12593E-02 ppm1      1.320 ppm2      0.710 CV     1
 ASSI { 2688}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB3 ))
      2.700     0.900     0.900 peak  2688 spectrum    1 weight  0.10000E+01 volume  0.14522E-02 ppm1      4.977 ppm2      1.640 CV     1
 ASSI { 2689}
   (( segid "    " and resid 6    and name HA  ))
   (  segid "    " and resid 79   and name HE% )
      4.900     3.000     1.100 peak  2689 spectrum    1 weight  0.10000E+01 volume  0.10020E-02 ppm1      4.980 ppm2      1.474 CV     1
 ASSI { 2690}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB2 ))
      3.400     1.400     1.400 peak  2690 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      4.976 ppm2      1.318 CV     1
 ASSI { 2691}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 4    and name HB2 ))
      2.700     0.900     0.900 peak  2691 spectrum    1 weight  0.10000E+01 volume  0.91736E-02 ppm1      0.883 ppm2      1.553 CV     1
 ASSI { 2694}
   (  segid "    " and resid 6    and name HD2%)
   (  segid "    " and resid 6    and name HD1%)
      2.000     0.500     0.500 peak  2694 spectrum    1 weight  0.10000E+01 volume  0.20504E-01 ppm1      0.883 ppm2      0.707 CV     1
 ASSI { 2695}
   (  segid "    " and resid 6    and name HD1%)
   (  segid "    " and resid 68   and name HD1%)
      2.500     0.800     0.800 peak  2695 spectrum    1 weight  0.10000E+01 volume  0.52741E-02 ppm1      0.709 ppm2      0.312 CV     1
 ASSI { 2697}
   (( segid "    " and resid 5    and name HB2 ))
   (  segid "    " and resid 16   and name HG2%)
      3.600     1.600     1.600 peak  2697 spectrum    1 weight  0.10000E+01 volume  0.23730E-02 ppm1      3.554 ppm2      0.929 CV     1
 ASSI { 2699}
   (( segid "    " and resid 5    and name HA  ))
   (  segid "    " and resid 3    and name HB% )
      5.300     3.500     0.700 peak  2699 spectrum    1 weight  0.10000E+01 volume  0.58223E-03 ppm1      4.900 ppm2      1.114 CV     1
 ASSI { 2700}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 18   and name HB3 ))
      5.200     3.400     0.800 peak  2700 spectrum    1 weight  0.10000E+01 volume  0.83611E-03 ppm1      3.602 ppm2      1.467 CV     1
 ASSI { 2703}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 18   and name HG3 ))
      3.400     1.500     1.500 peak  2703 spectrum    1 weight  0.10000E+01 volume  0.18178E-02 ppm1      3.599 ppm2      2.027 CV     1
 OR { 2703}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 2704}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 18   and name HG3 ))
      4.200     2.200     1.800 peak  2704 spectrum    1 weight  0.10000E+01 volume  0.15165E-02 ppm1      3.551 ppm2      2.026 CV     1
 OR { 2704}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 2705}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 18   and name HG3 ))
      2.600     0.800     0.800 peak  2705 spectrum    1 weight  0.10000E+01 volume  0.19363E-02 ppm1      4.898 ppm2      2.023 CV     1
 OR { 2705}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 18   and name HG2 ))
 ASSI { 2706}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 75   and name HB3 ))
      4.400     2.400     1.600 peak  2706 spectrum    1 weight  0.10000E+01 volume  0.91736E-03 ppm1      3.598 ppm2      2.692 CV     1
 ASSI { 2709}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HA  ))
      2.500     0.800     0.800 peak  2709 spectrum    1 weight  0.10000E+01 volume  0.30162E-02 ppm1      3.598 ppm2      4.889 CV     1
 ASSI { 2710}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HA  ))
      2.900     1.100     1.100 peak  2710 spectrum    1 weight  0.10000E+01 volume  0.29586E-02 ppm1      3.553 ppm2      4.890 CV     1
 ASSI { 2711}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 75   and name HA  ))
      3.700     1.700     1.700 peak  2711 spectrum    1 weight  0.10000E+01 volume  0.23256E-02 ppm1      3.597 ppm2      4.711 CV     1
 ASSI { 2712}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
      2.700     0.900     0.900 peak  2712 spectrum    1 weight  0.10000E+01 volume  0.22409E-02 ppm1      3.550 ppm2      4.710 CV     1
 ASSI { 2715}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 18   and name HA  ))
      4.900     2.900     1.100 peak  2715 spectrum    1 weight  0.10000E+01 volume  0.74473E-03 ppm1      3.596 ppm2      5.266 CV     1
 ASSI { 2716}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 75   and name HD22))
      4.700     2.800     1.300 peak  2716 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      3.595 ppm2      7.076 CV     1
 ASSI { 2718}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 6    and name H   ))
      4.100     2.100     1.900 peak  2718 spectrum    1 weight  0.10000E+01 volume  0.14184E-02 ppm1      3.552 ppm2      8.894 CV     1
 ASSI { 2719}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 6    and name H   ))
      3.900     1.900     1.900 peak  2719 spectrum    1 weight  0.10000E+01 volume  0.14725E-02 ppm1      3.592 ppm2      8.887 CV     1
 ASSI { 2720}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name H   ))
      3.000     1.100     1.100 peak  2720 spectrum    1 weight  0.10000E+01 volume  0.35036E-02 ppm1      3.597 ppm2      8.654 CV     1
 ASSI { 2721}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name H   ))
      2.500     0.800     0.800 peak  2721 spectrum    1 weight  0.10000E+01 volume  0.33139E-02 ppm1      3.553 ppm2      8.656 CV     1
 ASSI { 2722}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 76   and name H   ))
      4.500     2.600     1.500 peak  2722 spectrum    1 weight  0.10000E+01 volume  0.86319E-03 ppm1      3.594 ppm2      9.302 CV     1
 ASSI { 2723}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 76   and name H   ))
      3.800     1.800     1.800 peak  2723 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      3.549 ppm2      9.307 CV     1
 ASSI { 2725}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 192  and name H   ))
      3.500     1.600     1.600 peak  2725 spectrum    1 weight  0.10000E+01 volume  0.40587E-02 ppm1      0.718 ppm2      9.090 CV     1
 ASSI { 2726}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 74   and name H   ))
      3.600     1.600     1.600 peak  2726 spectrum    1 weight  0.10000E+01 volume  0.27792E-02 ppm1      0.716 ppm2      8.915 CV     1
 ASSI { 2727}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 4    and name H   ))
      3.000     1.100     1.100 peak  2727 spectrum    1 weight  0.10000E+01 volume  0.37845E-02 ppm1      0.712 ppm2      8.732 CV     1
 ASSI { 2728}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 93   and name H   ))
      3.600     1.700     1.700 peak  2728 spectrum    1 weight  0.10000E+01 volume  0.12186E-02 ppm1      0.713 ppm2      8.485 CV     1
 ASSI { 2729}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 75   and name H   ))
      2.900     2.900     3.100 peak  2729 spectrum    1 weight  0.10000E+01 volume  0.51454E-02 ppm1      0.713 ppm2      8.363 CV     1
 ASSI { 2730}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 69   and name H   ))
      3.900     1.900     1.900 peak  2730 spectrum    1 weight  0.10000E+01 volume  0.16249E-02 ppm1      0.709 ppm2      8.085 CV     1
 ASSI { 2731}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 75   and name HD21))
      3.700     1.700     1.700 peak  2731 spectrum    1 weight  0.10000E+01 volume  0.11475E-02 ppm1      0.716 ppm2      7.544 CV     1
 ASSI { 2732}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 74   and name HE  ))
      4.300     2.400     1.700 peak  2732 spectrum    1 weight  0.10000E+01 volume  0.93429E-03 ppm1      0.716 ppm2      7.398 CV     1
 ASSI { 2733}
   (  segid "    " and resid 193  and name HD2%)
   (  segid "    " and resid 127  and name HD% )
      2.600     0.900     0.900 peak  2733 spectrum    1 weight  0.10000E+01 volume  0.36829E-02 ppm1      0.737 ppm2      6.864 CV     1
 ASSI { 2734}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 73   and name H   ))
      3.400     3.400     2.600 peak  2734 spectrum    1 weight  0.10000E+01 volume  0.24847E-02 ppm1      0.714 ppm2      6.783 CV     1
 ASSI { 2735}
   (  segid "    " and resid 193  and name HD2%)
   (  segid "    " and resid 127  and name HE% )
      3.100     1.200     1.200 peak  2735 spectrum    1 weight  0.10000E+01 volume  0.19058E-02 ppm1      0.733 ppm2      6.640 CV     1
 ASSI { 2736}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HA  ))
      3.000     1.200     1.200 peak  2736 spectrum    1 weight  0.10000E+01 volume  0.14996E-02 ppm1      1.585 ppm2      4.718 CV     1
 ASSI { 2737}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HA  ))
      2.600     0.900     0.900 peak  2737 spectrum    1 weight  0.10000E+01 volume  0.14488E-02 ppm1      1.294 ppm2      4.718 CV     1
 ASSI { 2738}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 74   and name HA  ))
      2.300     0.700     0.700 peak  2738 spectrum    1 weight  0.10000E+01 volume  0.60391E-02 ppm1      0.713 ppm2      4.448 CV     1
 ASSI { 2739}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 3    and name HA  ))
      3.500     1.500     1.500 peak  2739 spectrum    1 weight  0.10000E+01 volume  0.25117E-02 ppm1      0.715 ppm2      4.286 CV     1
 ASSI { 2740}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 21   and name HA  ))
      2.400     0.700     0.700 peak  2740 spectrum    1 weight  0.10000E+01 volume  0.93158E-02 ppm1      0.715 ppm2      4.105 CV     1
 ASSI { 2741}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 3    and name HA  ))
      4.100     2.100     1.900 peak  2741 spectrum    1 weight  0.10000E+01 volume  0.76843E-03 ppm1      1.581 ppm2      4.276 CV     1
 ASSI { 2742}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 21   and name HD3 ))
      3.100     1.200     1.200 peak  2742 spectrum    1 weight  0.10000E+01 volume  0.16858E-02 ppm1      0.709 ppm2      3.813 CV     1
 ASSI { 2743}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 195  and name HA  ))
      3.600     1.600     1.600 peak  2743 spectrum    1 weight  0.10000E+01 volume  0.20175E-02 ppm1      0.716 ppm2      3.573 CV     1
 ASSI { 2745}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 69   and name HB3 ))
      4.300     2.300     1.700 peak  2745 spectrum    1 weight  0.10000E+01 volume  0.14251E-02 ppm1      0.719 ppm2      2.452 CV     1
 ASSI { 2746}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 21   and name HB3 ))
      2.700     0.900     0.900 peak  2746 spectrum    1 weight  0.10000E+01 volume  0.35679E-02 ppm1      0.711 ppm2      2.334 CV     1
 OR { 2746}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 21   and name HB3 ))
 ASSI { 2747}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 132  and name HG3 ))
      2.300     0.700     0.700 peak  2747 spectrum    1 weight  0.10000E+01 volume  0.71087E-02 ppm1      0.715 ppm2      2.128 CV     1
 ASSI { 2748}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 132  and name HG2 ))
      2.900     1.100     1.100 peak  2748 spectrum    1 weight  0.10000E+01 volume  0.62489E-02 ppm1      0.716 ppm2      2.001 CV     1
 ASSI { 2749}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 132  and name HB2 ))
      2.700     0.900     0.900 peak  2749 spectrum    1 weight  0.10000E+01 volume  0.80836E-02 ppm1      0.714 ppm2      1.937 CV     1
 ASSI { 2750}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 74   and name HB3 ))
      2.400     0.700     0.700 peak  2750 spectrum    1 weight  0.10000E+01 volume  0.12545E-01 ppm1      0.718 ppm2      1.633 CV     1
 OR { 2750}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 74   and name HB3 ))
 ASSI { 2752}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 4    and name HG  ))
      1.900     0.400     0.400 peak  2752 spectrum    1 weight  0.10000E+01 volume  0.24004E-01 ppm1      0.713 ppm2      1.476 CV     1
 OR { 2752}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 4    and name HG  ))
 ASSI { 2754}
   (  segid "    " and resid 4    and name HD2%)
   (  segid "    " and resid 3    and name HB% )
      3.300     3.300     2.700 peak  2754 spectrum    1 weight  0.10000E+01 volume  0.64249E-02 ppm1      0.711 ppm2      1.110 CV     1
 ASSI { 2756}
   (( segid "    " and resid 4    and name HB2 ))
   (  segid "    " and resid 3    and name HB% )
      4.000     2.000     2.000 peak  2756 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      1.576 ppm2      1.101 CV     1
 ASSI { 2757}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 68   and name HB3 ))
      4.100     2.100     1.900 peak  2757 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      1.286 ppm2      1.104 CV     1
 ASSI { 2758}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HG  ))
      2.700     0.900     0.900 peak  2758 spectrum    1 weight  0.10000E+01 volume  0.27216E-02 ppm1      1.580 ppm2      1.484 CV     1
 ASSI { 2759}
   (  segid "    " and resid 193  and name HD2%)
   (  segid "    " and resid 121  and name HD1%)
      2.400     0.700     0.700 peak  2759 spectrum    1 weight  0.10000E+01 volume  0.69495E-02 ppm1      0.709 ppm2      0.310 CV     1
 ASSI { 2762}
   (( segid "    " and resid 3    and name HA  ))
   (  segid "    " and resid 4    and name HD1%)
      3.800     1.800     1.800 peak  2762 spectrum    1 weight  0.10000E+01 volume  0.13811E-02 ppm1      4.286 ppm2      0.701 CV     1
 ASSI { 2764}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 20   and name HB3 ))
      4.500     2.600     1.500 peak  2764 spectrum    1 weight  0.10000E+01 volume  0.10832E-02 ppm1      4.286 ppm2      2.139 CV     1
 ASSI { 2765}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 20   and name HG2 ))
      4.200     2.200     1.800 peak  2765 spectrum    1 weight  0.10000E+01 volume  0.10020E-02 ppm1      4.294 ppm2      2.346 CV     1
 ASSI { 2766}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 2    and name HB  ))
      4.300     2.400     1.700 peak  2766 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      4.291 ppm2      2.052 CV     1
 ASSI { 2767}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 21   and name HG3 ))
      4.500     2.500     1.500 peak  2767 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      4.282 ppm2      1.944 CV     1
 ASSI { 2769}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 21   and name HD2 ))
      3.200     1.300     1.300 peak  2769 spectrum    1 weight  0.10000E+01 volume  0.20446E-02 ppm1      4.278 ppm2      3.868 CV     1
 ASSI { 2770}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 21   and name HD3 ))
      2.400     0.700     0.700 peak  2770 spectrum    1 weight  0.10000E+01 volume  0.20277E-02 ppm1      4.281 ppm2      3.819 CV     1
 ASSI { 2772}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 20   and name HA  ))
      2.500     0.800     0.800 peak  2772 spectrum    1 weight  0.10000E+01 volume  0.19194E-02 ppm1      4.282 ppm2      4.660 CV     1
 ASSI { 2774}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 4    and name H   ))
      2.200     0.600     0.600 peak  2774 spectrum    1 weight  0.10000E+01 volume  0.51656E-02 ppm1      4.282 ppm2      8.730 CV     1
 ASSI { 2775}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 4    and name H   ))
      4.700     2.800     1.300 peak  2775 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      0.868 ppm2      8.723 CV     1
 ASSI { 2776}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 2    and name H   ))
      2.900     1.000     1.000 peak  2776 spectrum    1 weight  0.10000E+01 volume  0.55618E-02 ppm1      0.870 ppm2      7.975 CV     1
 ASSI { 2777}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 3    and name H   ))
      3.700     1.700     1.700 peak  2777 spectrum    1 weight  0.10000E+01 volume  0.51351E-02 ppm1      0.869 ppm2      7.853 CV     1
 ASSI { 2778}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 1    and name H   ))
      3.900     1.900     1.900 peak  2778 spectrum    1 weight  0.10000E+01 volume  0.12694E-02 ppm1      0.865 ppm2      8.149 CV     1
 ASSI { 2779}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 0    and name H   ))
      3.600     1.600     1.600 peak  2779 spectrum    1 weight  0.10000E+01 volume  0.90382E-03 ppm1      0.864 ppm2      8.063 CV     1
 ASSI { 2780}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 2    and name H   ))
      2.200     0.600     0.600 peak  2780 spectrum    1 weight  0.10000E+01 volume  0.14806E-01 ppm1      0.864 ppm2      7.976 CV     1
 ASSI { 2785}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 3    and name H   ))
      2.000     0.500     0.500 peak  2785 spectrum    1 weight  0.10000E+01 volume  0.20591E-01 ppm1      4.112 ppm2      7.852 CV     1
 ASSI { 2786}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 20   and name HA  ))
      3.800     1.800     1.800 peak  2786 spectrum    1 weight  0.10000E+01 volume  0.13540E-02 ppm1      0.862 ppm2      4.675 CV     1
 ASSI { 2788}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 1    and name HA  ))
      4.000     2.000     2.000 peak  2788 spectrum    1 weight  0.10000E+01 volume  0.25084E-02 ppm1      0.862 ppm2      4.395 CV     1
 ASSI { 2789}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 3    and name HA  ))
      3.700     1.800     1.800 peak  2789 spectrum    1 weight  0.10000E+01 volume  0.13980E-02 ppm1      0.863 ppm2      4.275 CV     1
 ASSI { 2790}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 2    and name HA  ))
      2.700     0.900     0.900 peak  2790 spectrum    1 weight  0.10000E+01 volume  0.12599E-01 ppm1      0.863 ppm2      4.112 CV     1
 ASSI { 2791}
   (( segid "    " and resid 2    and name HB  ))
   (( segid "    " and resid 2    and name HA  ))
      2.200     0.600     0.600 peak  2791 spectrum    1 weight  0.10000E+01 volume  0.98675E-02 ppm1      2.063 ppm2      4.110 CV     1
 ASSI { 2792}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 3    and name HA  ))
      4.000     2.000     2.000 peak  2792 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      4.117 ppm2      4.271 CV     1
 ASSI { 2793}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 1    and name HA  ))
      3.900     1.900     1.900 peak  2793 spectrum    1 weight  0.10000E+01 volume  0.10663E-02 ppm1      4.113 ppm2      4.400 CV     1
 ASSI { 2794}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 1    and name HA  ))
      3.900     1.900     1.900 peak  2794 spectrum    1 weight  0.10000E+01 volume  0.13371E-02 ppm1      0.866 ppm2      4.394 CV     1
 ASSI { 2795}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 3    and name HA  ))
      4.600     2.600     1.400 peak  2795 spectrum    1 weight  0.10000E+01 volume  0.14014E-02 ppm1      0.869 ppm2      4.281 CV     1
 ASSI { 2796}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 2    and name HA  ))
      2.200     0.600     0.600 peak  2796 spectrum    1 weight  0.10000E+01 volume  0.15497E-01 ppm1      0.869 ppm2      4.110 CV     1
 ASSI { 2797}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 21   and name HD2 ))
      3.100     1.200     1.200 peak  2797 spectrum    1 weight  0.10000E+01 volume  0.23831E-02 ppm1      0.863 ppm2      3.872 CV     1
 ASSI { 2798}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 21   and name HD3 ))
      3.600     1.600     1.600 peak  2798 spectrum    1 weight  0.10000E+01 volume  0.23459E-02 ppm1      0.863 ppm2      3.818 CV     1
 ASSI { 2799}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 21   and name HD3 ))
      4.200     2.200     1.800 peak  2799 spectrum    1 weight  0.10000E+01 volume  0.18483E-02 ppm1      0.872 ppm2      3.814 CV     1
 ASSI { 2800}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 21   and name HB3 ))
      4.600     2.600     1.400 peak  2800 spectrum    1 weight  0.10000E+01 volume  0.18280E-02 ppm1      0.865 ppm2      2.346 CV     1
 ASSI { 2801}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 21   and name HG2 ))
      3.600     1.600     1.600 peak  2801 spectrum    1 weight  0.10000E+01 volume  0.36594E-02 ppm1      0.864 ppm2      2.147 CV     1
 ASSI { 2802}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 2    and name HB  ))
      1.900     0.500     0.500 peak  2802 spectrum    1 weight  0.10000E+01 volume  0.25090E-01 ppm1      0.864 ppm2      2.062 CV     1
 ASSI { 2803}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 21   and name HG3 ))
      3.700     1.700     1.700 peak  2803 spectrum    1 weight  0.10000E+01 volume  0.29113E-02 ppm1      0.865 ppm2      1.947 CV     1
 ASSI { 2804}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 1    and name HG3 ))
      3.300     1.300     1.300 peak  2804 spectrum    1 weight  0.10000E+01 volume  0.16147E-02 ppm1      0.873 ppm2      2.528 CV     1
 ASSI { 2805}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 21   and name HB3 ))
      4.400     2.500     1.600 peak  2805 spectrum    1 weight  0.10000E+01 volume  0.15402E-02 ppm1      0.872 ppm2      2.348 CV     1
 ASSI { 2806}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 21   and name HG2 ))
      3.700     1.700     1.700 peak  2806 spectrum    1 weight  0.10000E+01 volume  0.29722E-02 ppm1      0.869 ppm2      2.148 CV     1
 ASSI { 2807}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 2    and name HB  ))
      2.000     0.500     0.500 peak  2807 spectrum    1 weight  0.10000E+01 volume  0.24982E-01 ppm1      0.869 ppm2      2.061 CV     1
 ASSI { 2808}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 21   and name HG3 ))
      3.300     1.400     1.400 peak  2808 spectrum    1 weight  0.10000E+01 volume  0.31449E-02 ppm1      0.869 ppm2      1.953 CV     1
 ASSI { 2810}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 21   and name HG3 ))
      3.100     1.200     1.200 peak  2810 spectrum    1 weight  0.10000E+01 volume  0.84627E-03 ppm1      4.107 ppm2      1.952 CV     1
 ASSI { 2813}
   (( segid "    " and resid 2    and name HB  ))
   (  segid "    " and resid 2    and name HG2%)
      1.900     0.500     0.500 peak  2813 spectrum    1 weight  0.10000E+01 volume  0.30149E-01 ppm1      2.063 ppm2      0.866 CV     1
 OR { 2813}
   (( segid "    " and resid 2    and name HB  ))
   (  segid "    " and resid 2    and name HG1%)
 ASSI { 2814}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 73   and name HD2%)
      3.300     1.400     1.400 peak  2814 spectrum    1 weight  0.10000E+01 volume  0.45394E-02 ppm1      4.399 ppm2      0.863 CV     1
 ASSI { 2817}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 1    and name HG3 ))
      3.100     1.200     1.200 peak  2817 spectrum    1 weight  0.10000E+01 volume  0.37811E-02 ppm1      4.402 ppm2      2.511 CV     1
 OR { 2817}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 1    and name HG2 ))
 ASSI { 2818}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB3 ))
      2.900     1.000     1.000 peak  2818 spectrum    1 weight  0.10000E+01 volume  0.60492E-02 ppm1      4.398 ppm2      2.461 CV     1
 ASSI { 2820}
   (( segid "    " and resid 1    and name HB3 ))
   (( segid "    " and resid 1    and name HG3 ))
      2.500     0.800     0.800 peak  2820 spectrum    1 weight  0.10000E+01 volume  0.49896E-02 ppm1      1.963 ppm2      2.533 CV     1
 ASSI { 2821}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name HG3 ))
      3.000     1.200     1.200 peak  2821 spectrum    1 weight  0.10000E+01 volume  0.34224E-02 ppm1      1.916 ppm2      2.548 CV     1
 ASSI { 2823}
   (( segid "    " and resid 1    and name HB3 ))
   (( segid "    " and resid 1    and name HG2 ))
      2.700     0.900     0.900 peak  2823 spectrum    1 weight  0.10000E+01 volume  0.40349E-02 ppm1      1.964 ppm2      2.463 CV     1
 ASSI { 2825}
   (( segid "    " and resid 1    and name HB3 ))
   (( segid "    " and resid 1    and name HA  ))
      2.900     1.000     1.000 peak  2825 spectrum    1 weight  0.10000E+01 volume  0.52503E-02 ppm1      1.963 ppm2      4.399 CV     1
 ASSI { 2827}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 2    and name H   ))
      2.000     0.500     0.500 peak  2827 spectrum    1 weight  0.10000E+01 volume  0.20426E-01 ppm1      4.400 ppm2      7.976 CV     1
 ASSI { 2830}
   (( segid "    " and resid 0    and name HB  ))
   (( segid "    " and resid 1    and name H   ))
      1.900     0.400     0.400 peak  2830 spectrum    1 weight  0.10000E+01 volume  0.63505E-02 ppm1      4.138 ppm2      8.150 CV     1
 ASSI { 2832}
   (( segid "    " and resid 0    and name HB  ))
   (( segid "    " and resid 2    and name H   ))
      3.900     1.900     1.900 peak  2832 spectrum    1 weight  0.10000E+01 volume  0.17061E-02 ppm1      4.139 ppm2      7.979 CV     1
 ASSI { 2833}
   (( segid "    " and resid 0    and name HA  ))
   (( segid "    " and resid 1    and name H   ))
      2.400     0.700     0.700 peak  2833 spectrum    1 weight  0.10000E+01 volume  0.15886E-01 ppm1      4.201 ppm2      8.152 CV     1
 ASSI { 2835}
   (( segid "    " and resid 0    and name HA  ))
   (  segid "    " and resid -1   and name HD% )
      4.400     2.400     1.600 peak  2835 spectrum    1 weight  0.10000E+01 volume  0.68379E-03 ppm1      4.198 ppm2      7.213 CV     1
 ASSI { 2836}
   (( segid "    " and resid 0    and name HA  ))
   (( segid "    " and resid 1    and name HB2 ))
      4.400     2.400     1.600 peak  2836 spectrum    1 weight  0.10000E+01 volume  0.11272E-02 ppm1      4.202 ppm2      2.032 CV     1
 ASSI { 2837}
   (( segid "    " and resid 0    and name HA  ))
   (( segid "    " and resid 1    and name HB3 ))
      4.900     3.000     1.100 peak  2837 spectrum    1 weight  0.10000E+01 volume  0.11848E-02 ppm1      4.201 ppm2      1.957 CV     1
 ASSI { 2838}
   (( segid "    " and resid 0    and name HB  ))
   (( segid "    " and resid 1    and name HB2 ))
      4.900     3.000     1.100 peak  2838 spectrum    1 weight  0.10000E+01 volume  0.72780E-03 ppm1      4.138 ppm2      2.047 CV     1
 ASSI { 2841}
   (( segid "    " and resid 0    and name HB  ))
   (  segid "    " and resid 2    and name HG2%)
      3.800     1.800     1.800 peak  2841 spectrum    1 weight  0.10000E+01 volume  0.18517E-02 ppm1      4.138 ppm2      0.864 CV     1
 OR { 2841}
   (( segid "    " and resid 0    and name HB  ))
   (  segid "    " and resid 2    and name HG1%)
 ASSI { 2842}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 135  and name HA  ))
      4.200     2.200     1.800 peak  2842 spectrum    1 weight  0.10000E+01 volume  0.93090E-03 ppm1      1.564 ppm2      4.127 CV     1
 ASSI { 2843}
   (( segid "    " and resid 197  and name HA  ))
   (  segid "    " and resid 197  and name HE% )
      4.300     2.300     1.700 peak  2843 spectrum    1 weight  0.10000E+01 volume  0.15098E-02 ppm1      4.467 ppm2      7.110 CV     1
 ASSI { 2844}
   (( segid "    " and resid 197  and name HA  ))
   (  segid "    " and resid 197  and name HD% )
      2.300     0.700     0.700 peak  2844 spectrum    1 weight  0.10000E+01 volume  0.51454E-02 ppm1      4.469 ppm2      7.003 CV     1
 ASSI { 2845}
   (( segid "    " and resid 197  and name HA  ))
   (( segid "    " and resid 197  and name H   ))
      2.700     0.900     0.900 peak  2845 spectrum    1 weight  0.10000E+01 volume  0.31855E-02 ppm1      4.471 ppm2      7.546 CV     1
 ASSI { 2847}
   (( segid "    " and resid 197  and name HA  ))
   (( segid "    " and resid 198  and name H   ))
      2.200     0.600     0.600 peak  2847 spectrum    1 weight  0.10000E+01 volume  0.76166E-02 ppm1      4.469 ppm2      8.154 CV     1
 ASSI { 2848}
   (( segid "    " and resid 197  and name HB3 ))
   (( segid "    " and resid 126  and name HA  ))
      4.500     2.500     1.500 peak  2848 spectrum    1 weight  0.10000E+01 volume  0.17027E-02 ppm1      2.670 ppm2      4.141 CV     1
 ASSI { 2849}
   (( segid "    " and resid -3   and name HB2 ))
   (( segid "    " and resid -2   and name HD3 ))
      4.400     2.400     1.600 peak  2849 spectrum    1 weight  0.10000E+01 volume  0.15064E-02 ppm1      2.479 ppm2      3.791 CV     1
 ASSI { 2850}
   (( segid "    " and resid -3   and name HB2 ))
   (( segid "    " and resid -2   and name HD2 ))
      3.700     1.700     1.700 peak  2850 spectrum    1 weight  0.10000E+01 volume  0.17264E-02 ppm1      2.472 ppm2      3.676 CV     1
 ASSI { 2851}
   (( segid "    " and resid -3   and name HB3 ))
   (( segid "    " and resid -2   and name HD3 ))
      4.000     2.000     2.000 peak  2851 spectrum    1 weight  0.10000E+01 volume  0.16756E-02 ppm1      2.674 ppm2      3.795 CV     1
 ASSI { 2852}
   (( segid "    " and resid -3   and name HB3 ))
   (( segid "    " and resid -2   and name HD2 ))
      2.900     1.000     1.000 peak  2852 spectrum    1 weight  0.10000E+01 volume  0.41569E-02 ppm1      2.670 ppm2      3.676 CV     1
 ASSI { 2853}
   (( segid "    " and resid 197  and name HA  ))
   (( segid "    " and resid 196  and name HA  ))
      3.800     1.800     1.800 peak  2853 spectrum    1 weight  0.10000E+01 volume  0.85304E-03 ppm1      4.469 ppm2      3.785 CV     1
 ASSI { 2854}
   (( segid "    " and resid 197  and name HA  ))
   (( segid "    " and resid 197  and name HB3 ))
      2.300     0.700     0.700 peak  2854 spectrum    1 weight  0.10000E+01 volume  0.50777E-02 ppm1      4.469 ppm2      2.683 CV     1
 ASSI { 2855}
   (( segid "    " and resid 197  and name HA  ))
   (( segid "    " and resid 197  and name HB2 ))
      3.100     1.200     1.200 peak  2855 spectrum    1 weight  0.10000E+01 volume  0.29890E-02 ppm1      4.471 ppm2      2.426 CV     1
 ASSI { 2856}
   (( segid "    " and resid -3   and name HB3 ))
   (( segid "    " and resid -3   and name HB2 ))
      1.500     0.300     0.700 peak  2856 spectrum    1 weight  0.10000E+01 volume  0.45151E-01 ppm1      2.678 ppm2      2.477 CV     1
 ASSI { 2858}
   (( segid "    " and resid 197  and name HA  ))
   (( segid "    " and resid 196  and name HG2 ))
      3.400     1.400     1.400 peak  2858 spectrum    1 weight  0.10000E+01 volume  0.69733E-03 ppm1      4.482 ppm2      0.070 CV     1
 ASSI { 2859}
   (( segid "    " and resid 193  and name HA  ))
   (  segid "    " and resid 193  and name HD2%)
      3.100     1.200     1.200 peak  2859 spectrum    1 weight  0.10000E+01 volume  0.50439E-02 ppm1      4.868 ppm2      0.734 CV     1
 ASSI { 2860}
   (( segid "    " and resid 193  and name HA  ))
   (  segid "    " and resid 129  and name HD2%)
      3.000     1.100     1.100 peak  2860 spectrum    1 weight  0.10000E+01 volume  0.16824E-02 ppm1      4.868 ppm2      0.640 CV     1
 ASSI { 2862}
   (( segid "    " and resid 193  and name HB3 ))
   (  segid "    " and resid 90   and name HG2%)
      3.600     1.600     1.600 peak  2862 spectrum    1 weight  0.10000E+01 volume  0.13608E-02 ppm1      1.846 ppm2      0.637 CV     1
 ASSI { 2864}
   (( segid "    " and resid 193  and name HB3 ))
   (( segid "    " and resid 193  and name HB2 ))
      2.500     0.800     0.800 peak  2864 spectrum    1 weight  0.10000E+01 volume  0.11035E-02 ppm1      1.847 ppm2      1.005 CV     1
 ASSI { 2865}
   (( segid "    " and resid 193  and name HB2 ))
   (  segid "    " and resid 193  and name HD2%)
      3.700     1.700     1.700 peak  2865 spectrum    1 weight  0.10000E+01 volume  0.18754E-02 ppm1      0.998 ppm2      0.736 CV     1
 ASSI { 2866}
   (( segid "    " and resid 193  and name HB2 ))
   (  segid "    " and resid 90   and name HG2%)
      2.900     1.100     1.100 peak  2866 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      1.019 ppm2      0.634 CV     1
 ASSI { 2868}
   (  segid "    " and resid 193  and name HD1%)
   (  segid "    " and resid 121  and name HD1%)
      2.400     0.700     0.700 peak  2868 spectrum    1 weight  0.10000E+01 volume  0.71222E-02 ppm1      0.574 ppm2      0.285 CV     1
 ASSI { 2869}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 193  and name HG  ))
      2.300     0.700     0.700 peak  2869 spectrum    1 weight  0.10000E+01 volume  0.72204E-02 ppm1      0.574 ppm2      1.384 CV     1
 ASSI { 2870}
   (  segid "    " and resid 193  and name HD1%)
   (  segid "    " and resid 93   and name HD2%)
      2.700     0.900     0.900 peak  2870 spectrum    1 weight  0.10000E+01 volume  0.70578E-02 ppm1      0.574 ppm2      0.960 CV     1
 OR { 2870}
   (  segid "    " and resid 193  and name HD1%)
   (  segid "    " and resid 93   and name HD1%)
 ASSI { 2871}
   (  segid "    " and resid 193  and name HD1%)
   (  segid "    " and resid 193  and name HD2%)
      2.100     0.500     0.500 peak  2871 spectrum    1 weight  0.10000E+01 volume  0.23039E-01 ppm1      0.574 ppm2      0.736 CV     1
 ASSI { 2872}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 193  and name HB3 ))
      3.000     1.100     1.100 peak  2872 spectrum    1 weight  0.10000E+01 volume  0.50640E-02 ppm1      0.574 ppm2      1.895 CV     1
 ASSI { 2875}
   (( segid "    " and resid 193  and name HA  ))
   (( segid "    " and resid 193  and name HB2 ))
      3.300     1.300     1.300 peak  2875 spectrum    1 weight  0.10000E+01 volume  0.67025E-03 ppm1      4.864 ppm2      1.003 CV     1
 ASSI { 2878}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 47   and name HB2 ))
      2.400     0.700     0.700 peak  2878 spectrum    1 weight  0.10000E+01 volume  0.14319E-02 ppm1      1.852 ppm2      2.554 CV     1
 ASSI { 2881}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 193  and name HA  ))
      3.800     1.800     1.800 peak  2881 spectrum    1 weight  0.10000E+01 volume  0.19701E-02 ppm1      0.573 ppm2      4.862 CV     1
 ASSI { 2882}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 92   and name HA  ))
      3.200     1.300     1.300 peak  2882 spectrum    1 weight  0.10000E+01 volume  0.14217E-02 ppm1      0.571 ppm2      4.575 CV     1
 ASSI { 2884}
   (  segid "    " and resid 193  and name HD1%)
   (  segid "    " and resid 127  and name HD% )
      3.200     1.300     1.300 peak  2884 spectrum    1 weight  0.10000E+01 volume  0.19227E-02 ppm1      0.576 ppm2      6.863 CV     1
 ASSI { 2885}
   (  segid "    " and resid 193  and name HD1%)
   (  segid "    " and resid 127  and name HE% )
      3.600     1.700     1.700 peak  2885 spectrum    1 weight  0.10000E+01 volume  0.11475E-02 ppm1      0.574 ppm2      6.635 CV     1
 ASSI { 2886}
   (( segid "    " and resid 47   and name HB3 ))
   (  segid "    " and resid 47   and name HE% )
      4.800     2.900     1.200 peak  2886 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      1.849 ppm2      7.099 CV     1
 ASSI { 2891}
   (( segid "    " and resid 193  and name HA  ))
   (( segid "    " and resid 194  and name H   ))
      2.600     0.900     0.900 peak  2891 spectrum    1 weight  0.10000E+01 volume  0.25084E-02 ppm1      4.868 ppm2      8.647 CV     1
 ASSI { 2892}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 194  and name H   ))
      4.400     2.400     1.600 peak  2892 spectrum    1 weight  0.10000E+01 volume  0.12829E-02 ppm1      0.574 ppm2      8.643 CV     1
 ASSI { 2893}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 93   and name H   ))
      4.000     2.000     2.000 peak  2893 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      0.575 ppm2      8.500 CV     1
 ASSI { 2894}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 193  and name H   ))
      4.000     2.000     2.000 peak  2894 spectrum    1 weight  0.10000E+01 volume  0.18313E-02 ppm1      0.574 ppm2      7.890 CV     1
 ASSI { 2896}
   (( segid "    " and resid 192  and name HB2 ))
   (( segid "    " and resid 192  and name H   ))
      3.200     1.300     1.300 peak  2896 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      1.394 ppm2      9.090 CV     1
 ASSI { 2897}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 61   and name HA  ))
      4.200     2.200     1.800 peak  2897 spectrum    1 weight  0.10000E+01 volume  0.58223E-03 ppm1      1.561 ppm2      4.881 CV     1
 ASSI { 2898}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HA  ))
      2.600     0.900     0.900 peak  2898 spectrum    1 weight  0.10000E+01 volume  0.39300E-02 ppm1      1.565 ppm2      4.483 CV     1
 ASSI { 2899}
   (( segid "    " and resid 192  and name HB2 ))
   (( segid "    " and resid 192  and name HA  ))
      3.600     1.600     1.600 peak  2899 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      1.402 ppm2      4.707 CV     1
 ASSI { 2900}
   (( segid "    " and resid 192  and name HB2 ))
   (( segid "    " and resid 130  and name HB  ))
      4.300     2.300     1.700 peak  2900 spectrum    1 weight  0.10000E+01 volume  0.12660E-02 ppm1      1.387 ppm2      1.644 CV     1
 ASSI { 2901}
   (( segid "    " and resid 192  and name HB3 ))
   (  segid "    " and resid 192  and name HD1%)
      2.700     0.900     0.900 peak  2901 spectrum    1 weight  0.10000E+01 volume  0.38827E-02 ppm1      1.548 ppm2      0.715 CV     1
 OR { 2901}
   (( segid "    " and resid 192  and name HB3 ))
   (  segid "    " and resid 192  and name HD2%)
 ASSI { 2902}
   (( segid "    " and resid 192  and name HB3 ))
   (  segid "    " and resid 130  and name HG2%)
      5.400     3.600     0.600 peak  2902 spectrum    1 weight  0.10000E+01 volume  0.64316E-03 ppm1      1.549 ppm2      0.491 CV     1
 ASSI { 2903}
   (( segid "    " and resid 192  and name HB3 ))
   (  segid "    " and resid 130  and name HG1%)
      4.700     2.800     1.300 peak  2903 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1      1.534 ppm2      0.230 CV     1
 ASSI { 2904}
   (( segid "    " and resid 192  and name HB2 ))
   (  segid "    " and resid 130  and name HG1%)
      3.100     1.200     1.200 peak  2904 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      1.387 ppm2      0.224 CV     1
 ASSI { 2907}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 170  and name HA  ))
      2.800     1.000     1.000 peak  2907 spectrum    1 weight  0.10000E+01 volume  0.52333E-02 ppm1      1.800 ppm2      4.209 CV     1
 ASSI { 2910}
   (( segid "    " and resid 189  and name HA  ))
   (( segid "    " and resid 189  and name H   ))
      3.000     1.100     1.100 peak  2910 spectrum    1 weight  0.10000E+01 volume  0.17636E-02 ppm1      3.990 ppm2      6.934 CV     1
 ASSI { 2911}
   (( segid "    " and resid 189  and name HB3 ))
   (( segid "    " and resid 189  and name H   ))
      3.500     1.500     1.500 peak  2911 spectrum    1 weight  0.10000E+01 volume  0.15402E-02 ppm1      1.847 ppm2      6.939 CV     1
 ASSI { 2912}
   (( segid "    " and resid 189  and name HB2 ))
   (( segid "    " and resid 189  and name H   ))
      3.000     1.200     1.200 peak  2912 spectrum    1 weight  0.10000E+01 volume  0.14658E-02 ppm1      1.792 ppm2      6.940 CV     1
 ASSI { 2914}
   (( segid "    " and resid 189  and name HB2 ))
   (( segid "    " and resid 190  and name H   ))
      4.100     2.100     1.900 peak  2914 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      1.785 ppm2      8.619 CV     1
 ASSI { 2917}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 175  and name H   ))
      3.100     1.200     1.200 peak  2917 spectrum    1 weight  0.10000E+01 volume  0.22071E-02 ppm1      2.599 ppm2      9.115 CV     1
 OR { 2917}
   (( segid "    " and resid 175  and name HB3 ))
   (( segid "    " and resid 175  and name H   ))
 ASSI { 2918}
   (( segid "    " and resid 175  and name HA  ))
   (( segid "    " and resid 176  and name H   ))
      3.000     1.100     1.100 peak  2918 spectrum    1 weight  0.10000E+01 volume  0.22342E-02 ppm1      4.627 ppm2      9.298 CV     1
 ASSI { 2919}
   (( segid "    " and resid 175  and name HA  ))
   (( segid "    " and resid 175  and name H   ))
      3.100     1.200     1.200 peak  2919 spectrum    1 weight  0.10000E+01 volume  0.19058E-02 ppm1      4.640 ppm2      9.112 CV     1
 ASSI { 2922}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 103  and name HA  ))
      2.700     0.900     0.900 peak  2922 spectrum    1 weight  0.10000E+01 volume  0.20751E-02 ppm1      2.591 ppm2      4.190 CV     1
 ASSI { 2923}
   (( segid "    " and resid 175  and name HA  ))
   (( segid "    " and resid 175  and name HB3 ))
      3.100     1.200     1.200 peak  2923 spectrum    1 weight  0.10000E+01 volume  0.26676E-02 ppm1      4.630 ppm2      2.595 CV     1
 OR { 2923}
   (( segid "    " and resid 175  and name HA  ))
   (( segid "    " and resid 175  and name HB2 ))
 ASSI { 2925}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 80   and name H   ))
      4.100     2.100     1.900 peak  2925 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      3.709 ppm2      9.168 CV     1
 ASSI { 2926}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 128  and name HA  ))
      2.900     1.100     1.100 peak  2926 spectrum    1 weight  0.10000E+01 volume  0.16012E-02 ppm1      3.707 ppm2      4.590 CV     1
 OR { 2926}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name HA  ))
 ASSI { 2927}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 127  and name H   ))
      3.200     1.300     1.300 peak  2927 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      2.811 ppm2      7.824 CV     1
 OR { 2927}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name H   ))
 ASSI { 2928}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 128  and name H   ))
      3.400     1.400     1.400 peak  2928 spectrum    1 weight  0.10000E+01 volume  0.13879E-02 ppm1      2.801 ppm2      8.885 CV     1
 OR { 2928}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 128  and name H   ))
 ASSI { 2929}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 194  and name H   ))
      4.000     2.000     2.000 peak  2929 spectrum    1 weight  0.10000E+01 volume  0.17061E-02 ppm1      2.799 ppm2      8.666 CV     1
 ASSI { 2930}
   (( segid "    " and resid 83   and name HE3 ))
   (( segid "    " and resid 86   and name H   ))
      3.900     1.900     1.900 peak  2930 spectrum    1 weight  0.10000E+01 volume  0.12017E-02 ppm1      2.801 ppm2      9.303 CV     1
 ASSI { 2932}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HA  ))
      2.100     0.600     0.600 peak  2932 spectrum    1 weight  0.10000E+01 volume  0.96070E-02 ppm1      2.802 ppm2      4.702 CV     1
 OR { 2932}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 127  and name HA  ))
 ASSI { 2933}
   (( segid "    " and resid 89   and name HE2 ))
   (( segid "    " and resid 89   and name HB2 ))
      2.700     0.900     0.900 peak  2933 spectrum    1 weight  0.10000E+01 volume  0.50439E-02 ppm1      2.801 ppm2      1.816 CV     1
 OR { 2933}
   (( segid "    " and resid 89   and name HE3 ))
   (( segid "    " and resid 89   and name HB2 ))
 ASSI { 2934}
   (( segid "    " and resid 15   and name HE2 ))
   (( segid "    " and resid 15   and name HD3 ))
      2.300     0.700     0.700 peak  2934 spectrum    1 weight  0.10000E+01 volume  0.65570E-02 ppm1      2.803 ppm2      1.676 CV     1
 OR { 2934}
   (( segid "    " and resid 15   and name HE3 ))
   (( segid "    " and resid 15   and name HD3 ))
 ASSI { 2937}
   (( segid "    " and resid 83   and name HE3 ))
   (( segid "    " and resid 83   and name HG2 ))
      2.000     0.500     0.500 peak  2937 spectrum    1 weight  0.10000E+01 volume  0.12190E-01 ppm1      2.810 ppm2      0.914 CV     1
 ASSI { 2940}
   (( segid "    " and resid 7    and name HE2 ))
   (  segid "    " and resid 14   and name HG2%)
      2.300     0.700     0.700 peak  2940 spectrum    1 weight  0.10000E+01 volume  0.10748E-01 ppm1      2.800 ppm2      0.707 CV     1
 OR { 2940}
   (( segid "    " and resid 7    and name HE3 ))
   (  segid "    " and resid 14   and name HG2%)
 ASSI { 2941}
   (  segid "    " and resid 122  and name HG2%)
   (  segid "    " and resid 121  and name HG2%)
      3.500     1.500     1.500 peak  2941 spectrum    1 weight  0.10000E+01 volume  0.39876E-02 ppm1      1.135 ppm2      0.479 CV     1
 ASSI { 2943}
   (( segid "    " and resid 122  and name HA  ))
   (  segid "    " and resid 122  and name HG2%)
      2.700     0.900     0.900 peak  2943 spectrum    1 weight  0.10000E+01 volume  0.61202E-02 ppm1      4.193 ppm2      1.141 CV     1
 ASSI { 2945}
   (  segid "    " and resid 122  and name HG2%)
   (( segid "    " and resid 122  and name HB  ))
      1.800     0.400     0.400 peak  2945 spectrum    1 weight  0.10000E+01 volume  0.50878E-01 ppm1      1.141 ppm2      4.190 CV     1
 ASSI { 2946}
   (  segid "    " and resid 122  and name HG2%)
   (( segid "    " and resid 123  and name HA  ))
      3.300     1.400     1.400 peak  2946 spectrum    1 weight  0.10000E+01 volume  0.18009E-02 ppm1      1.142 ppm2      4.901 CV     1
 ASSI { 2947}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 122  and name H   ))
      3.300     1.400     1.400 peak  2947 spectrum    1 weight  0.10000E+01 volume  0.14556E-02 ppm1      4.196 ppm2      8.497 CV     1
 ASSI { 2948}
   (( segid "    " and resid 122  and name HB  ))
   (( segid "    " and resid 122  and name H   ))
      3.500     1.600     1.600 peak  2948 spectrum    1 weight  0.10000E+01 volume  0.11475E-02 ppm1      4.190 ppm2      8.497 CV     1
 ASSI { 2949}
   (( segid "    " and resid 122  and name HB  ))
   (( segid "    " and resid 123  and name H   ))
      3.300     1.400     1.400 peak  2949 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      4.191 ppm2      8.699 CV     1
 ASSI { 2950}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name H   ))
      3.700     1.700     1.700 peak  2950 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      4.194 ppm2      8.701 CV     1
 ASSI { 2951}
   (  segid "    " and resid 122  and name HG2%)
   (( segid "    " and resid 123  and name H   ))
      3.300     1.400     1.400 peak  2951 spectrum    1 weight  0.10000E+01 volume  0.24508E-02 ppm1      1.143 ppm2      8.706 CV     1
 ASSI { 2953}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 115  and name HD1%)
      4.000     2.000     2.000 peak  2953 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      4.016 ppm2      0.644 CV     1
 ASSI { 2954}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HG3 ))
      2.900     1.000     1.000 peak  2954 spectrum    1 weight  0.10000E+01 volume  0.17873E-02 ppm1      4.011 ppm2      2.245 CV     1
 ASSI { 2955}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB3 ))
      3.100     1.200     1.200 peak  2955 spectrum    1 weight  0.10000E+01 volume  0.19295E-02 ppm1      4.014 ppm2      2.008 CV     1
 ASSI { 2957}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB2 ))
      2.500     0.800     0.800 peak  2957 spectrum    1 weight  0.10000E+01 volume  0.24204E-02 ppm1      4.010 ppm2      1.723 CV     1
 ASSI { 2958}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HG2 ))
      3.100     1.200     1.200 peak  2958 spectrum    1 weight  0.10000E+01 volume  0.15876E-02 ppm1      4.020 ppm2      2.568 CV     1
 ASSI { 2961}
   (( segid "    " and resid 111  and name HG3 ))
   (  segid "    " and resid 102  and name HG1%)
      2.600     0.900     0.900 peak  2961 spectrum    1 weight  0.10000E+01 volume  0.25625E-02 ppm1      2.238 ppm2      0.734 CV     1
 OR { 2961}
   (( segid "    " and resid 111  and name HG3 ))
   (  segid "    " and resid 102  and name HG2%)
 ASSI { 2962}
   (( segid "    " and resid 111  and name HG3 ))
   (  segid "    " and resid 115  and name HD1%)
      3.700     1.700     1.700 peak  2962 spectrum    1 weight  0.10000E+01 volume  0.14488E-02 ppm1      2.242 ppm2      0.639 CV     1
 ASSI { 2963}
   (( segid "    " and resid 111  and name HG2 ))
   (  segid "    " and resid 115  and name HD1%)
      2.500     0.800     0.800 peak  2963 spectrum    1 weight  0.10000E+01 volume  0.15571E-02 ppm1      2.573 ppm2      0.634 CV     1
 ASSI { 2964}
   (( segid "    " and resid 111  and name HG3 ))
   (( segid "    " and resid 111  and name HB2 ))
      2.500     0.800     0.800 peak  2964 spectrum    1 weight  0.10000E+01 volume  0.21292E-02 ppm1      2.240 ppm2      1.725 CV     1
 ASSI { 2971}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 111  and name H   ))
      3.900     1.900     1.900 peak  2971 spectrum    1 weight  0.10000E+01 volume  0.17704E-02 ppm1      2.572 ppm2      8.407 CV     1
 ASSI { 2972}
   (( segid "    " and resid 81   and name HA  ))
   (  segid "    " and resid 81   and name HD% )
      3.300     1.400     1.400 peak  2972 spectrum    1 weight  0.10000E+01 volume  0.13608E-02 ppm1      5.417 ppm2      6.817 CV     1
 ASSI { 2976}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HA  ))
      3.100     1.200     1.200 peak  2976 spectrum    1 weight  0.10000E+01 volume  0.86658E-03 ppm1      2.441 ppm2      5.404 CV     1
 ASSI { 2982}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HB3 ))
      3.700     1.700     1.700 peak  2982 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      5.419 ppm2      3.117 CV     1
 ASSI { 2983}
   (( segid "    " and resid 81   and name HB3 ))
   (( segid "    " and resid 81   and name HB2 ))
      2.400     0.700     0.700 peak  2983 spectrum    1 weight  0.10000E+01 volume  0.10663E-02 ppm1      3.109 ppm2      2.430 CV     1
 ASSI { 2985}
   (( segid "    " and resid 81   and name HA  ))
   (  segid "    " and resid 49   and name HD2%)
      3.100     1.200     1.200 peak  2985 spectrum    1 weight  0.10000E+01 volume  0.18110E-02 ppm1      5.414 ppm2      0.868 CV     1
 ASSI { 2986}
   (( segid "    " and resid 81   and name HA  ))
   (  segid "    " and resid 8    and name HG2%)
      4.000     2.000     2.000 peak  2986 spectrum    1 weight  0.10000E+01 volume  0.12390E-02 ppm1      5.407 ppm2      0.735 CV     1
 ASSI { 2995}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 61   and name HE3 ))
      3.500     1.500     1.500 peak  2995 spectrum    1 weight  0.10000E+01 volume  0.59577E-03 ppm1      3.163 ppm2      7.533 CV     1
 ASSI { 2996}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 61   and name HB3 ))
      2.600     0.900     0.900 peak  2996 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      3.023 ppm2      3.159 CV     1
 ASSI { 3000}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 78   and name H   ))
      2.400     0.700     0.700 peak  3000 spectrum    1 weight  0.10000E+01 volume  0.71560E-02 ppm1      4.588 ppm2      8.142 CV     1
 ASSI { 3001}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name H   ))
      2.700     0.900     0.900 peak  3001 spectrum    1 weight  0.10000E+01 volume  0.35579E-02 ppm1      4.586 ppm2      8.082 CV     1
 ASSI { 3003}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 74   and name H   ))
      4.800     2.900     1.200 peak  3003 spectrum    1 weight  0.10000E+01 volume  0.80905E-03 ppm1      4.587 ppm2      8.933 CV     1
 ASSI { 3004}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HB2 ))
      3.000     1.100     1.100 peak  3004 spectrum    1 weight  0.10000E+01 volume  0.24407E-02 ppm1      4.587 ppm2      2.801 CV     1
 ASSI { 3005}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HB3 ))
      2.900     1.000     1.000 peak  3005 spectrum    1 weight  0.10000E+01 volume  0.24914E-02 ppm1      4.587 ppm2      2.476 CV     1
 ASSI { 3007}
   (( segid "    " and resid 77   and name HB3 ))
   (  segid "    " and resid 73   and name HD2%)
      4.100     2.100     1.900 peak  3007 spectrum    1 weight  0.10000E+01 volume  0.11103E-02 ppm1      2.479 ppm2      0.806 CV     1
 OR { 3007}
   (( segid "    " and resid 77   and name HB3 ))
   (  segid "    " and resid 73   and name HD1%)
 ASSI { 3008}
   (( segid "    " and resid 77   and name HA  ))
   (  segid "    " and resid 6    and name HD2%)
      3.700     1.700     1.700 peak  3008 spectrum    1 weight  0.10000E+01 volume  0.16350E-02 ppm1      4.580 ppm2      0.874 CV     1
 ASSI { 3009}
   (( segid "    " and resid 79   and name HB3 ))
   (  segid "    " and resid 49   and name HD2%)
      4.700     2.700     1.300 peak  3009 spectrum    1 weight  0.10000E+01 volume  0.13134E-02 ppm1      1.818 ppm2      0.864 CV     1
 ASSI { 3010}
   (( segid "    " and resid 79   and name HB2 ))
   (  segid "    " and resid 49   and name HD2%)
      4.400     2.400     1.600 peak  3010 spectrum    1 weight  0.10000E+01 volume  0.11848E-02 ppm1      1.720 ppm2      0.871 CV     1
 ASSI { 3014}
   (( segid "    " and resid 101  and name HA  ))
   (  segid "    " and resid 102  and name HG2%)
      3.300     1.300     1.300 peak  3014 spectrum    1 weight  0.10000E+01 volume  0.33410E-02 ppm1      4.880 ppm2      0.728 CV     1
 ASSI { 3017}
   (( segid "    " and resid 178  and name HA  ))
   (( segid "    " and resid 178  and name HG2 ))
      3.400     1.500     1.500 peak  3017 spectrum    1 weight  0.10000E+01 volume  0.22003E-02 ppm1      4.877 ppm2      1.617 CV     1
 ASSI { 3023}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 79   and name HB2 ))
      1.900     0.400     0.400 peak  3023 spectrum    1 weight  0.10000E+01 volume  0.41740E-02 ppm1      1.818 ppm2      1.712 CV     1
 ASSI { 3026}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HG3 ))
      2.800     1.000     1.000 peak  3026 spectrum    1 weight  0.10000E+01 volume  0.19634E-02 ppm1      1.718 ppm2      2.143 CV     1
 OR { 3026}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 3027}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 73   and name HD2%)
      1.500     1.500     4.500 peak  3027 spectrum    1 weight  0.10000E+01 volume  0.19623E-01 ppm1      1.472 ppm2      0.860 CV     1
 ASSI { 3028}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 8    and name HD1%)
      1.600     0.300     0.600 peak  3028 spectrum    1 weight  0.10000E+01 volume  0.54982E-01 ppm1      1.473 ppm2      0.722 CV     1
 ASSI { 3029}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 62   and name HD1%)
      2.800     1.000     1.000 peak  3029 spectrum    1 weight  0.10000E+01 volume  0.65536E-02 ppm1      1.473 ppm2      0.397 CV     1
 ASSI { 3030}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 68   and name HD1%)
      2.200     0.600     0.600 peak  3030 spectrum    1 weight  0.10000E+01 volume  0.11723E-01 ppm1      1.472 ppm2      0.302 CV     1
 OR { 3030}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 68   and name HD2%)
 ASSI { 3031}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 32   and name HD1%)
      3.700     1.700     1.700 peak  3031 spectrum    1 weight  0.10000E+01 volume  0.14996E-02 ppm1      1.471 ppm2      0.122 CV     1
 ASSI { 3032}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 62   and name HD2%)
      2.000     2.000     4.000 peak  3032 spectrum    1 weight  0.10000E+01 volume  0.42280E-02 ppm1      1.474 ppm2     -0.163 CV     1
 ASSI { 3036}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 79   and name HB3 ))
      2.000     0.500     0.500 peak  3036 spectrum    1 weight  0.10000E+01 volume  0.89333E-02 ppm1      1.472 ppm2      1.814 CV     1
 ASSI { 3037}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 79   and name HB2 ))
      2.900     1.100     1.100 peak  3037 spectrum    1 weight  0.10000E+01 volume  0.77148E-02 ppm1      1.473 ppm2      1.702 CV     1
 ASSI { 3038}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 79   and name HG2 ))
      2.300     0.600     0.600 peak  3038 spectrum    1 weight  0.10000E+01 volume  0.12247E-01 ppm1      1.472 ppm2      2.144 CV     1
 OR { 3038}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 79   and name HG3 ))
 ASSI { 3040}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB3 ))
      2.900     1.100     1.100 peak  3040 spectrum    1 weight  0.10000E+01 volume  0.19194E-02 ppm1      4.893 ppm2      1.809 CV     1
 ASSI { 3041}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 68   and name HA  ))
      2.300     2.300     3.700 peak  3041 spectrum    1 weight  0.10000E+01 volume  0.15436E-02 ppm1      1.474 ppm2      3.921 CV     1
 ASSI { 3044}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 79   and name HA  ))
      3.700     1.700     1.700 peak  3044 spectrum    1 weight  0.10000E+01 volume  0.33105E-02 ppm1      1.473 ppm2      4.900 CV     1
 ASSI { 3045}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 19   and name HE% )
      2.800     1.000     1.000 peak  3045 spectrum    1 weight  0.10000E+01 volume  0.47358E-02 ppm1      1.472 ppm2      7.118 CV     1
 ASSI { 3046}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 19   and name HZ  ))
      3.200     1.300     1.300 peak  3046 spectrum    1 weight  0.10000E+01 volume  0.19058E-02 ppm1      1.473 ppm2      6.964 CV     1
 ASSI { 3047}
   (( segid "    " and resid 178  and name HA  ))
   (( segid "    " and resid 178  and name H   ))
      3.100     1.200     1.200 peak  3047 spectrum    1 weight  0.10000E+01 volume  0.14387E-02 ppm1      4.882 ppm2      7.018 CV     1
 ASSI { 3048}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 79   and name H   ))
      4.000     2.000     2.000 peak  3048 spectrum    1 weight  0.10000E+01 volume  0.25727E-02 ppm1      1.473 ppm2      9.053 CV     1
 ASSI { 3050}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 79   and name H   ))
      3.200     1.300     1.300 peak  3050 spectrum    1 weight  0.10000E+01 volume  0.11916E-02 ppm1      1.824 ppm2      9.051 CV     1
 ASSI { 3051}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name H   ))
      3.200     1.300     1.300 peak  3051 spectrum    1 weight  0.10000E+01 volume  0.74134E-03 ppm1      1.721 ppm2      9.051 CV     1
 ASSI { 3052}
   (( segid "    " and resid 178  and name HA  ))
   (( segid "    " and resid 179  and name H   ))
      2.800     1.000     1.000 peak  3052 spectrum    1 weight  0.10000E+01 volume  0.19701E-02 ppm1      4.882 ppm2      9.376 CV     1
 ASSI { 3058}
   (( segid "    " and resid 1    and name HG2 ))
   (( segid "    " and resid 1    and name HB2 ))
      2.500     0.800     0.800 peak  3058 spectrum    1 weight  0.10000E+01 volume  0.48508E-02 ppm1      2.466 ppm2      2.034 CV     1
 ASSI { 3062}
   (( segid "    " and resid 101  and name HG3 ))
   (( segid "    " and resid 101  and name HB3 ))
      2.800     1.000     1.000 peak  3062 spectrum    1 weight  0.10000E+01 volume  0.16249E-02 ppm1      2.509 ppm2      1.561 CV     1
 ASSI { 3066}
   (( segid "    " and resid 1    and name HG2 ))
   (  segid "    " and resid 2    and name HG1%)
      3.800     1.800     1.800 peak  3066 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      2.465 ppm2      0.867 CV     1
 OR { 3066}
   (( segid "    " and resid 1    and name HG2 ))
   (  segid "    " and resid 2    and name HG2%)
 ASSI { 3067}
   (( segid "    " and resid 1    and name HG2 ))
   (( segid "    " and resid 1    and name HA  ))
      3.600     1.600     1.600 peak  3067 spectrum    1 weight  0.10000E+01 volume  0.30940E-02 ppm1      2.464 ppm2      4.396 CV     1
 ASSI { 3068}
   (( segid "    " and resid 101  and name HG2 ))
   (( segid "    " and resid 100  and name HA  ))
      3.700     1.800     1.800 peak  3068 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      2.475 ppm2      4.258 CV     1
 ASSI { 3071}
   (( segid "    " and resid 1    and name HG2 ))
   (( segid "    " and resid 1    and name H   ))
      4.300     2.300     1.700 peak  3071 spectrum    1 weight  0.10000E+01 volume  0.20209E-02 ppm1      2.466 ppm2      8.151 CV     1
 ASSI { 3072}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 24   and name H   ))
      3.900     1.900     1.900 peak  3072 spectrum    1 weight  0.10000E+01 volume  0.40892E-02 ppm1      2.023 ppm2      9.138 CV     1
 ASSI { 3073}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 25   and name H   ))
      3.800     1.800     1.800 peak  3073 spectrum    1 weight  0.10000E+01 volume  0.36018E-02 ppm1      2.022 ppm2      9.452 CV     1
 ASSI { 3074}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 24   and name H   ))
      4.400     2.400     1.600 peak  3074 spectrum    1 weight  0.10000E+01 volume  0.19870E-02 ppm1      2.601 ppm2      9.134 CV     1
 ASSI { 3075}
   (( segid "    " and resid 24   and name HG3 ))
   (( segid "    " and resid 25   and name H   ))
      3.600     1.600     1.600 peak  3075 spectrum    1 weight  0.10000E+01 volume  0.85304E-03 ppm1      2.734 ppm2      9.460 CV     1
 ASSI { 3076}
   (( segid "    " and resid 24   and name HG3 ))
   (( segid "    " and resid 24   and name H   ))
      3.600     1.700     1.700 peak  3076 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      2.730 ppm2      9.135 CV     1
 ASSI { 3077}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 26   and name H   ))
      3.600     1.600     1.600 peak  3077 spectrum    1 weight  0.10000E+01 volume  0.65332E-03 ppm1      1.755 ppm2      8.704 CV     1
 OR { 3077}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 26   and name H   ))
 ASSI { 3079}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 66   and name H   ))
      2.700     0.900     0.900 peak  3079 spectrum    1 weight  0.10000E+01 volume  0.56700E-02 ppm1      2.022 ppm2      7.476 CV     1
 ASSI { 3080}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 67   and name H   ))
      2.600     0.900     0.900 peak  3080 spectrum    1 weight  0.10000E+01 volume  0.96476E-02 ppm1      2.023 ppm2      8.144 CV     1
 ASSI { 3081}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 26   and name H   ))
      3.800     1.800     1.800 peak  3081 spectrum    1 weight  0.10000E+01 volume  0.27960E-02 ppm1      2.019 ppm2      8.712 CV     1
 ASSI { 3082}
   (( segid "    " and resid 24   and name HG3 ))
   (  segid "    " and resid 26   and name HD% )
      4.900     3.000     1.100 peak  3082 spectrum    1 weight  0.10000E+01 volume  0.69056E-03 ppm1      2.733 ppm2      7.091 CV     1
 ASSI { 3084}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 27   and name H   ))
      3.500     1.600     1.600 peak  3084 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      1.757 ppm2      6.714 CV     1
 OR { 3084}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 27   and name H   ))
 ASSI { 3085}
   (  segid "    " and resid 24   and name HE% )
   (  segid "    " and resid 26   and name HD% )
      3.000     1.200     1.200 peak  3085 spectrum    1 weight  0.10000E+01 volume  0.56532E-02 ppm1      2.023 ppm2      7.071 CV     1
 ASSI { 3086}
   (  segid "    " and resid 24   and name HE% )
   (  segid "    " and resid 26   and name HE% )
      2.500     0.800     0.800 peak  3086 spectrum    1 weight  0.10000E+01 volume  0.93801E-02 ppm1      2.024 ppm2      6.786 CV     1
 ASSI { 3087}
   (( segid "    " and resid 24   and name HG3 ))
   (( segid "    " and resid 24   and name HA  ))
      2.600     0.800     0.800 peak  3087 spectrum    1 weight  0.10000E+01 volume  0.10731E-02 ppm1      2.727 ppm2      4.706 CV     1
 ASSI { 3088}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 24   and name HA  ))
      3.800     1.800     1.800 peak  3088 spectrum    1 weight  0.10000E+01 volume  0.84627E-03 ppm1      2.598 ppm2      4.703 CV     1
 ASSI { 3089}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 24   and name HA  ))
      3.600     1.600     1.600 peak  3089 spectrum    1 weight  0.10000E+01 volume  0.51656E-02 ppm1      2.020 ppm2      4.712 CV     1
 ASSI { 3090}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 67   and name HA  ))
      3.200     1.300     1.300 peak  3090 spectrum    1 weight  0.10000E+01 volume  0.52604E-02 ppm1      2.022 ppm2      4.865 CV     1
 ASSI { 3091}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 66   and name HA  ))
      2.100     0.600     0.600 peak  3091 spectrum    1 weight  0.10000E+01 volume  0.14058E-01 ppm1      2.023 ppm2      4.379 CV     1
 ASSI { 3093}
   (( segid "    " and resid 24   and name HG3 ))
   (( segid "    " and resid 24   and name HG2 ))
      1.600     0.300     0.600 peak  3093 spectrum    1 weight  0.10000E+01 volume  0.96781E-02 ppm1      2.729 ppm2      2.600 CV     1
 ASSI { 3096}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 24   and name HG2 ))
      2.100     0.500     0.500 peak  3096 spectrum    1 weight  0.10000E+01 volume  0.18534E-01 ppm1      2.017 ppm2      2.594 CV     1
 ASSI { 3097}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 24   and name HG3 ))
      2.100     0.500     0.500 peak  3097 spectrum    1 weight  0.10000E+01 volume  0.15504E-01 ppm1      2.022 ppm2      2.723 CV     1
 ASSI { 3098}
   (( segid "    " and resid 24   and name HG3 ))
   (( segid "    " and resid 24   and name HB2 ))
      2.700     0.900     0.900 peak  3098 spectrum    1 weight  0.10000E+01 volume  0.37507E-02 ppm1      2.729 ppm2      1.725 CV     1
 OR { 3098}
   (( segid "    " and resid 24   and name HG3 ))
   (( segid "    " and resid 24   and name HB3 ))
 ASSI { 3100}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 24   and name HB3 ))
      2.600     0.800     0.800 peak  3100 spectrum    1 weight  0.10000E+01 volume  0.33175E-02 ppm1      2.601 ppm2      1.729 CV     1
 OR { 3100}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 24   and name HB2 ))
 ASSI { 3103}
   (  segid "    " and resid 24   and name HE% )
   (  segid "    " and resid 67   and name HB% )
      2.400     0.700     0.700 peak  3103 spectrum    1 weight  0.10000E+01 volume  0.15747E-01 ppm1      2.021 ppm2      1.380 CV     1
 ASSI { 3104}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 66   and name HD3 ))
      3.400     1.400     1.400 peak  3104 spectrum    1 weight  0.10000E+01 volume  0.49694E-02 ppm1      2.021 ppm2      0.862 CV     1
 ASSI { 3106}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 124  and name H   ))
      2.700     0.900     0.900 peak  3106 spectrum    1 weight  0.10000E+01 volume  0.23019E-02 ppm1      4.906 ppm2      7.688 CV     1
 ASSI { 3108}
   (( segid "    " and resid 123  and name HB3 ))
   (( segid "    " and resid 123  and name HD21))
      3.000     1.100     1.100 peak  3108 spectrum    1 weight  0.10000E+01 volume  0.21495E-02 ppm1      2.701 ppm2      7.696 CV     1
 ASSI { 3112}
   (( segid "    " and resid 191  and name HA  ))
   (( segid "    " and resid 192  and name H   ))
      2.600     0.900     0.900 peak  3112 spectrum    1 weight  0.10000E+01 volume  0.19058E-02 ppm1      4.903 ppm2      9.085 CV     1
 ASSI { 3118}
   (( segid "    " and resid 123  and name HB3 ))
   (( segid "    " and resid 123  and name HB2 ))
      2.000     0.500     0.500 peak  3118 spectrum    1 weight  0.10000E+01 volume  0.64011E-02 ppm1      2.698 ppm2      2.789 CV     1
 ASSI { 3120}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HB2 ))
      2.700     0.900     0.900 peak  3120 spectrum    1 weight  0.10000E+01 volume  0.40892E-02 ppm1      4.903 ppm2      2.788 CV     1
 ASSI { 3121}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HB3 ))
      2.700     0.900     0.900 peak  3121 spectrum    1 weight  0.10000E+01 volume  0.44378E-02 ppm1      4.905 ppm2      2.696 CV     1
 ASSI { 3122}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 122  and name HA  ))
      3.700     1.700     1.700 peak  3122 spectrum    1 weight  0.10000E+01 volume  0.96476E-03 ppm1      4.898 ppm2      4.201 CV     1
 ASSI { 3123}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 124  and name HA  ))
      4.300     2.300     1.700 peak  3123 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      4.905 ppm2      4.377 CV     1
 ASSI { 3126}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 126  and name HG2 ))
      4.000     2.000     2.000 peak  3126 spectrum    1 weight  0.10000E+01 volume  0.60592E-03 ppm1      2.777 ppm2      1.827 CV     1
 ASSI { 3127}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 126  and name HG3 ))
      4.200     2.200     1.800 peak  3127 spectrum    1 weight  0.10000E+01 volume  0.76504E-03 ppm1      2.803 ppm2      2.125 CV     1
 OR { 3127}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 126  and name HB3 ))
 ASSI { 3128}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 126  and name HG3 ))
      4.700     2.800     1.300 peak  3128 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      4.901 ppm2      2.118 CV     1
 ASSI { 3131}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HD22))
      4.600     2.600     1.400 peak  3131 spectrum    1 weight  0.10000E+01 volume  0.80567E-03 ppm1      4.900 ppm2      6.663 CV     1
 ASSI { 3133}
   (( segid "    " and resid -3   and name HA  ))
   (( segid "    " and resid -2   and name HD3 ))
      1.800     0.400     0.400 peak  3133 spectrum    1 weight  0.10000E+01 volume  0.26867E-01 ppm1      4.799 ppm2      3.793 CV     1
 ASSI { 3135}
   (( segid "    " and resid -3   and name HA  ))
   (( segid "    " and resid -3   and name HB3 ))
      2.400     0.700     0.700 peak  3135 spectrum    1 weight  0.10000E+01 volume  0.77486E-02 ppm1      4.798 ppm2      2.668 CV     1
 ASSI { 3136}
   (( segid "    " and resid -3   and name HA  ))
   (( segid "    " and resid -3   and name HB2 ))
      2.600     0.800     0.800 peak  3136 spectrum    1 weight  0.10000E+01 volume  0.78874E-02 ppm1      4.799 ppm2      2.477 CV     1
 ASSI { 3142}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 48   and name H   ))
      3.800     1.800     1.800 peak  3142 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      3.695 ppm2      8.610 CV     1
 ASSI { 3143}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name H   ))
      2.900     1.100     1.100 peak  3143 spectrum    1 weight  0.10000E+01 volume  0.12559E-02 ppm1      3.704 ppm2      8.109 CV     1
 ASSI { 3144}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name H   ))
      2.800     1.000     1.000 peak  3144 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      1.129 ppm2      8.102 CV     1
 ASSI { 3145}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 84   and name H   ))
      3.900     1.900     1.900 peak  3145 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      0.940 ppm2      8.104 CV     1
 ASSI { 3146}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 84   and name H   ))
      4.300     2.300     1.700 peak  3146 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      1.041 ppm2      8.109 CV     1
 OR { 3146}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name H   ))
 ASSI { 3148}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 61   and name HE3 ))
      3.900     1.900     1.900 peak  3148 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      1.044 ppm2      7.497 CV     1
 OR { 3148}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 61   and name HE3 ))
 ASSI { 3149}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 61   and name HE3 ))
      3.300     1.400     1.400 peak  3149 spectrum    1 weight  0.10000E+01 volume  0.83611E-03 ppm1      2.379 ppm2      7.512 CV     1
 ASSI { 3150}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 61   and name HE3 ))
      3.700     1.700     1.700 peak  3150 spectrum    1 weight  0.10000E+01 volume  0.11306E-02 ppm1      2.335 ppm2      7.502 CV     1
 ASSI { 3151}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 48   and name H   ))
      2.700     2.700     3.300 peak  3151 spectrum    1 weight  0.10000E+01 volume  0.61608E-03 ppm1      2.394 ppm2      8.608 CV     1
 ASSI { 3152}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 48   and name H   ))
      4.200     2.200     1.800 peak  3152 spectrum    1 weight  0.10000E+01 volume  0.67025E-03 ppm1      2.331 ppm2      8.602 CV     1
 ASSI { 3153}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 49   and name H   ))
      4.200     2.200     1.800 peak  3153 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      2.385 ppm2      9.079 CV     1
 ASSI { 3154}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 49   and name H   ))
      4.100     2.100     1.900 peak  3154 spectrum    1 weight  0.10000E+01 volume  0.62962E-03 ppm1      2.335 ppm2      9.081 CV     1
 ASSI { 3155}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 48   and name H   ))
      3.700     1.700     1.700 peak  3155 spectrum    1 weight  0.10000E+01 volume  0.61947E-03 ppm1      0.540 ppm2      8.597 CV     1
 ASSI { 3156}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name H   ))
      3.600     1.700     1.700 peak  3156 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      0.533 ppm2      8.107 CV     1
 ASSI { 3157}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 84   and name H   ))
      3.800     1.900     1.900 peak  3157 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      0.030 ppm2      8.110 CV     1
 ASSI { 3158}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 85   and name H   ))
      3.300     1.400     1.400 peak  3158 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      1.131 ppm2      7.133 CV     1
 ASSI { 3159}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 85   and name H   ))
      3.400     1.400     1.400 peak  3159 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      0.940 ppm2      7.122 CV     1
 ASSI { 3160}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 61   and name HZ2 ))
      4.200     2.200     1.800 peak  3160 spectrum    1 weight  0.10000E+01 volume  0.69056E-03 ppm1      1.036 ppm2      7.133 CV     1
 OR { 3160}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 61   and name HZ2 ))
 ASSI { 3161}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 85   and name H   ))
      4.300     2.300     1.700 peak  3161 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      0.542 ppm2      7.136 CV     1
 ASSI { 3162}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 85   and name H   ))
      4.400     2.400     1.600 peak  3162 spectrum    1 weight  0.10000E+01 volume  0.68718E-03 ppm1      0.028 ppm2      7.143 CV     1
 ASSI { 3163}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 82   and name HE  ))
      4.300     2.300     1.700 peak  3163 spectrum    1 weight  0.10000E+01 volume  0.73796E-03 ppm1      3.702 ppm2      6.641 CV     1
 ASSI { 3164}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 61   and name HH2 ))
      2.700     0.900     0.900 peak  3164 spectrum    1 weight  0.10000E+01 volume  0.18990E-02 ppm1      3.695 ppm2      6.489 CV     1
 ASSI { 3165}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 61   and name HZ3 ))
      4.100     2.100     1.900 peak  3165 spectrum    1 weight  0.10000E+01 volume  0.65332E-03 ppm1      1.053 ppm2      6.627 CV     1
 OR { 3165}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 61   and name HZ3 ))
 ASSI { 3166}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 61   and name HH2 ))
      4.500     2.500     1.500 peak  3166 spectrum    1 weight  0.10000E+01 volume  0.54840E-03 ppm1      1.055 ppm2      6.482 CV     1
 OR { 3166}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 61   and name HH2 ))
 ASSI { 3167}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 61   and name HZ3 ))
      4.100     2.100     1.900 peak  3167 spectrum    1 weight  0.10000E+01 volume  0.72780E-03 ppm1      2.389 ppm2      6.625 CV     1
 ASSI { 3168}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 61   and name HZ3 ))
      4.300     2.300     1.700 peak  3168 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      2.331 ppm2      6.624 CV     1
 ASSI { 3169}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 48   and name HA3 ))
      3.600     1.600     1.600 peak  3169 spectrum    1 weight  0.10000E+01 volume  0.13473E-02 ppm1      1.046 ppm2      4.464 CV     1
 OR { 3169}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 48   and name HA3 ))
 ASSI { 3170}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 48   and name HA3 ))
      3.200     1.200     1.200 peak  3170 spectrum    1 weight  0.10000E+01 volume  0.14014E-02 ppm1      2.379 ppm2      4.472 CV     1
 ASSI { 3171}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 48   and name HA2 ))
      3.900     1.900     1.900 peak  3171 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1      2.349 ppm2      3.932 CV     1
 OR { 3171}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 48   and name HA2 ))
 ASSI { 3172}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 48   and name HA2 ))
      4.600     2.600     1.400 peak  3172 spectrum    1 weight  0.10000E+01 volume  0.86319E-03 ppm1      2.389 ppm2      3.927 CV     1
 ASSI { 3173}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 48   and name HA2 ))
      4.900     3.000     1.100 peak  3173 spectrum    1 weight  0.10000E+01 volume  0.88012E-03 ppm1      1.046 ppm2      3.941 CV     1
 OR { 3173}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 48   and name HA2 ))
 ASSI { 3174}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 47   and name HA  ))
      4.500     2.600     1.500 peak  3174 spectrum    1 weight  0.10000E+01 volume  0.65671E-03 ppm1      0.537 ppm2      4.862 CV     1
 ASSI { 3175}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 48   and name HA3 ))
      3.600     1.600     1.600 peak  3175 spectrum    1 weight  0.10000E+01 volume  0.56871E-03 ppm1      0.016 ppm2      4.462 CV     1
 ASSI { 3178}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 105  and name HB2 ))
      3.800     1.800     1.800 peak  3178 spectrum    1 weight  0.10000E+01 volume  0.10426E-02 ppm1      2.373 ppm2      3.699 CV     1
 ASSI { 3183}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 84   and name HE3 ))
      3.400     1.400     1.400 peak  3183 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      0.024 ppm2      2.347 CV     1
 OR { 3183}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 84   and name HE2 ))
 ASSI { 3184}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HE3 ))
      3.600     1.600     1.600 peak  3184 spectrum    1 weight  0.10000E+01 volume  0.78874E-03 ppm1      0.529 ppm2      2.370 CV     1
 OR { 3184}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HE2 ))
 ASSI { 3185}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 84   and name HE2 ))
      2.700     0.900     0.900 peak  3185 spectrum    1 weight  0.10000E+01 volume  0.38049E-02 ppm1      1.047 ppm2      2.374 CV     1
 OR { 3185}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HE3 ))
 OR { 3185}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 84   and name HE3 ))
 OR { 3185}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HE2 ))
 ASSI { 3186}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 84   and name HE3 ))
      4.700     2.700     1.300 peak  3186 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      0.937 ppm2      2.371 CV     1
 OR { 3186}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 84   and name HE2 ))
 ASSI { 3188}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 84   and name HB2 ))
      2.900     1.000     1.000 peak  3188 spectrum    1 weight  0.10000E+01 volume  0.13168E-02 ppm1      0.027 ppm2      1.124 CV     1
 ASSI { 3190}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 84   and name HB3 ))
      3.200     1.300     1.300 peak  3190 spectrum    1 weight  0.10000E+01 volume  0.12085E-02 ppm1      0.030 ppm2      0.931 CV     1
 ASSI { 3191}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HB2 ))
      3.200     1.300     1.300 peak  3191 spectrum    1 weight  0.10000E+01 volume  0.11374E-02 ppm1      0.544 ppm2      1.132 CV     1
 ASSI { 3193}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 84   and name HB2 ))
      4.100     2.100     1.900 peak  3193 spectrum    1 weight  0.10000E+01 volume  0.13744E-02 ppm1      2.366 ppm2      1.124 CV     1
 ASSI { 3194}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 84   and name HD3 ))
      2.500     0.800     0.800 peak  3194 spectrum    1 weight  0.10000E+01 volume  0.45903E-02 ppm1      2.378 ppm2      1.045 CV     1
 OR { 3194}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 84   and name HD2 ))
 ASSI { 3195}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 84   and name HD2 ))
      2.600     0.800     0.800 peak  3195 spectrum    1 weight  0.10000E+01 volume  0.45970E-02 ppm1      2.334 ppm2      1.045 CV     1
 OR { 3195}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 84   and name HD3 ))
 ASSI { 3196}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 84   and name HB3 ))
      4.400     2.500     1.600 peak  3196 spectrum    1 weight  0.10000E+01 volume  0.10257E-02 ppm1      2.368 ppm2      0.955 CV     1
 ASSI { 3197}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 84   and name HB3 ))
      4.200     2.200     1.800 peak  3197 spectrum    1 weight  0.10000E+01 volume  0.13642E-02 ppm1      2.332 ppm2      0.951 CV     1
 ASSI { 3198}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 84   and name HB2 ))
      2.100     0.500     0.500 peak  3198 spectrum    1 weight  0.10000E+01 volume  0.27148E-02 ppm1      0.944 ppm2      1.133 CV     1
 ASSI { 3200}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.000     1.200     1.200 peak  3200 spectrum    1 weight  0.10000E+01 volume  0.18449E-02 ppm1      3.703 ppm2      1.133 CV     1
 ASSI { 3201}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HD3 ))
      3.400     1.400     1.400 peak  3201 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      3.701 ppm2      1.044 CV     1
 OR { 3201}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HD2 ))
 ASSI { 3202}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB3 ))
      3.000     1.100     1.100 peak  3202 spectrum    1 weight  0.10000E+01 volume  0.17298E-02 ppm1      3.700 ppm2      0.936 CV     1
 ASSI { 3203}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HG3 ))
      3.600     1.600     1.600 peak  3203 spectrum    1 weight  0.10000E+01 volume  0.14861E-02 ppm1      3.704 ppm2      0.020 CV     1
 ASSI { 3204}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HG2 ))
      2.900     1.000     1.000 peak  3204 spectrum    1 weight  0.10000E+01 volume  0.14353E-02 ppm1      3.700 ppm2      0.541 CV     1
 ASSI { 3208}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 84   and name HG2 ))
      3.200     1.300     1.300 peak  3208 spectrum    1 weight  0.10000E+01 volume  0.13371E-02 ppm1      0.940 ppm2      0.543 CV     1
 ASSI { 3209}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HG3 ))
      2.900     1.000     1.000 peak  3209 spectrum    1 weight  0.10000E+01 volume  0.23222E-02 ppm1      1.047 ppm2      0.026 CV     1
 OR { 3209}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 84   and name HG3 ))
 ASSI { 3210}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 84   and name HG2 ))
      2.800     1.000     1.000 peak  3210 spectrum    1 weight  0.10000E+01 volume  0.24576E-02 ppm1      1.045 ppm2      0.539 CV     1
 OR { 3210}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HG2 ))
 ASSI { 3211}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 84   and name HG3 ))
      3.400     1.400     1.400 peak  3211 spectrum    1 weight  0.10000E+01 volume  0.15165E-02 ppm1      2.374 ppm2      0.028 CV     1
 ASSI { 3212}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 84   and name HG3 ))
      2.900     1.100     1.100 peak  3212 spectrum    1 weight  0.10000E+01 volume  0.16384E-02 ppm1      2.330 ppm2      0.027 CV     1
 ASSI { 3213}
   (( segid "    " and resid 84   and name HE2 ))
   (( segid "    " and resid 84   and name HG2 ))
      3.300     1.300     1.300 peak  3213 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      2.374 ppm2      0.539 CV     1
 ASSI { 3214}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 84   and name HG2 ))
      3.200     1.300     1.300 peak  3214 spectrum    1 weight  0.10000E+01 volume  0.16384E-02 ppm1      2.332 ppm2      0.542 CV     1
 ASSI { 3215}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HG3 ))
      2.000     0.500     0.500 peak  3215 spectrum    1 weight  0.10000E+01 volume  0.38217E-02 ppm1      0.545 ppm2      0.027 CV     1
 ASSI { 3217}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name H   ))
      3.100     1.200     1.200 peak  3217 spectrum    1 weight  0.10000E+01 volume  0.14556E-02 ppm1      4.625 ppm2      9.013 CV     1
 ASSI { 3221}
   (  segid "    " and resid 88   and name HD1%)
   (( segid "    " and resid 88   and name H   ))
      4.300     2.300     1.700 peak  3221 spectrum    1 weight  0.10000E+01 volume  0.10189E-02 ppm1      0.692 ppm2      9.018 CV     1
 ASSI { 3224}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 89   and name H   ))
      2.900     1.100     1.100 peak  3224 spectrum    1 weight  0.10000E+01 volume  0.67601E-02 ppm1      0.795 ppm2      8.478 CV     1
 ASSI { 3225}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 191  and name H   ))
      2.600     0.800     0.800 peak  3225 spectrum    1 weight  0.10000E+01 volume  0.43872E-02 ppm1      0.751 ppm2      8.428 CV     1
 ASSI { 3227}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 90   and name H   ))
      3.900     1.900     1.900 peak  3227 spectrum    1 weight  0.10000E+01 volume  0.17264E-02 ppm1      0.794 ppm2      8.807 CV     1
 ASSI { 3228}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 71   and name H   ))
      3.900     1.900     1.900 peak  3228 spectrum    1 weight  0.10000E+01 volume  0.14184E-02 ppm1      0.824 ppm2      7.566 CV     1
 ASSI { 3229}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 172  and name HD21))
      3.000     1.200     1.200 peak  3229 spectrum    1 weight  0.10000E+01 volume  0.21089E-02 ppm1      0.793 ppm2      7.387 CV     1
 ASSI { 3230}
   (  segid "    " and resid 73   and name HD1%)
   (  segid "    " and resid 71   and name HD% )
      3.800     1.800     1.800 peak  3230 spectrum    1 weight  0.10000E+01 volume  0.18110E-02 ppm1      0.822 ppm2      7.233 CV     1
 ASSI { 3231}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 172  and name HD22))
      2.800     1.000     1.000 peak  3231 spectrum    1 weight  0.10000E+01 volume  0.22646E-02 ppm1      0.790 ppm2      6.981 CV     1
 ASSI { 3232}
   (  segid "    " and resid 73   and name HD1%)
   (  segid "    " and resid 71   and name HE% )
      2.300     2.300     3.700 peak  3232 spectrum    1 weight  0.10000E+01 volume  0.18076E-02 ppm1      0.788 ppm2      6.841 CV     1
 ASSI { 3233}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name H   ))
      3.400     1.500     1.500 peak  3233 spectrum    1 weight  0.10000E+01 volume  0.52098E-02 ppm1      0.822 ppm2      6.779 CV     1
 ASSI { 3236}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 88   and name HA  ))
      2.500     0.800     0.800 peak  3236 spectrum    1 weight  0.10000E+01 volume  0.82528E-02 ppm1      0.796 ppm2      4.627 CV     1
 ASSI { 3237}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 190  and name HA  ))
      3.400     1.500     1.500 peak  3237 spectrum    1 weight  0.10000E+01 volume  0.16249E-02 ppm1      0.752 ppm2      4.551 CV     1
 ASSI { 3238}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 133  and name HA  ))
      2.900     1.100     1.100 peak  3238 spectrum    1 weight  0.10000E+01 volume  0.17454E-01 ppm1      0.789 ppm2      4.299 CV     1
 ASSI { 3239}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name HA  ))
      3.100     1.200     1.200 peak  3239 spectrum    1 weight  0.10000E+01 volume  0.11404E-01 ppm1      0.821 ppm2      4.216 CV     1
 ASSI { 3242}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 189  and name HA  ))
      2.500     2.500     3.500 peak  3242 spectrum    1 weight  0.10000E+01 volume  0.10731E-02 ppm1      0.748 ppm2      3.984 CV     1
 ASSI { 3243}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 68   and name HA  ))
      3.100     1.200     1.200 peak  3243 spectrum    1 weight  0.10000E+01 volume  0.13134E-02 ppm1      0.822 ppm2      3.923 CV     1
 ASSI { 3245}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB2 ))
      3.200     1.200     1.200 peak  3245 spectrum    1 weight  0.10000E+01 volume  0.12119E-02 ppm1      4.639 ppm2      1.827 CV     1
 ASSI { 3246}
   (  segid "    " and resid 88   and name HD1%)
   (( segid "    " and resid 102  and name HB  ))
      2.900     1.100     1.100 peak  3246 spectrum    1 weight  0.10000E+01 volume  0.29213E-02 ppm1      0.689 ppm2      1.942 CV     1
 ASSI { 3247}
   (  segid "    " and resid 88   and name HD1%)
   (( segid "    " and resid 88   and name HB2 ))
      2.600     0.800     0.800 peak  3247 spectrum    1 weight  0.10000E+01 volume  0.38421E-02 ppm1      0.690 ppm2      1.841 CV     1
 ASSI { 3248}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 135  and name HB3 ))
      3.200     1.300     1.300 peak  3248 spectrum    1 weight  0.10000E+01 volume  0.60897E-02 ppm1      0.790 ppm2      1.979 CV     1
 ASSI { 3249}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 88   and name HB2 ))
      2.800     1.000     1.000 peak  3249 spectrum    1 weight  0.10000E+01 volume  0.75421E-02 ppm1      0.793 ppm2      1.836 CV     1
 ASSI { 3250}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HG  ))
      3.200     1.300     1.300 peak  3250 spectrum    1 weight  0.10000E+01 volume  0.10291E-02 ppm1      1.846 ppm2      1.300 CV     1
 ASSI { 3251}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HB3 ))
      2.300     0.700     0.700 peak  3251 spectrum    1 weight  0.10000E+01 volume  0.14251E-02 ppm1      1.844 ppm2      1.089 CV     1
 ASSI { 3252}
   (( segid "    " and resid 88   and name HB3 ))
   (( segid "    " and resid 88   and name HG  ))
      3.500     1.500     1.500 peak  3252 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      1.084 ppm2      1.294 CV     1
 ASSI { 3253}
   (  segid "    " and resid 88   and name HD1%)
   (( segid "    " and resid 88   and name HG  ))
      2.400     0.700     0.700 peak  3253 spectrum    1 weight  0.10000E+01 volume  0.66653E-02 ppm1      0.689 ppm2      1.290 CV     1
 ASSI { 3254}
   (  segid "    " and resid 88   and name HD1%)
   (( segid "    " and resid 88   and name HB3 ))
      2.900     1.000     1.000 peak  3254 spectrum    1 weight  0.10000E+01 volume  0.45531E-02 ppm1      0.689 ppm2      1.092 CV     1
 ASSI { 3258}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 88   and name HD1%)
      3.100     1.200     1.200 peak  3258 spectrum    1 weight  0.10000E+01 volume  0.32971E-02 ppm1      4.622 ppm2      0.700 CV     1
 ASSI { 3259}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB3 ))
      3.100     1.200     1.200 peak  3259 spectrum    1 weight  0.10000E+01 volume  0.13744E-02 ppm1      4.623 ppm2      1.081 CV     1
 ASSI { 3261}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 90   and name HG13))
      2.900     2.900     3.100 peak  3261 spectrum    1 weight  0.10000E+01 volume  0.57548E-02 ppm1      0.789 ppm2      1.194 CV     1
 ASSI { 3263}
   (( segid "    " and resid -4   and name HG13))
   (( segid "    " and resid -4   and name HG12))
      1.700     0.300     0.500 peak  3263 spectrum    1 weight  0.10000E+01 volume  0.17999E-01 ppm1      1.358 ppm2      1.076 CV     1
 ASSI { 3264}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 76   and name H   ))
      4.100     2.100     1.900 peak  3264 spectrum    1 weight  0.10000E+01 volume  0.10494E-02 ppm1      2.703 ppm2      9.300 CV     1
 ASSI { 3265}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 76   and name H   ))
      4.400     2.400     1.600 peak  3265 spectrum    1 weight  0.10000E+01 volume  0.10223E-02 ppm1      2.626 ppm2      9.303 CV     1
 ASSI { 3266}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 76   and name H   ))
      2.300     0.700     0.700 peak  3266 spectrum    1 weight  0.10000E+01 volume  0.44582E-02 ppm1      4.732 ppm2      9.310 CV     1
 ASSI { 3268}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 5    and name H   ))
      4.700     2.700     1.300 peak  3268 spectrum    1 weight  0.10000E+01 volume  0.62962E-03 ppm1      2.698 ppm2      8.642 CV     1
 ASSI { 3271}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 75   and name HA  ))
      2.800     1.000     1.000 peak  3271 spectrum    1 weight  0.10000E+01 volume  0.21800E-02 ppm1      2.696 ppm2      4.722 CV     1
 ASSI { 3273}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 76   and name HA3 ))
      4.300     2.300     1.700 peak  3273 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      2.626 ppm2      4.256 CV     1
 ASSI { 3274}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 5    and name HB2 ))
      3.600     1.700     1.700 peak  3274 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      2.711 ppm2      3.575 CV     1
 ASSI { 3275}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 5    and name HB2 ))
      4.700     2.800     1.300 peak  3275 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      2.611 ppm2      3.536 CV     1
 ASSI { 3276}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 75   and name HB2 ))
      2.000     0.500     0.500 peak  3276 spectrum    1 weight  0.10000E+01 volume  0.71764E-02 ppm1      2.694 ppm2      2.619 CV     1
 ASSI { 3277}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 51   and name HD2%)
      4.800     2.900     1.200 peak  3277 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      2.680 ppm2      0.706 CV     1
 ASSI { 3278}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 74   and name HB3 ))
      5.200     3.400     0.800 peak  3278 spectrum    1 weight  0.10000E+01 volume  0.78874E-03 ppm1      2.631 ppm2      1.614 CV     1
 ASSI { 3285}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 71   and name H   ))
      3.400     1.400     1.400 peak  3285 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      3.929 ppm2      7.563 CV     1
 ASSI { 3288}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 67   and name H   ))
      5.400     3.700     0.600 peak  3288 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      3.927 ppm2      8.135 CV     1
 ASSI { 3289}
   (( segid "    " and resid 70   and name HB3 ))
   (( segid "    " and resid 66   and name HA  ))
      4.800     2.800     1.200 peak  3289 spectrum    1 weight  0.10000E+01 volume  0.60592E-03 ppm1      3.115 ppm2      4.372 CV     1
 ASSI { 3292}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB3 ))
      3.200     1.300     1.300 peak  3292 spectrum    1 weight  0.10000E+01 volume  0.30736E-02 ppm1      3.930 ppm2      3.108 CV     1
 ASSI { 3293}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
      2.800     1.000     1.000 peak  3293 spectrum    1 weight  0.10000E+01 volume  0.21495E-02 ppm1      3.930 ppm2      2.834 CV     1
 ASSI { 3296}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.400     1.400     1.400 peak  3296 spectrum    1 weight  0.10000E+01 volume  0.23357E-02 ppm1      4.079 ppm2      2.063 CV     1
 ASSI { 3297}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB3 ))
      3.000     1.100     1.100 peak  3297 spectrum    1 weight  0.10000E+01 volume  0.24779E-02 ppm1      4.076 ppm2      2.028 CV     1
 OR { 3297}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 3298}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 72   and name HE% )
      4.800     2.800     1.200 peak  3298 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      4.069 ppm2      1.935 CV     1
 ASSI { 3299}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 72   and name HG2 ))
      2.900     1.100     1.100 peak  3299 spectrum    1 weight  0.10000E+01 volume  0.23797E-02 ppm1      2.021 ppm2      2.272 CV     1
 ASSI { 3304}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name H   ))
      2.500     0.800     0.800 peak  3304 spectrum    1 weight  0.10000E+01 volume  0.37574E-02 ppm1      4.079 ppm2      7.826 CV     1
 ASSI { 3305}
   (( segid "    " and resid 189  and name HG3 ))
   (( segid "    " and resid 190  and name H   ))
      2.500     2.500     3.500 peak  3305 spectrum    1 weight  0.10000E+01 volume  0.10325E-02 ppm1      1.994 ppm2      8.621 CV     1
 ASSI { 3307}
   (( segid "    " and resid 189  and name HG3 ))
   (( segid "    " and resid 189  and name HA  ))
      3.700     1.700     1.700 peak  3307 spectrum    1 weight  0.10000E+01 volume  0.18347E-02 ppm1      1.995 ppm2      3.983 CV     1
 ASSI { 3309}
   (( segid "    " and resid 187  and name HG2 ))
   (( segid "    " and resid 187  and name H   ))
      3.500     1.500     1.500 peak  3309 spectrum    1 weight  0.10000E+01 volume  0.26642E-02 ppm1      2.057 ppm2      9.147 CV     1
 ASSI { 3310}
   (( segid "    " and resid 187  and name HB2 ))
   (( segid "    " and resid 187  and name H   ))
      2.700     0.900     0.900 peak  3310 spectrum    1 weight  0.10000E+01 volume  0.28332E-02 ppm1      1.910 ppm2      9.146 CV     1
 OR { 3310}
   (( segid "    " and resid 187  and name HB3 ))
   (( segid "    " and resid 187  and name H   ))
 ASSI { 3311}
   (( segid "    " and resid 187  and name HA  ))
   (( segid "    " and resid 187  and name H   ))
      3.000     1.100     1.100 peak  3311 spectrum    1 weight  0.10000E+01 volume  0.16587E-02 ppm1      3.825 ppm2      9.142 CV     1
 ASSI { 3314}
   (( segid "    " and resid 187  and name HB2 ))
   (( segid "    " and resid 188  and name H   ))
      3.900     1.900     1.900 peak  3314 spectrum    1 weight  0.10000E+01 volume  0.90721E-03 ppm1      1.901 ppm2      7.582 CV     1
 OR { 3314}
   (( segid "    " and resid 187  and name HB3 ))
   (( segid "    " and resid 188  and name H   ))
 ASSI { 3315}
   (( segid "    " and resid 187  and name HA  ))
   (( segid "    " and resid 186  and name HA  ))
      4.100     2.100     1.900 peak  3315 spectrum    1 weight  0.10000E+01 volume  0.82257E-03 ppm1      3.843 ppm2      4.304 CV     1
 ASSI { 3316}
   (( segid "    " and resid 187  and name HB3 ))
   (( segid "    " and resid 187  and name HA  ))
      2.600     0.900     0.900 peak  3316 spectrum    1 weight  0.10000E+01 volume  0.48746E-02 ppm1      1.909 ppm2      3.829 CV     1
 OR { 3316}
   (( segid "    " and resid 187  and name HB2 ))
   (( segid "    " and resid 187  and name HA  ))
 ASSI { 3317}
   (( segid "    " and resid 187  and name HG2 ))
   (( segid "    " and resid 187  and name HA  ))
      3.300     1.300     1.300 peak  3317 spectrum    1 weight  0.10000E+01 volume  0.46715E-02 ppm1      2.055 ppm2      3.830 CV     1
 ASSI { 3318}
   (( segid "    " and resid 187  and name HG3 ))
   (( segid "    " and resid 86   and name HD2 ))
      2.500     2.500     3.500 peak  3318 spectrum    1 weight  0.10000E+01 volume  0.11340E-02 ppm1      2.213 ppm2      2.970 CV     1
 ASSI { 3319}
   (( segid "    " and resid 187  and name HG3 ))
   (( segid "    " and resid 86   and name HD3 ))
      4.200     2.200     1.800 peak  3319 spectrum    1 weight  0.10000E+01 volume  0.86658E-03 ppm1      2.211 ppm2      2.910 CV     1
 ASSI { 3320}
   (( segid "    " and resid 187  and name HG2 ))
   (( segid "    " and resid 86   and name HD2 ))
      2.600     2.600     3.400 peak  3320 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      2.058 ppm2      2.963 CV     1
 ASSI { 3322}
   (( segid "    " and resid 187  and name HG2 ))
   (( segid "    " and resid 187  and name HB3 ))
      2.100     0.500     0.500 peak  3322 spectrum    1 weight  0.10000E+01 volume  0.12833E-01 ppm1      2.052 ppm2      1.911 CV     1
 OR { 3322}
   (( segid "    " and resid 187  and name HG2 ))
   (( segid "    " and resid 187  and name HB2 ))
 ASSI { 3330}
   (( segid "    " and resid 59   and name HA3 ))
   (( segid "    " and resid 53   and name H   ))
      4.100     2.100     1.900 peak  3330 spectrum    1 weight  0.10000E+01 volume  0.83611E-03 ppm1      3.745 ppm2      8.035 CV     1
 ASSI { 3332}
   (( segid "    " and resid 59   and name HA2 ))
   (( segid "    " and resid 53   and name H   ))
      3.100     1.200     1.200 peak  3332 spectrum    1 weight  0.10000E+01 volume  0.92075E-03 ppm1      3.538 ppm2      8.039 CV     1
 ASSI { 3333}
   (( segid "    " and resid 59   and name HA2 ))
   (( segid "    " and resid 50   and name HZ  ))
      5.000     3.100     1.000 peak  3333 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      3.550 ppm2      6.733 CV     1
 ASSI { 3336}
   (( segid "    " and resid 59   and name HA2 ))
   (( segid "    " and resid 59   and name HA3 ))
      2.300     0.600     0.600 peak  3336 spectrum    1 weight  0.10000E+01 volume  0.21665E-02 ppm1      3.552 ppm2      3.746 CV     1
 ASSI { 3337}
   (( segid "    " and resid 59   and name HA2 ))
   (( segid "    " and resid 60   and name HG13))
      4.500     2.500     1.500 peak  3337 spectrum    1 weight  0.10000E+01 volume  0.57210E-03 ppm1      3.544 ppm2      1.319 CV     1
 ASSI { 3343}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 136  and name H   ))
      4.300     2.300     1.700 peak  3343 spectrum    1 weight  0.10000E+01 volume  0.15470E-02 ppm1      1.592 ppm2      8.406 CV     1
 ASSI { 3344}
   (( segid "    " and resid 138  and name HD3 ))
   (( segid "    " and resid 169  and name H   ))
      4.100     2.100     1.900 peak  3344 spectrum    1 weight  0.10000E+01 volume  0.14928E-02 ppm1      1.593 ppm2      8.342 CV     1
 OR { 3344}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 169  and name H   ))
 ASSI { 3346}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 58   and name H   ))
      2.700     0.900     0.900 peak  3346 spectrum    1 weight  0.10000E+01 volume  0.31312E-02 ppm1      1.629 ppm2      8.036 CV     1
 OR { 3346}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 58   and name H   ))
 ASSI { 3347}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 55   and name H   ))
      3.100     1.200     1.200 peak  3347 spectrum    1 weight  0.10000E+01 volume  0.18889E-02 ppm1      1.628 ppm2      9.273 CV     1
 OR { 3347}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 55   and name H   ))
 ASSI { 3348}
   (( segid "    " and resid 58   and name HG3 ))
   (( segid "    " and resid 58   and name H   ))
      3.200     1.200     1.200 peak  3348 spectrum    1 weight  0.10000E+01 volume  0.15064E-02 ppm1      1.191 ppm2      8.041 CV     1
 ASSI { 3352}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 184  and name H   ))
      3.900     1.900     1.900 peak  3352 spectrum    1 weight  0.10000E+01 volume  0.93768E-03 ppm1      1.625 ppm2      7.703 CV     1
 OR { 3352}
   (( segid "    " and resid 57   and name HD3 ))
   (( segid "    " and resid 184  and name H   ))
 ASSI { 3353}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 169  and name HA  ))
      4.700     2.700     1.300 peak  3353 spectrum    1 weight  0.10000E+01 volume  0.11983E-02 ppm1      1.594 ppm2      4.431 CV     1
 OR { 3353}
   (( segid "    " and resid 138  and name HD3 ))
   (( segid "    " and resid 169  and name HA  ))
 ASSI { 3354}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 58   and name HA  ))
      3.200     1.300     1.300 peak  3354 spectrum    1 weight  0.10000E+01 volume  0.43533E-02 ppm1      1.629 ppm2      4.334 CV     1
 OR { 3354}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI { 3355}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HA  ))
      3.500     1.500     1.500 peak  3355 spectrum    1 weight  0.10000E+01 volume  0.51183E-02 ppm1      1.595 ppm2      4.257 CV     1
 OR { 3355}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 3356}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 138  and name HA  ))
      3.400     1.400     1.400 peak  3356 spectrum    1 weight  0.10000E+01 volume  0.43805E-02 ppm1      1.591 ppm2      4.204 CV     1
 OR { 3356}
   (( segid "    " and resid 138  and name HD3 ))
   (( segid "    " and resid 138  and name HA  ))
 ASSI { 3358}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 184  and name HA3 ))
      3.800     1.800     1.800 peak  3358 spectrum    1 weight  0.10000E+01 volume  0.14454E-02 ppm1      1.622 ppm2      4.044 CV     1
 OR { 3358}
   (( segid "    " and resid 57   and name HD3 ))
   (( segid "    " and resid 184  and name HA3 ))
 ASSI { 3362}
   (( segid "    " and resid 138  and name HB3 ))
   (( segid "    " and resid 138  and name HA  ))
      2.500     0.800     0.800 peak  3362 spectrum    1 weight  0.10000E+01 volume  0.64689E-02 ppm1      1.779 ppm2      4.195 CV     1
 ASSI { 3367}
   (( segid "    " and resid 58   and name HG2 ))
   (( segid "    " and resid 58   and name HE2 ))
      3.200     1.300     1.300 peak  3367 spectrum    1 weight  0.10000E+01 volume  0.20785E-02 ppm1      1.289 ppm2      2.920 CV     1
 OR { 3367}
   (( segid "    " and resid 58   and name HG2 ))
   (( segid "    " and resid 58   and name HE3 ))
 ASSI { 3369}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 53   and name HB3 ))
      3.700     1.800     1.800 peak  3369 spectrum    1 weight  0.10000E+01 volume  0.13947E-02 ppm1      1.610 ppm2      2.607 CV     1
 OR { 3369}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 53   and name HB3 ))
 ASSI { 3370}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 55   and name HB3 ))
      3.600     1.600     1.600 peak  3370 spectrum    1 weight  0.10000E+01 volume  0.34563E-02 ppm1      1.627 ppm2      2.449 CV     1
 OR { 3370}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 55   and name HB3 ))
 ASSI { 3371}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 136  and name HG3 ))
      3.800     1.800     1.800 peak  3371 spectrum    1 weight  0.10000E+01 volume  0.22714E-02 ppm1      1.587 ppm2      2.237 CV     1
 ASSI { 3372}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 136  and name HG3 ))
      3.500     1.500     1.500 peak  3372 spectrum    1 weight  0.10000E+01 volume  0.48813E-02 ppm1      1.588 ppm2      2.150 CV     1
 OR { 3372}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 136  and name HG3 ))
 OR { 3372}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 136  and name HG2 ))
 ASSI { 3373}
   (( segid "    " and resid 98   and name HD3 ))
   (( segid "    " and resid 118  and name HB2 ))
      2.100     0.500     0.500 peak  3373 spectrum    1 weight  0.10000E+01 volume  0.42923E-02 ppm1      1.591 ppm2      1.985 CV     1
 ASSI { 3374}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 58   and name HB3 ))
      2.800     0.900     0.900 peak  3374 spectrum    1 weight  0.10000E+01 volume  0.62624E-02 ppm1      1.627 ppm2      1.908 CV     1
 OR { 3374}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 58   and name HB3 ))
 ASSI { 3375}
   (( segid "    " and resid 58   and name HB3 ))
   (( segid "    " and resid 58   and name HB2 ))
      2.000     0.500     0.500 peak  3375 spectrum    1 weight  0.10000E+01 volume  0.36390E-02 ppm1      1.904 ppm2      1.710 CV     1
 ASSI { 3377}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
      3.100     1.200     1.200 peak  3377 spectrum    1 weight  0.10000E+01 volume  0.27319E-02 ppm1      4.339 ppm2      1.717 CV     1
 ASSI { 3378}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB3 ))
      2.600     0.900     0.900 peak  3378 spectrum    1 weight  0.10000E+01 volume  0.36052E-02 ppm1      4.339 ppm2      1.907 CV     1
 ASSI { 3379}
   (( segid "    " and resid 58   and name HG3 ))
   (( segid "    " and resid 58   and name HB3 ))
      2.900     1.000     1.000 peak  3379 spectrum    1 weight  0.10000E+01 volume  0.26166E-02 ppm1      1.189 ppm2      1.903 CV     1
 ASSI { 3380}
   (( segid "    " and resid 58   and name HG3 ))
   (( segid "    " and resid 58   and name HB2 ))
      3.000     1.100     1.100 peak  3380 spectrum    1 weight  0.10000E+01 volume  0.21529E-02 ppm1      1.189 ppm2      1.720 CV     1
 ASSI { 3382}
   (( segid "    " and resid 58   and name HG2 ))
   (( segid "    " and resid 58   and name HB2 ))
      2.900     1.100     1.100 peak  3382 spectrum    1 weight  0.10000E+01 volume  0.22138E-02 ppm1      1.289 ppm2      1.722 CV     1
 ASSI { 3383}
   (( segid "    " and resid 58   and name HG2 ))
   (( segid "    " and resid 58   and name HD2 ))
      2.500     0.800     0.800 peak  3383 spectrum    1 weight  0.10000E+01 volume  0.50066E-02 ppm1      1.289 ppm2      1.625 CV     1
 OR { 3383}
   (( segid "    " and resid 58   and name HG2 ))
   (( segid "    " and resid 58   and name HD3 ))
 ASSI { 3384}
   (( segid "    " and resid 58   and name HG2 ))
   (( segid "    " and resid 58   and name HB3 ))
      2.700     0.900     0.900 peak  3384 spectrum    1 weight  0.10000E+01 volume  0.22375E-02 ppm1      1.291 ppm2      1.901 CV     1
 ASSI { 3385}
   (( segid "    " and resid 58   and name HG3 ))
   (( segid "    " and resid 58   and name HG2 ))
      1.800     0.400     0.400 peak  3385 spectrum    1 weight  0.10000E+01 volume  0.86524E-02 ppm1      1.192 ppm2      1.287 CV     1
 ASSI { 3386}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HG2 ))
      3.200     1.300     1.300 peak  3386 spectrum    1 weight  0.10000E+01 volume  0.28908E-02 ppm1      4.337 ppm2      1.288 CV     1
 ASSI { 3387}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HG3 ))
      2.600     0.900     0.900 peak  3387 spectrum    1 weight  0.10000E+01 volume  0.45394E-02 ppm1      4.336 ppm2      1.190 CV     1
 ASSI { 3392}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 58   and name HG3 ))
      2.200     0.600     0.600 peak  3392 spectrum    1 weight  0.10000E+01 volume  0.10616E-01 ppm1      1.629 ppm2      1.191 CV     1
 OR { 3392}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 58   and name HG3 ))
 ASSI { 3393}
   (( segid "    " and resid 60   and name HG13))
   (  segid "    " and resid 51   and name HD2%)
      4.300     2.300     1.700 peak  3393 spectrum    1 weight  0.10000E+01 volume  0.16147E-02 ppm1      1.351 ppm2      0.711 CV     1
 ASSI { 3396}
   (( segid "    " and resid 57   and name HD3 ))
   (( segid "    " and resid 57   and name HA  ))
      3.000     1.200     1.200 peak  3396 spectrum    1 weight  0.10000E+01 volume  0.16045E-02 ppm1      1.666 ppm2      4.137 CV     1
 OR { 3396}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI { 3397}
   (( segid "    " and resid 57   and name HD3 ))
   (( segid "    " and resid 57   and name H   ))
      3.800     1.800     1.800 peak  3397 spectrum    1 weight  0.10000E+01 volume  0.13947E-02 ppm1      1.666 ppm2      8.124 CV     1
 OR { 3397}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 57   and name H   ))
 ASSI { 3398}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 58   and name H   ))
      3.300     1.400     1.400 peak  3398 spectrum    1 weight  0.10000E+01 volume  0.10054E-02 ppm1      1.776 ppm2      8.025 CV     1
 OR { 3398}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 58   and name H   ))
 ASSI { 3399}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name H   ))
      2.900     1.100     1.100 peak  3399 spectrum    1 weight  0.10000E+01 volume  0.22951E-02 ppm1      1.791 ppm2      8.127 CV     1
 OR { 3399}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name H   ))
 ASSI { 3401}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 58   and name H   ))
      3.500     1.500     1.500 peak  3401 spectrum    1 weight  0.10000E+01 volume  0.11069E-02 ppm1      4.143 ppm2      8.027 CV     1
 ASSI { 3402}
   (( segid "    " and resid 57   and name HG3 ))
   (( segid "    " and resid 57   and name H   ))
      3.800     1.800     1.800 peak  3402 spectrum    1 weight  0.10000E+01 volume  0.15639E-02 ppm1      1.464 ppm2      8.125 CV     1
 ASSI { 3404}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 111  and name H   ))
      3.500     1.500     1.500 peak  3404 spectrum    1 weight  0.10000E+01 volume  0.12559E-02 ppm1      4.380 ppm2      8.408 CV     1
 ASSI { 3406}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 110  and name HB3 ))
      3.000     1.100     1.100 peak  3406 spectrum    1 weight  0.10000E+01 volume  0.35307E-02 ppm1      4.382 ppm2      2.596 CV     1
 ASSI { 3407}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
      2.800     1.000     1.000 peak  3407 spectrum    1 weight  0.10000E+01 volume  0.37134E-02 ppm1      4.381 ppm2      1.900 CV     1
 ASSI { 3408}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG2 ))
      3.100     1.200     1.200 peak  3408 spectrum    1 weight  0.10000E+01 volume  0.47459E-02 ppm1      3.957 ppm2      2.156 CV     1
 ASSI { 3409}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB3 ))
      2.900     1.100     1.100 peak  3409 spectrum    1 weight  0.10000E+01 volume  0.48645E-02 ppm1      3.957 ppm2      2.021 CV     1
 ASSI { 3410}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
      2.500     0.800     0.800 peak  3410 spectrum    1 weight  0.10000E+01 volume  0.56463E-02 ppm1      3.955 ppm2      1.946 CV     1
 ASSI { 3411}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 33   and name HB3 ))
      3.400     1.400     1.400 peak  3411 spectrum    1 weight  0.10000E+01 volume  0.17501E-02 ppm1      3.953 ppm2      1.678 CV     1
 ASSI { 3412}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG3 ))
      3.000     1.100     1.100 peak  3412 spectrum    1 weight  0.10000E+01 volume  0.29281E-02 ppm1      3.957 ppm2      2.428 CV     1
 ASSI { 3413}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 40   and name HD1%)
      3.900     1.900     1.900 peak  3413 spectrum    1 weight  0.10000E+01 volume  0.97153E-03 ppm1      3.955 ppm2      0.844 CV     1
 ASSI { 3414}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 51   and name HD2%)
      4.100     2.100     1.900 peak  3414 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      3.958 ppm2      0.745 CV     1
 ASSI { 3415}
   (( segid "    " and resid 189  and name HA  ))
   (( segid "    " and resid 188  and name HB2 ))
      3.700     1.800     1.800 peak  3415 spectrum    1 weight  0.10000E+01 volume  0.59238E-03 ppm1      3.961 ppm2      3.221 CV     1
 ASSI { 3416}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 59   and name HA2 ))
      3.500     1.600     1.600 peak  3416 spectrum    1 weight  0.10000E+01 volume  0.13676E-02 ppm1      3.950 ppm2      3.550 CV     1
 ASSI { 3418}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 51   and name HA  ))
      4.100     2.100     1.900 peak  3418 spectrum    1 weight  0.10000E+01 volume  0.84627E-03 ppm1      3.945 ppm2      4.386 CV     1
 ASSI { 3419}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HA  ))
      4.000     2.000     2.000 peak  3419 spectrum    1 weight  0.10000E+01 volume  0.81580E-03 ppm1      3.955 ppm2      4.344 CV     1
 ASSI { 3420}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
      4.000     2.000     2.000 peak  3420 spectrum    1 weight  0.10000E+01 volume  0.91398E-03 ppm1      3.712 ppm2      4.892 CV     1
 ASSI { 3421}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 50   and name HD% )
      3.900     1.900     1.900 peak  3421 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1      3.952 ppm2      5.501 CV     1
 ASSI { 3423}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 50   and name HZ  ))
      4.300     2.300     1.700 peak  3423 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      3.953 ppm2      6.741 CV     1
 ASSI { 3424}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 60   and name H   ))
      4.000     2.000     2.000 peak  3424 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      3.961 ppm2      7.238 CV     1
 ASSI { 3425}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name H   ))
      2.900     1.000     1.000 peak  3425 spectrum    1 weight  0.10000E+01 volume  0.35408E-02 ppm1      3.956 ppm2      7.629 CV     1
 ASSI { 3426}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name H   ))
      3.500     1.500     1.500 peak  3426 spectrum    1 weight  0.10000E+01 volume  0.14725E-02 ppm1      3.957 ppm2      7.524 CV     1
 ASSI { 3429}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 67   and name H   ))
      4.500     2.500     1.500 peak  3429 spectrum    1 weight  0.10000E+01 volume  0.73119E-03 ppm1      1.545 ppm2      8.131 CV     1
 ASSI { 3432}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name H   ))
      4.300     2.400     1.700 peak  3432 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      2.065 ppm2      7.466 CV     1
 ASSI { 3434}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 65   and name H   ))
      2.400     2.400     3.600 peak  3434 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      0.497 ppm2      8.132 CV     1
 ASSI { 3436}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 66   and name H   ))
      3.900     1.900     1.900 peak  3436 spectrum    1 weight  0.10000E+01 volume  0.11746E-02 ppm1      2.249 ppm2      7.467 CV     1
 OR { 3436}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 66   and name H   ))
 ASSI { 3437}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 67   and name H   ))
      3.900     1.900     1.900 peak  3437 spectrum    1 weight  0.10000E+01 volume  0.14895E-02 ppm1      2.245 ppm2      8.143 CV     1
 OR { 3437}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 67   and name H   ))
 ASSI { 3441}
   (( segid "    " and resid 66   and name HD2 ))
   (  segid "    " and resid 70   and name HE% )
      4.400     2.400     1.600 peak  3441 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      0.487 ppm2      6.538 CV     1
 ASSI { 3444}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 66   and name HA  ))
      3.900     1.900     1.900 peak  3444 spectrum    1 weight  0.10000E+01 volume  0.26371E-02 ppm1      2.251 ppm2      4.393 CV     1
 OR { 3444}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 3445}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 66   and name HA  ))
      4.200     2.300     1.800 peak  3445 spectrum    1 weight  0.10000E+01 volume  0.17366E-02 ppm1      0.501 ppm2      4.390 CV     1
 ASSI { 3446}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HA  ))
      3.100     1.200     1.200 peak  3446 spectrum    1 weight  0.10000E+01 volume  0.65332E-03 ppm1      2.052 ppm2      4.398 CV     1
 ASSI { 3448}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 70   and name HB3 ))
      3.400     1.400     1.400 peak  3448 spectrum    1 weight  0.10000E+01 volume  0.10257E-02 ppm1      0.975 ppm2      3.122 CV     1
 OR { 3448}
   (( segid "    " and resid 66   and name HG3 ))
   (( segid "    " and resid 70   and name HB3 ))
 ASSI { 3452}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 66   and name HB2 ))
      4.000     2.000     2.000 peak  3452 spectrum    1 weight  0.10000E+01 volume  0.20175E-02 ppm1      2.250 ppm2      2.048 CV     1
 OR { 3452}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 3453}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 66   and name HB2 ))
      2.500     0.800     0.800 peak  3453 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      1.536 ppm2      2.051 CV     1
 ASSI { 3456}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 62   and name HB3 ))
      4.300     2.300     1.700 peak  3456 spectrum    1 weight  0.10000E+01 volume  0.59577E-03 ppm1      0.853 ppm2      1.395 CV     1
 ASSI { 3457}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 66   and name HB3 ))
      3.800     1.800     1.800 peak  3457 spectrum    1 weight  0.10000E+01 volume  0.19972E-02 ppm1      2.248 ppm2      1.536 CV     1
 ASSI { 3458}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 62   and name HB3 ))
      2.700     0.900     0.900 peak  3458 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      2.243 ppm2      1.404 CV     1
 OR { 3458}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 62   and name HB3 ))
 ASSI { 3459}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 66   and name HB3 ))
      3.100     1.200     1.200 peak  3459 spectrum    1 weight  0.10000E+01 volume  0.10189E-02 ppm1      0.498 ppm2      1.532 CV     1
 ASSI { 3460}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 66   and name HG3 ))
      3.100     1.200     1.200 peak  3460 spectrum    1 weight  0.10000E+01 volume  0.11340E-02 ppm1      1.536 ppm2      0.998 CV     1
 OR { 3460}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 66   and name HG2 ))
 ASSI { 3463}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 66   and name HG2 ))
      2.200     0.600     0.600 peak  3463 spectrum    1 weight  0.10000E+01 volume  0.10419E-01 ppm1      2.248 ppm2      0.999 CV     1
 OR { 3463}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 66   and name HG3 ))
 ASSI { 3464}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 66   and name HD3 ))
      2.000     0.500     0.500 peak  3464 spectrum    1 weight  0.10000E+01 volume  0.91803E-02 ppm1      2.248 ppm2      0.864 CV     1
 OR { 3464}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 66   and name HD3 ))
 ASSI { 3466}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 66   and name HD2 ))
      1.900     0.500     0.500 peak  3466 spectrum    1 weight  0.10000E+01 volume  0.93191E-02 ppm1      2.248 ppm2      0.497 CV     1
 OR { 3466}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 66   and name HD2 ))
 ASSI { 3473}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 9    and name H   ))
      3.900     1.900     1.900 peak  3473 spectrum    1 weight  0.10000E+01 volume  0.30025E-02 ppm1      0.718 ppm2      8.863 CV     1
 ASSI { 3476}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 19   and name HZ  ))
      2.700     0.900     0.900 peak  3476 spectrum    1 weight  0.10000E+01 volume  0.28265E-02 ppm1      0.720 ppm2      6.967 CV     1
 ASSI { 3477}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 7    and name HA  ))
      4.100     2.100     1.900 peak  3477 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      0.716 ppm2      4.496 CV     1
 ASSI { 3478}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 8    and name HA  ))
      2.200     0.600     0.600 peak  3478 spectrum    1 weight  0.10000E+01 volume  0.58155E-02 ppm1      0.718 ppm2      4.914 CV     1
 ASSI { 3481}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 9    and name HA  ))
      3.800     1.800     1.800 peak  3481 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      0.741 ppm2      5.276 CV     1
 ASSI { 3483}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 8    and name HA  ))
      2.500     0.800     0.800 peak  3483 spectrum    1 weight  0.10000E+01 volume  0.39944E-02 ppm1      0.742 ppm2      4.917 CV     1
 ASSI { 3484}
   (( segid "    " and resid 187  and name HG2 ))
   (( segid "    " and resid 186  and name HA  ))
      2.600     2.600     3.400 peak  3484 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      2.067 ppm2      4.336 CV     1
 ASSI { 3486}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 8    and name HB  ))
      3.000     1.100     1.100 peak  3486 spectrum    1 weight  0.10000E+01 volume  0.52503E-02 ppm1      0.718 ppm2      2.077 CV     1
 ASSI { 3487}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 79   and name HB3 ))
      2.200     0.600     0.600 peak  3487 spectrum    1 weight  0.10000E+01 volume  0.45495E-02 ppm1      0.719 ppm2      1.814 CV     1
 ASSI { 3491}
   (  segid "    " and resid 8    and name HD1%)
   (  segid "    " and resid 49   and name HD2%)
      3.400     1.500     1.500 peak  3491 spectrum    1 weight  0.10000E+01 volume  0.60729E-02 ppm1      0.718 ppm2      0.869 CV     1
 ASSI { 3492}
   (( segid "    " and resid 8    and name HB  ))
   (  segid "    " and resid 8    and name HG2%)
      2.400     0.700     0.700 peak  3492 spectrum    1 weight  0.10000E+01 volume  0.46849E-02 ppm1      2.081 ppm2      0.730 CV     1
 OR { 3492}
   (( segid "    " and resid 8    and name HB  ))
   (  segid "    " and resid 8    and name HD1%)
 ASSI { 3494}
   (  segid "    " and resid 8    and name HD1%)
   (  segid "    " and resid 32   and name HD1%)
      3.100     1.200     1.200 peak  3494 spectrum    1 weight  0.10000E+01 volume  0.19532E-02 ppm1      0.718 ppm2      0.111 CV     1
 ASSI { 3495}
   (  segid "    " and resid 8    and name HD1%)
   (  segid "    " and resid 68   and name HD1%)
      4.100     2.100     1.900 peak  3495 spectrum    1 weight  0.10000E+01 volume  0.11272E-02 ppm1      0.715 ppm2      0.308 CV     1
 ASSI { 3496}
   (( segid "    " and resid 8    and name HG13))
   (( segid "    " and resid 32   and name HG13))
      3.600     1.600     1.600 peak  3496 spectrum    1 weight  0.10000E+01 volume  0.98169E-03 ppm1      1.644 ppm2      0.988 CV     1
 ASSI { 3499}
   (  segid "    " and resid 8    and name HG2%)
   (  segid "    " and resid 32   and name HD1%)
      2.200     0.600     0.600 peak  3499 spectrum    1 weight  0.10000E+01 volume  0.45495E-02 ppm1      0.741 ppm2      0.109 CV     1
 ASSI { 3500}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 8    and name HD1%)
      2.400     0.700     0.700 peak  3500 spectrum    1 weight  0.10000E+01 volume  0.38861E-02 ppm1      4.916 ppm2      0.722 CV     1
 OR { 3500}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 8    and name HG2%)
 ASSI { 3501}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HD22))
      4.500     2.500     1.500 peak  3501 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      2.759 ppm2      6.890 CV     1
 OR { 3501}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 45   and name HD22))
 ASSI { 3503}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 43   and name HB2 ))
      3.000     1.100     1.100 peak  3503 spectrum    1 weight  0.10000E+01 volume  0.16215E-02 ppm1      2.760 ppm2      1.990 CV     1
 ASSI { 3505}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name H   ))
      4.000     2.000     2.000 peak  3505 spectrum    1 weight  0.10000E+01 volume  0.27115E-02 ppm1      2.160 ppm2      7.627 CV     1
 ASSI { 3506}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 34   and name H   ))
      3.900     1.900     1.900 peak  3506 spectrum    1 weight  0.10000E+01 volume  0.31312E-02 ppm1      2.431 ppm2      7.628 CV     1
 ASSI { 3508}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 35   and name H   ))
      2.700     0.900     0.900 peak  3508 spectrum    1 weight  0.10000E+01 volume  0.10561E-02 ppm1      2.022 ppm2      7.529 CV     1
 ASSI { 3511}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 35   and name H   ))
      4.000     2.000     2.000 peak  3511 spectrum    1 weight  0.10000E+01 volume  0.10223E-02 ppm1      2.159 ppm2      7.514 CV     1
 ASSI { 3512}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 66   and name H   ))
      4.300     2.300     1.700 peak  3512 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      2.423 ppm2      7.519 CV     1
 ASSI { 3518}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 34   and name HG3 ))
      3.000     1.100     1.100 peak  3518 spectrum    1 weight  0.10000E+01 volume  0.25929E-02 ppm1      2.032 ppm2      2.433 CV     1
 ASSI { 3519}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HG3 ))
      2.900     1.000     1.000 peak  3519 spectrum    1 weight  0.10000E+01 volume  0.29958E-02 ppm1      1.942 ppm2      2.429 CV     1
 ASSI { 3523}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name H   ))
      3.000     1.100     1.100 peak  3523 spectrum    1 weight  0.10000E+01 volume  0.20581E-02 ppm1      3.815 ppm2      7.176 CV     1
 ASSI { 3524}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 33   and name H   ))
      3.500     1.500     1.500 peak  3524 spectrum    1 weight  0.10000E+01 volume  0.82595E-03 ppm1      3.814 ppm2      7.460 CV     1
 ASSI { 3525}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 33   and name HE  ))
      3.500     1.500     1.500 peak  3525 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      3.824 ppm2      7.632 CV     1
 ASSI { 3528}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 31   and name H   ))
      3.100     1.200     1.200 peak  3528 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      1.470 ppm2      8.343 CV     1
 ASSI { 3529}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 31   and name H   ))
      3.100     1.200     1.200 peak  3529 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      1.650 ppm2      8.327 CV     1
 ASSI { 3532}
   (( segid "    " and resid 30   and name HD2 ))
   (( segid "    " and resid 30   and name H   ))
      4.700     2.700     1.300 peak  3532 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      3.165 ppm2      7.172 CV     1
 ASSI { 3533}
   (( segid "    " and resid 30   and name HD3 ))
   (( segid "    " and resid 30   and name H   ))
      4.800     2.800     1.200 peak  3533 spectrum    1 weight  0.10000E+01 volume  0.68379E-03 ppm1      3.230 ppm2      7.161 CV     1
 ASSI { 3536}
   (( segid "    " and resid 30   and name HD3 ))
   (  segid "    " and resid 26   and name HD% )
      2.500     2.500     3.500 peak  3536 spectrum    1 weight  0.10000E+01 volume  0.98846E-03 ppm1      3.235 ppm2      7.077 CV     1
 ASSI { 3538}
   (( segid "    " and resid 30   and name HG2 ))
   (  segid "    " and resid 26   and name HD% )
      2.700     2.700     3.300 peak  3538 spectrum    1 weight  0.10000E+01 volume  0.65332E-03 ppm1      1.481 ppm2      7.076 CV     1
 ASSI { 3543}
   (( segid "    " and resid 30   and name HB3 ))
   (( segid "    " and resid 27   and name HA  ))
      3.500     1.600     1.600 peak  3543 spectrum    1 weight  0.10000E+01 volume  0.86658E-03 ppm1      1.860 ppm2      4.624 CV     1
 ASSI { 3545}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HA  ))
      3.600     1.700     1.700 peak  3545 spectrum    1 weight  0.10000E+01 volume  0.17975E-02 ppm1      1.475 ppm2      3.809 CV     1
 ASSI { 3547}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HD2 ))
      4.900     3.000     1.100 peak  3547 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      3.813 ppm2      3.151 CV     1
 ASSI { 3548}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 33   and name HD2 ))
      3.900     1.900     1.900 peak  3548 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      3.804 ppm2      3.019 CV     1
 OR { 3548}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 33   and name HD3 ))
 ASSI { 3550}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HD3 ))
      3.500     1.500     1.500 peak  3550 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      2.087 ppm2      3.213 CV     1
 ASSI { 3552}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HA  ))
      3.000     1.100     1.100 peak  3552 spectrum    1 weight  0.10000E+01 volume  0.14725E-02 ppm1      2.106 ppm2      3.813 CV     1
 ASSI { 3554}
   (( segid "    " and resid 30   and name HD3 ))
   (( segid "    " and resid 30   and name HB3 ))
      3.200     1.300     1.300 peak  3554 spectrum    1 weight  0.10000E+01 volume  0.21563E-02 ppm1      3.231 ppm2      1.859 CV     1
 ASSI { 3556}
   (( segid "    " and resid 30   and name HD3 ))
   (( segid "    " and resid 30   and name HG2 ))
      2.500     0.800     0.800 peak  3556 spectrum    1 weight  0.10000E+01 volume  0.44244E-02 ppm1      3.231 ppm2      1.473 CV     1
 ASSI { 3557}
   (( segid "    " and resid 30   and name HD2 ))
   (( segid "    " and resid 30   and name HB2 ))
      3.100     1.200     1.200 peak  3557 spectrum    1 weight  0.10000E+01 volume  0.18957E-02 ppm1      3.151 ppm2      2.104 CV     1
 ASSI { 3558}
   (( segid "    " and resid 35   and name HD3 ))
   (( segid "    " and resid 34   and name HB3 ))
      3.600     1.600     1.600 peak  3558 spectrum    1 weight  0.10000E+01 volume  0.17027E-02 ppm1      3.121 ppm2      2.043 CV     1
 ASSI { 3560}
   (( segid "    " and resid 30   and name HD2 ))
   (( segid "    " and resid 30   and name HG2 ))
      2.500     0.800     0.800 peak  3560 spectrum    1 weight  0.10000E+01 volume  0.42822E-02 ppm1      3.153 ppm2      1.471 CV     1
 ASSI { 3561}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HG3 ))
      1.600     0.300     0.600 peak  3561 spectrum    1 weight  0.10000E+01 volume  0.95393E-02 ppm1      1.472 ppm2      1.655 CV     1
 ASSI { 3562}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HG3 ))
      3.000     1.100     1.100 peak  3562 spectrum    1 weight  0.10000E+01 volume  0.11679E-02 ppm1      2.100 ppm2      1.654 CV     1
 ASSI { 3563}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HG2 ))
      3.300     1.400     1.400 peak  3563 spectrum    1 weight  0.10000E+01 volume  0.18009E-02 ppm1      2.108 ppm2      1.469 CV     1
 ASSI { 3564}
   (( segid "    " and resid 30   and name HB3 ))
   (( segid "    " and resid 30   and name HG2 ))
      2.600     0.800     0.800 peak  3564 spectrum    1 weight  0.10000E+01 volume  0.22274E-02 ppm1      1.863 ppm2      1.467 CV     1
 ASSI { 3565}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HB3 ))
      2.200     0.600     0.600 peak  3565 spectrum    1 weight  0.10000E+01 volume  0.27420E-02 ppm1      2.103 ppm2      1.861 CV     1
 ASSI { 3568}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 32   and name HG2%)
      3.700     1.700     1.700 peak  3568 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      3.823 ppm2      0.758 CV     1
 ASSI { 3569}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 33   and name HG3 ))
      4.000     2.000     2.000 peak  3569 spectrum    1 weight  0.10000E+01 volume  0.59577E-03 ppm1      3.827 ppm2      1.141 CV     1
 OR { 3569}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 33   and name HG2 ))
 ASSI { 3570}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 26   and name H   ))
      4.800     2.900     1.200 peak  3570 spectrum    1 weight  0.10000E+01 volume  0.66348E-03 ppm1      2.596 ppm2      8.716 CV     1
 OR { 3570}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 26   and name H   ))
 ASSI { 3571}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 107  and name H   ))
      3.600     1.600     1.600 peak  3571 spectrum    1 weight  0.10000E+01 volume  0.11069E-02 ppm1      2.601 ppm2      8.522 CV     1
 ASSI { 3578}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 24   and name HB3 ))
      3.400     1.400     1.400 peak  3578 spectrum    1 weight  0.10000E+01 volume  0.18144E-02 ppm1      2.599 ppm2      1.721 CV     1
 OR { 3578}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 24   and name HB2 ))
 OR { 3578}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 24   and name HB3 ))
 OR { 3578}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 24   and name HB2 ))
 ASSI { 3583}
   (( segid "    " and resid 103  and name HB3 ))
   (  segid "    " and resid 102  and name HG1%)
      4.600     2.600     1.400 peak  3583 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      2.594 ppm2      0.693 CV     1
 ASSI { 3588}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 74   and name H   ))
      4.600     2.600     1.400 peak  3588 spectrum    1 weight  0.10000E+01 volume  0.14928E-02 ppm1      0.824 ppm2      8.925 CV     1
 ASSI { 3589}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 74   and name H   ))
      3.300     1.300     1.300 peak  3589 spectrum    1 weight  0.10000E+01 volume  0.67906E-02 ppm1      0.821 ppm2      8.927 CV     1
 ASSI { 3590}
   (( segid "    " and resid 73   and name HG  ))
   (( segid "    " and resid 74   and name H   ))
      4.500     2.500     1.500 peak  3590 spectrum    1 weight  0.10000E+01 volume  0.74811E-03 ppm1      1.514 ppm2      8.921 CV     1
 ASSI { 3591}
   (( segid "    " and resid 195  and name HG3 ))
   (( segid "    " and resid 196  and name H   ))
      3.500     1.600     1.600 peak  3591 spectrum    1 weight  0.10000E+01 volume  0.14285E-02 ppm1      0.822 ppm2      8.346 CV     1
 OR { 3591}
   (( segid "    " and resid 195  and name HG2 ))
   (( segid "    " and resid 196  and name H   ))
 ASSI { 3592}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 77   and name H   ))
      4.600     2.600     1.400 peak  3592 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      0.822 ppm2      8.082 CV     1
 ASSI { 3593}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 69   and name H   ))
      3.800     1.800     1.800 peak  3593 spectrum    1 weight  0.10000E+01 volume  0.21800E-02 ppm1      0.820 ppm2      8.083 CV     1
 ASSI { 3595}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 72   and name H   ))
      5.200     3.400     0.800 peak  3595 spectrum    1 weight  0.10000E+01 volume  0.72780E-03 ppm1      0.817 ppm2      7.835 CV     1
 ASSI { 3596}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 72   and name H   ))
      3.500     1.500     1.500 peak  3596 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      0.833 ppm2      7.823 CV     1
 ASSI { 3597}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 60   and name H   ))
      3.000     1.100     1.100 peak  3597 spectrum    1 weight  0.10000E+01 volume  0.10697E-02 ppm1      1.491 ppm2      7.230 CV     1
 ASSI { 3598}
   (  segid "    " and resid 73   and name HD2%)
   (  segid "    " and resid 71   and name HD% )
      4.000     2.000     2.000 peak  3598 spectrum    1 weight  0.10000E+01 volume  0.10697E-02 ppm1      0.825 ppm2      7.243 CV     1
 ASSI { 3600}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name H   ))
      3.900     1.900     1.900 peak  3600 spectrum    1 weight  0.10000E+01 volume  0.10122E-02 ppm1      1.456 ppm2      6.783 CV     1
 ASSI { 3602}
   (( segid "    " and resid 178  and name HG3 ))
   (( segid "    " and resid 178  and name HA  ))
      3.700     1.700     1.700 peak  3602 spectrum    1 weight  0.10000E+01 volume  0.64655E-03 ppm1      1.480 ppm2      4.866 CV     1
 ASSI { 3604}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
      3.600     1.600     1.600 peak  3604 spectrum    1 weight  0.10000E+01 volume  0.58900E-03 ppm1      1.492 ppm2      4.223 CV     1
 ASSI { 3607}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 71   and name HB3 ))
      3.700     1.700     1.700 peak  3607 spectrum    1 weight  0.10000E+01 volume  0.26404E-02 ppm1      0.819 ppm2      3.159 CV     1
 ASSI { 3608}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 71   and name HB3 ))
      2.800     1.000     1.000 peak  3608 spectrum    1 weight  0.10000E+01 volume  0.14962E-02 ppm1      0.823 ppm2      3.156 CV     1
 ASSI { 3610}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 77   and name HB2 ))
      4.400     2.400     1.600 peak  3610 spectrum    1 weight  0.10000E+01 volume  0.11475E-02 ppm1      0.831 ppm2      2.820 CV     1
 ASSI { 3611}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 77   and name HB2 ))
      3.800     1.900     1.900 peak  3611 spectrum    1 weight  0.10000E+01 volume  0.26844E-02 ppm1      0.821 ppm2      2.803 CV     1
 ASSI { 3612}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 71   and name HB2 ))
      3.200     1.300     1.300 peak  3612 spectrum    1 weight  0.10000E+01 volume  0.23120E-02 ppm1      0.821 ppm2      2.685 CV     1
 ASSI { 3613}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 77   and name HB3 ))
      3.800     1.800     1.800 peak  3613 spectrum    1 weight  0.10000E+01 volume  0.26944E-02 ppm1      0.820 ppm2      2.469 CV     1
 ASSI { 3614}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 77   and name HB3 ))
      4.600     2.600     1.400 peak  3614 spectrum    1 weight  0.10000E+01 volume  0.64655E-03 ppm1      0.823 ppm2      2.456 CV     1
 ASSI { 3615}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 79   and name HG3 ))
      3.600     1.700     1.700 peak  3615 spectrum    1 weight  0.10000E+01 volume  0.13202E-02 ppm1      0.823 ppm2      2.137 CV     1
 OR { 3615}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 3616}
   (( segid "    " and resid 121  and name HG13))
   (( segid "    " and resid 119  and name HB  ))
      2.200     0.600     0.600 peak  3616 spectrum    1 weight  0.10000E+01 volume  0.19126E-02 ppm1      0.823 ppm2      1.946 CV     1
 ASSI { 3617}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 73   and name HB2 ))
      2.300     0.700     0.700 peak  3617 spectrum    1 weight  0.10000E+01 volume  0.15030E-02 ppm1      1.335 ppm2      1.470 CV     1
 OR { 3617}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 73   and name HG  ))
 ASSI { 3623}
   (( segid "    " and resid 73   and name HB3 ))
   (  segid "    " and resid 73   and name HD2%)
      2.700     0.900     0.900 peak  3623 spectrum    1 weight  0.10000E+01 volume  0.24034E-02 ppm1      1.331 ppm2      0.824 CV     1
 OR { 3623}
   (( segid "    " and resid 73   and name HB3 ))
   (  segid "    " and resid 73   and name HD1%)
 ASSI { 3624}
   (( segid "    " and resid 73   and name HB3 ))
   (  segid "    " and resid 51   and name HD2%)
      2.900     1.100     1.100 peak  3624 spectrum    1 weight  0.10000E+01 volume  0.13811E-02 ppm1      1.324 ppm2      0.709 CV     1
 ASSI { 3626}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 72   and name HB2 ))
      3.800     3.800     2.200 peak  3626 spectrum    1 weight  0.10000E+01 volume  0.27994E-02 ppm1      0.816 ppm2      2.138 CV     1
 ASSI { 3627}
   (( segid "    " and resid 51   and name HB3 ))
   (  segid "    " and resid 62   and name HD1%)
      4.700     2.800     1.300 peak  3627 spectrum    1 weight  0.10000E+01 volume  0.74473E-03 ppm1      1.493 ppm2      0.397 CV     1
 ASSI { 3628}
   (  segid "    " and resid 73   and name HD1%)
   (  segid "    " and resid 62   and name HD1%)
      2.900     1.000     1.000 peak  3628 spectrum    1 weight  0.10000E+01 volume  0.24068E-02 ppm1      0.819 ppm2      0.406 CV     1
 ASSI { 3629}
   (  segid "    " and resid 73   and name HD1%)
   (  segid "    " and resid 68   and name HD2%)
      3.100     1.200     1.200 peak  3629 spectrum    1 weight  0.10000E+01 volume  0.22375E-02 ppm1      0.821 ppm2      0.310 CV     1
 OR { 3629}
   (  segid "    " and resid 73   and name HD1%)
   (  segid "    " and resid 68   and name HD1%)
 ASSI { 3631}
   (  segid "    " and resid 73   and name HD1%)
   (  segid "    " and resid 62   and name HD2%)
      3.100     1.200     1.200 peak  3631 spectrum    1 weight  0.10000E+01 volume  0.25354E-02 ppm1      0.821 ppm2     -0.164 CV     1
 ASSI { 3632}
   (( segid "    " and resid 51   and name HB3 ))
   (  segid "    " and resid 62   and name HD2%)
      4.200     2.200     1.800 peak  3632 spectrum    1 weight  0.10000E+01 volume  0.93429E-03 ppm1      1.503 ppm2     -0.166 CV     1
 ASSI { 3634}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 72   and name HG3 ))
      3.200     1.300     1.300 peak  3634 spectrum    1 weight  0.10000E+01 volume  0.24610E-02 ppm1      2.029 ppm2      2.329 CV     1
 ASSI { 3635}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name H   ))
      2.600     0.800     0.800 peak  3635 spectrum    1 weight  0.10000E+01 volume  0.22646E-02 ppm1      4.455 ppm2      8.926 CV     1
 ASSI { 3636}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 92   and name H   ))
      4.700     2.800     1.300 peak  3636 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      1.788 ppm2      8.935 CV     1
 ASSI { 3638}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 74   and name H   ))
      3.600     1.600     1.600 peak  3638 spectrum    1 weight  0.10000E+01 volume  0.98169E-03 ppm1      1.640 ppm2      8.929 CV     1
 ASSI { 3640}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 74   and name H   ))
      2.700     0.900     0.900 peak  3640 spectrum    1 weight  0.10000E+01 volume  0.21394E-02 ppm1      1.610 ppm2      8.927 CV     1
 ASSI { 3641}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name H   ))
      3.300     1.400     1.400 peak  3641 spectrum    1 weight  0.10000E+01 volume  0.20175E-02 ppm1      1.560 ppm2      8.923 CV     1
 ASSI { 3642}
   (( segid "    " and resid 68   and name HG  ))
   (( segid "    " and resid 68   and name H   ))
      2.600     0.900     0.900 peak  3642 spectrum    1 weight  0.10000E+01 volume  0.18449E-02 ppm1      1.616 ppm2      8.364 CV     1
 ASSI { 3643}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 75   and name H   ))
      3.900     1.900     1.900 peak  3643 spectrum    1 weight  0.10000E+01 volume  0.21800E-02 ppm1      1.560 ppm2      8.363 CV     1
 ASSI { 3646}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name H   ))
      2.400     0.700     0.700 peak  3646 spectrum    1 weight  0.10000E+01 volume  0.71188E-02 ppm1      4.452 ppm2      8.362 CV     1
 ASSI { 3647}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 75   and name H   ))
      3.500     1.500     1.500 peak  3647 spectrum    1 weight  0.10000E+01 volume  0.14556E-02 ppm1      3.184 ppm2      8.363 CV     1
 ASSI { 3648}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 75   and name H   ))
      4.000     2.000     2.000 peak  3648 spectrum    1 weight  0.10000E+01 volume  0.14624E-02 ppm1      3.113 ppm2      8.357 CV     1
 ASSI { 3649}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name H   ))
      3.700     1.700     1.700 peak  3649 spectrum    1 weight  0.10000E+01 volume  0.13710E-02 ppm1      3.184 ppm2      8.934 CV     1
 ASSI { 3650}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name H   ))
      4.100     2.100     1.900 peak  3650 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      3.113 ppm2      8.926 CV     1
 ASSI { 3653}
   (( segid "    " and resid 35   and name HD3 ))
   (( segid "    " and resid 32   and name H   ))
      3.800     1.800     1.800 peak  3653 spectrum    1 weight  0.10000E+01 volume  0.56871E-03 ppm1      3.115 ppm2      8.102 CV     1
 ASSI { 3656}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HA  ))
      3.800     1.800     1.800 peak  3656 spectrum    1 weight  0.10000E+01 volume  0.23662E-02 ppm1      3.182 ppm2      4.452 CV     1
 ASSI { 3657}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 74   and name HA  ))
      3.100     1.200     1.200 peak  3657 spectrum    1 weight  0.10000E+01 volume  0.27826E-02 ppm1      1.617 ppm2      4.449 CV     1
 ASSI { 3658}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name HA  ))
      3.200     1.300     1.300 peak  3658 spectrum    1 weight  0.10000E+01 volume  0.32056E-02 ppm1      1.562 ppm2      4.450 CV     1
 ASSI { 3662}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 73   and name HA  ))
      3.000     1.100     1.100 peak  3662 spectrum    1 weight  0.10000E+01 volume  0.24339E-02 ppm1      1.613 ppm2      4.213 CV     1
 ASSI { 3663}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 73   and name HA  ))
      3.800     1.800     1.800 peak  3663 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      1.559 ppm2      4.210 CV     1
 ASSI { 3664}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name HD2 ))
      2.900     1.000     1.000 peak  3664 spectrum    1 weight  0.10000E+01 volume  0.29314E-02 ppm1      1.560 ppm2      3.182 CV     1
 ASSI { 3665}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name HD3 ))
      2.800     1.000     1.000 peak  3665 spectrum    1 weight  0.10000E+01 volume  0.23967E-02 ppm1      1.561 ppm2      3.111 CV     1
 ASSI { 3668}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 74   and name HD2 ))
      4.000     2.000     2.000 peak  3668 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      1.627 ppm2      3.178 CV     1
 ASSI { 3669}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 74   and name HD3 ))
      3.700     1.700     1.700 peak  3669 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      1.621 ppm2      3.124 CV     1
 ASSI { 3671}
   (( segid "    " and resid 35   and name HD3 ))
   (( segid "    " and resid 34   and name HG3 ))
      5.200     3.300     0.800 peak  3671 spectrum    1 weight  0.10000E+01 volume  0.68718E-03 ppm1      3.113 ppm2      2.431 CV     1
 ASSI { 3672}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
      2.600     0.900     0.900 peak  3672 spectrum    1 weight  0.10000E+01 volume  0.32193E-02 ppm1      4.451 ppm2      1.725 CV     1
 ASSI { 3673}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB3 ))
      2.200     0.600     0.600 peak  3673 spectrum    1 weight  0.10000E+01 volume  0.55413E-02 ppm1      4.452 ppm2      1.614 CV     1
 ASSI { 3674}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HB3 ))
      1.800     0.400     0.400 peak  3674 spectrum    1 weight  0.10000E+01 volume  0.10003E-01 ppm1      1.723 ppm2      1.620 CV     1
 OR { 3674}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HG3 ))
 ASSI { 3675}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 74   and name HB2 ))
      1.900     0.500     0.500 peak  3675 spectrum    1 weight  0.10000E+01 volume  0.40959E-02 ppm1      1.629 ppm2      1.723 CV     1
 ASSI { 3676}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HB2 ))
      2.400     0.700     0.700 peak  3676 spectrum    1 weight  0.10000E+01 volume  0.43973E-02 ppm1      3.181 ppm2      1.717 CV     1
 ASSI { 3677}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HG3 ))
      2.200     2.200     3.800 peak  3677 spectrum    1 weight  0.10000E+01 volume  0.11885E-01 ppm1      3.183 ppm2      1.610 CV     1
 ASSI { 3678}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name HG3 ))
      2.200     0.600     0.600 peak  3678 spectrum    1 weight  0.10000E+01 volume  0.13933E-01 ppm1      3.111 ppm2      1.611 CV     1
 ASSI { 3679}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name HB2 ))
      2.500     0.800     0.800 peak  3679 spectrum    1 weight  0.10000E+01 volume  0.57512E-02 ppm1      3.114 ppm2      1.720 CV     1
 ASSI { 3681}
   (( segid "    " and resid 74   and name HA  ))
   (  segid "    " and resid 4    and name HD2%)
      2.600     0.900     0.900 peak  3681 spectrum    1 weight  0.10000E+01 volume  0.33852E-02 ppm1      4.454 ppm2      0.708 CV     1
 OR { 3681}
   (( segid "    " and resid 74   and name HA  ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 3683}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 106  and name H   ))
      3.300     1.400     1.400 peak  3683 spectrum    1 weight  0.10000E+01 volume  0.10731E-02 ppm1      4.150 ppm2      7.250 CV     1
 ASSI { 3685}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HB2 ))
      3.000     1.100     1.100 peak  3685 spectrum    1 weight  0.10000E+01 volume  0.21868E-02 ppm1      4.155 ppm2      3.713 CV     1
 ASSI { 3686}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 61   and name HB3 ))
      4.700     2.700     1.300 peak  3686 spectrum    1 weight  0.10000E+01 volume  0.62285E-03 ppm1      4.159 ppm2      3.133 CV     1
 ASSI { 3687}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HB3 ))
      3.100     1.200     1.200 peak  3687 spectrum    1 weight  0.10000E+01 volume  0.19904E-02 ppm1      4.157 ppm2      2.420 CV     1
 ASSI { 3688}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 106  and name HG3 ))
      4.600     2.700     1.400 peak  3688 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      4.155 ppm2      1.180 CV     1
 ASSI { 3689}
   (( segid "    " and resid 182  and name HG2 ))
   (( segid "    " and resid 179  and name H   ))
      4.200     2.300     1.800 peak  3689 spectrum    1 weight  0.10000E+01 volume  0.78197E-03 ppm1      2.574 ppm2      9.377 CV     1
 ASSI { 3690}
   (( segid "    " and resid 182  and name HG3 ))
   (( segid "    " and resid 179  and name H   ))
      4.900     3.000     1.100 peak  3690 spectrum    1 weight  0.10000E+01 volume  0.78874E-03 ppm1      2.239 ppm2      9.400 CV     1
 ASSI { 3695}
   (( segid "    " and resid 182  and name HB3 ))
   (( segid "    " and resid 183  and name H   ))
      3.500     1.500     1.500 peak  3695 spectrum    1 weight  0.10000E+01 volume  0.64994E-03 ppm1      2.324 ppm2      7.159 CV     1
 ASSI { 3697}
   (( segid "    " and resid 182  and name HG2 ))
   (( segid "    " and resid 183  and name H   ))
      4.900     3.000     1.100 peak  3697 spectrum    1 weight  0.10000E+01 volume  0.60254E-03 ppm1      2.573 ppm2      7.171 CV     1
 ASSI { 3700}
   (( segid "    " and resid 182  and name HG2 ))
   (( segid "    " and resid 183  and name HA  ))
      4.700     2.700     1.300 peak  3700 spectrum    1 weight  0.10000E+01 volume  0.76166E-03 ppm1      2.581 ppm2      4.486 CV     1
 ASSI { 3701}
   (( segid "    " and resid 182  and name HB2 ))
   (( segid "    " and resid 182  and name HA  ))
      2.700     0.900     0.900 peak  3701 spectrum    1 weight  0.10000E+01 volume  0.25185E-02 ppm1      1.942 ppm2      4.384 CV     1
 ASSI { 3702}
   (( segid "    " and resid 182  and name HG3 ))
   (( segid "    " and resid 182  and name HA  ))
      3.400     1.400     1.400 peak  3702 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      2.214 ppm2      4.382 CV     1
 ASSI { 3706}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 57   and name HA  ))
      3.400     1.400     1.400 peak  3706 spectrum    1 weight  0.10000E+01 volume  0.15131E-02 ppm1      4.388 ppm2      4.137 CV     1
 ASSI { 3707}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 182  and name HG2 ))
      4.000     2.000     2.000 peak  3707 spectrum    1 weight  0.10000E+01 volume  0.13337E-02 ppm1      4.383 ppm2      2.566 CV     1
 ASSI { 3709}
   (( segid "    " and resid 182  and name HB2 ))
   (( segid "    " and resid 182  and name HG2 ))
      2.700     0.900     0.900 peak  3709 spectrum    1 weight  0.10000E+01 volume  0.29348E-02 ppm1      1.950 ppm2      2.560 CV     1
 ASSI { 3710}
   (( segid "    " and resid 182  and name HB3 ))
   (( segid "    " and resid 182  and name HG3 ))
      2.900     1.000     1.000 peak  3710 spectrum    1 weight  0.10000E+01 volume  0.20886E-02 ppm1      2.319 ppm2      2.229 CV     1
 ASSI { 3711}
   (( segid "    " and resid 182  and name HB3 ))
   (( segid "    " and resid 182  and name HB2 ))
      1.900     0.500     0.500 peak  3711 spectrum    1 weight  0.10000E+01 volume  0.48273E-02 ppm1      2.323 ppm2      1.941 CV     1
 ASSI { 3713}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 57   and name HB3 ))
      3.000     1.100     1.100 peak  3713 spectrum    1 weight  0.10000E+01 volume  0.18618E-02 ppm1      4.389 ppm2      1.785 CV     1
 ASSI { 3714}
   (( segid "    " and resid 182  and name HB3 ))
   (( segid "    " and resid 181  and name HB3 ))
      3.800     1.800     1.800 peak  3714 spectrum    1 weight  0.10000E+01 volume  0.84627E-03 ppm1      2.313 ppm2      1.767 CV     1
 ASSI { 3715}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 57   and name HD3 ))
      3.700     1.800     1.800 peak  3715 spectrum    1 weight  0.10000E+01 volume  0.95460E-03 ppm1      4.389 ppm2      1.643 CV     1
 OR { 3715}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 57   and name HD2 ))
 ASSI { 3717}
   (( segid "    " and resid 182  and name HG2 ))
   (( segid "    " and resid 182  and name HB3 ))
      2.700     0.900     0.900 peak  3717 spectrum    1 weight  0.10000E+01 volume  0.27386E-02 ppm1      2.572 ppm2      2.308 CV     1
 ASSI { 3723}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 9    and name H   ))
      2.900     1.000     1.000 peak  3723 spectrum    1 weight  0.10000E+01 volume  0.16079E-02 ppm1      5.175 ppm2      8.855 CV     1
 ASSI { 3725}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name H   ))
      2.700     0.900     0.900 peak  3725 spectrum    1 weight  0.10000E+01 volume  0.20141E-02 ppm1      1.979 ppm2      9.162 CV     1
 OR { 3725}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 80   and name H   ))
 ASSI { 3727}
   (( segid "    " and resid 80   and name HG2 ))
   (( segid "    " and resid 80   and name H   ))
      4.500     2.500     1.500 peak  3727 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      2.023 ppm2      9.157 CV     1
 ASSI { 3728}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 80   and name H   ))
      4.100     2.100     1.900 peak  3728 spectrum    1 weight  0.10000E+01 volume  0.16722E-02 ppm1      2.399 ppm2      9.166 CV     1
 ASSI { 3729}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 9    and name H   ))
      3.800     1.800     1.800 peak  3729 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      2.396 ppm2      8.851 CV     1
 ASSI { 3730}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 81   and name H   ))
      4.200     2.200     1.800 peak  3730 spectrum    1 weight  0.10000E+01 volume  0.10934E-02 ppm1      2.404 ppm2      8.550 CV     1
 ASSI { 3731}
   (( segid "    " and resid 80   and name HG2 ))
   (( segid "    " and resid 81   and name H   ))
      3.400     1.500     1.500 peak  3731 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      2.018 ppm2      8.552 CV     1
 ASSI { 3732}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 132  and name H   ))
      4.100     2.100     1.900 peak  3732 spectrum    1 weight  0.10000E+01 volume  0.92413E-03 ppm1      1.982 ppm2      8.617 CV     1
 ASSI { 3733}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 81   and name H   ))
      3.600     1.600     1.600 peak  3733 spectrum    1 weight  0.10000E+01 volume  0.16722E-02 ppm1      1.996 ppm2      8.557 CV     1
 ASSI { 3735}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 57   and name H   ))
      3.300     1.400     1.400 peak  3735 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      2.016 ppm2      8.126 CV     1
 ASSI { 3736}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 80   and name HA  ))
      3.000     1.100     1.100 peak  3736 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      2.398 ppm2      5.166 CV     1
 ASSI { 3737}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 8    and name HA  ))
      4.300     2.300     1.700 peak  3737 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      2.401 ppm2      4.897 CV     1
 ASSI { 3738}
   (( segid "    " and resid 80   and name HG2 ))
   (( segid "    " and resid 80   and name HA  ))
      3.200     1.300     1.300 peak  3738 spectrum    1 weight  0.10000E+01 volume  0.15267E-02 ppm1      2.021 ppm2      5.168 CV     1
 ASSI { 3739}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HA  ))
      3.100     1.200     1.200 peak  3739 spectrum    1 weight  0.10000E+01 volume  0.13947E-02 ppm1      1.998 ppm2      5.172 CV     1
 OR { 3739}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI { 3742}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 9    and name HB3 ))
      2.700     0.900     0.900 peak  3742 spectrum    1 weight  0.10000E+01 volume  0.16012E-02 ppm1      2.398 ppm2      3.667 CV     1
 ASSI { 3743}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 9    and name HB2 ))
      3.700     1.700     1.700 peak  3743 spectrum    1 weight  0.10000E+01 volume  0.10426E-02 ppm1      2.400 ppm2      3.571 CV     1
 ASSI { 3745}
   (( segid "    " and resid 80   and name HG2 ))
   (( segid "    " and resid 9    and name HB3 ))
      3.900     1.900     1.900 peak  3745 spectrum    1 weight  0.10000E+01 volume  0.14285E-02 ppm1      2.026 ppm2      3.672 CV     1
 ASSI { 3746}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 52   and name HB2 ))
      3.300     1.300     1.300 peak  3746 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      1.996 ppm2      3.672 CV     1
 ASSI { 3747}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HD3 ))
      2.600     0.800     0.800 peak  3747 spectrum    1 weight  0.10000E+01 volume  0.11645E-02 ppm1      1.986 ppm2      3.056 CV     1
 ASSI { 3748}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HD2 ))
      3.800     1.800     1.800 peak  3748 spectrum    1 weight  0.10000E+01 volume  0.10663E-02 ppm1      1.991 ppm2      2.963 CV     1
 ASSI { 3749}
   (( segid "    " and resid 178  and name HB3 ))
   (( segid "    " and resid 178  and name HD3 ))
      3.900     1.900     1.900 peak  3749 spectrum    1 weight  0.10000E+01 volume  0.91398E-03 ppm1      2.025 ppm2      3.077 CV     1
 OR { 3749}
   (( segid "    " and resid 178  and name HB3 ))
   (( segid "    " and resid 178  and name HD2 ))
 ASSI { 3750}
   (( segid "    " and resid 178  and name HB3 ))
   (( segid "    " and resid 178  and name HA  ))
      3.700     1.700     1.700 peak  3750 spectrum    1 weight  0.10000E+01 volume  0.95460E-03 ppm1      2.022 ppm2      4.888 CV     1
 ASSI { 3751}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
      4.300     2.300     1.700 peak  3751 spectrum    1 weight  0.10000E+01 volume  0.12051E-02 ppm1      1.982 ppm2      4.901 CV     1
 ASSI { 3752}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 81   and name HA  ))
      4.400     2.400     1.600 peak  3752 spectrum    1 weight  0.10000E+01 volume  0.62624E-03 ppm1      5.180 ppm2      5.429 CV     1
 ASSI { 3753}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 81   and name HA  ))
      3.800     1.800     1.800 peak  3753 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      1.968 ppm2      5.423 CV     1
 ASSI { 3756}
   (( segid "    " and resid 80   and name HG2 ))
   (( segid "    " and resid 80   and name HG3 ))
      1.900     0.400     0.400 peak  3756 spectrum    1 weight  0.10000E+01 volume  0.83037E-02 ppm1      2.020 ppm2      2.398 CV     1
 ASSI { 3757}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
      3.000     1.100     1.100 peak  3757 spectrum    1 weight  0.10000E+01 volume  0.19194E-02 ppm1      5.177 ppm2      1.995 CV     1
 OR { 3757}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HG2 ))
 OR { 3757}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB3 ))
 ASSI { 3758}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 80   and name HG2 ))
      1.800     0.400     0.400 peak  3758 spectrum    1 weight  0.10000E+01 volume  0.12329E-01 ppm1      2.400 ppm2      2.012 CV     1
 OR { 3758}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI { 3759}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 82   and name HG2 ))
      4.200     2.200     1.800 peak  3759 spectrum    1 weight  0.10000E+01 volume  0.65332E-03 ppm1      5.185 ppm2      1.464 CV     1
 ASSI { 3760}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HB3 ))
      1.800     0.400     0.400 peak  3760 spectrum    1 weight  0.10000E+01 volume  0.33886E-02 ppm1      1.983 ppm2      1.527 CV     1
 ASSI { 3761}
   (( segid "    " and resid 80   and name HB3 ))
   (( segid "    " and resid 82   and name HG2 ))
      2.400     0.700     0.700 peak  3761 spectrum    1 weight  0.10000E+01 volume  0.33919E-02 ppm1      1.984 ppm2      1.478 CV     1
 ASSI { 3762}
   (( segid "    " and resid 178  and name HB3 ))
   (( segid "    " and resid 178  and name HG3 ))
      3.300     1.300     1.300 peak  3762 spectrum    1 weight  0.10000E+01 volume  0.16384E-02 ppm1      2.003 ppm2      1.521 CV     1
 ASSI { 3763}
   (( segid "    " and resid 80   and name HG3 ))
   (( segid "    " and resid 82   and name HG2 ))
      4.200     2.200     1.800 peak  3763 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      2.401 ppm2      1.470 CV     1
 ASSI { 3767}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 8    and name HG2%)
      3.600     1.600     1.600 peak  3767 spectrum    1 weight  0.10000E+01 volume  0.11848E-02 ppm1      5.177 ppm2      0.727 CV     1
 ASSI { 3768}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 172  and name H   ))
      3.400     1.500     1.500 peak  3768 spectrum    1 weight  0.10000E+01 volume  0.69700E-02 ppm1      0.617 ppm2      8.334 CV     1
 ASSI { 3769}
   (  segid "    " and resid 171  and name HD1%)
   (( segid "    " and resid 171  and name H   ))
      3.500     1.500     1.500 peak  3769 spectrum    1 weight  0.10000E+01 volume  0.63066E-02 ppm1      0.695 ppm2      8.192 CV     1
 ASSI { 3770}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name H   ))
      3.100     1.200     1.200 peak  3770 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      4.405 ppm2      8.445 CV     1
 ASSI { 3771}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 51   and name H   ))
      2.900     1.100     1.100 peak  3771 spectrum    1 weight  0.10000E+01 volume  0.16079E-02 ppm1      1.501 ppm2      8.436 CV     1
 ASSI { 3772}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 52   and name H   ))
      4.100     2.100     1.900 peak  3772 spectrum    1 weight  0.10000E+01 volume  0.74134E-03 ppm1      1.486 ppm2      8.141 CV     1
 ASSI { 3773}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 52   and name H   ))
      4.500     2.500     1.500 peak  3773 spectrum    1 weight  0.10000E+01 volume  0.82595E-03 ppm1      0.943 ppm2      8.144 CV     1
 ASSI { 3775}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 52   and name H   ))
      2.800     1.000     1.000 peak  3775 spectrum    1 weight  0.10000E+01 volume  0.79414E-02 ppm1      0.777 ppm2      8.142 CV     1
 ASSI { 3777}
   (( segid "    " and resid 51   and name HG  ))
   (( segid "    " and resid 52   and name H   ))
      4.400     2.500     1.600 peak  3777 spectrum    1 weight  0.10000E+01 volume  0.11983E-02 ppm1      1.301 ppm2      8.143 CV     1
 ASSI { 3778}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 80   and name H   ))
      4.800     2.900     1.200 peak  3778 spectrum    1 weight  0.10000E+01 volume  0.11239E-02 ppm1      0.776 ppm2      9.159 CV     1
 ASSI { 3779}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 74   and name H   ))
      4.700     2.800     1.300 peak  3779 spectrum    1 weight  0.10000E+01 volume  0.11239E-02 ppm1      0.775 ppm2      8.923 CV     1
 ASSI { 3780}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name H   ))
      3.900     1.900     1.900 peak  3780 spectrum    1 weight  0.10000E+01 volume  0.25422E-02 ppm1      0.777 ppm2      8.438 CV     1
 ASSI { 3781}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 60   and name H   ))
      4.200     2.200     1.800 peak  3781 spectrum    1 weight  0.10000E+01 volume  0.80905E-03 ppm1      0.944 ppm2      7.226 CV     1
 ASSI { 3782}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 60   and name H   ))
      3.500     1.600     1.600 peak  3782 spectrum    1 weight  0.10000E+01 volume  0.23493E-02 ppm1      0.777 ppm2      7.235 CV     1
 ASSI { 3784}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 51   and name HA  ))
      2.700     0.900     0.900 peak  3784 spectrum    1 weight  0.10000E+01 volume  0.14014E-02 ppm1      0.946 ppm2      4.414 CV     1
 ASSI { 3785}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 50   and name HA  ))
      4.800     2.900     1.200 peak  3785 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      1.499 ppm2      4.690 CV     1
 ASSI { 3786}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name HA  ))
      2.900     1.000     1.000 peak  3786 spectrum    1 weight  0.10000E+01 volume  0.94344E-02 ppm1      0.776 ppm2      4.414 CV     1
 ASSI { 3787}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 73   and name HA  ))
      3.900     1.900     1.900 peak  3787 spectrum    1 weight  0.10000E+01 volume  0.15131E-02 ppm1      0.780 ppm2      4.219 CV     1
 ASSI { 3788}
   (( segid "    " and resid 51   and name HG  ))
   (( segid "    " and resid 51   and name HA  ))
      3.600     1.600     1.600 peak  3788 spectrum    1 weight  0.10000E+01 volume  0.12829E-02 ppm1      1.306 ppm2      4.412 CV     1
 ASSI { 3789}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 52   and name HA  ))
      3.700     1.700     1.700 peak  3789 spectrum    1 weight  0.10000E+01 volume  0.13303E-02 ppm1      0.777 ppm2      3.955 CV     1
 ASSI { 3790}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 52   and name HB2 ))
      3.700     1.700     1.700 peak  3790 spectrum    1 weight  0.10000E+01 volume  0.19363E-02 ppm1      0.776 ppm2      3.709 CV     1
 ASSI { 3791}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      4.300     2.300     1.700 peak  3791 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      4.422 ppm2      3.709 CV     1
 ASSI { 3792}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 71   and name HB3 ))
      3.800     1.800     1.800 peak  3792 spectrum    1 weight  0.10000E+01 volume  0.14793E-02 ppm1      0.774 ppm2      3.159 CV     1
 ASSI { 3793}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 77   and name HB2 ))
      3.800     1.800     1.800 peak  3793 spectrum    1 weight  0.10000E+01 volume  0.19329E-02 ppm1      0.776 ppm2      2.804 CV     1
 ASSI { 3794}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 71   and name HB2 ))
      4.400     2.400     1.600 peak  3794 spectrum    1 weight  0.10000E+01 volume  0.14217E-02 ppm1      0.782 ppm2      2.674 CV     1
 ASSI { 3795}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 77   and name HB3 ))
      3.200     1.300     1.300 peak  3795 spectrum    1 weight  0.10000E+01 volume  0.22545E-02 ppm1      0.777 ppm2      2.460 CV     1
 ASSI { 3796}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 51   and name HB3 ))
      1.800     0.400     0.400 peak  3796 spectrum    1 weight  0.10000E+01 volume  0.39843E-02 ppm1      0.945 ppm2      1.498 CV     1
 ASSI { 3798}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 79   and name HG3 ))
      3.500     1.500     1.500 peak  3798 spectrum    1 weight  0.10000E+01 volume  0.59510E-02 ppm1      0.776 ppm2      2.143 CV     1
 OR { 3798}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 3799}
   (( segid "    " and resid 51   and name HG  ))
   (( segid "    " and resid 51   and name HB3 ))
      2.600     0.800     0.800 peak  3799 spectrum    1 weight  0.10000E+01 volume  0.34868E-02 ppm1      1.299 ppm2      1.497 CV     1
 ASSI { 3800}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 51   and name HD2%)
      2.500     0.800     0.800 peak  3800 spectrum    1 weight  0.10000E+01 volume  0.32294E-02 ppm1      4.416 ppm2      0.773 CV     1
 OR { 3800}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI { 3803}
   (( segid "    " and resid 51   and name HB2 ))
   (  segid "    " and resid 51   and name HD2%)
      3.100     1.200     1.200 peak  3803 spectrum    1 weight  0.10000E+01 volume  0.31516E-02 ppm1      0.950 ppm2      0.745 CV     1
 OR { 3803}
   (( segid "    " and resid 51   and name HB2 ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI { 3804}
   (( segid "    " and resid 51   and name HB3 ))
   (  segid "    " and resid 51   and name HD2%)
      3.000     1.100     1.100 peak  3804 spectrum    1 weight  0.10000E+01 volume  0.39403E-02 ppm1      1.507 ppm2      0.725 CV     1
 ASSI { 3805}
   (( segid "    " and resid 51   and name HG  ))
   (( segid "    " and resid 51   and name HB2 ))
      2.300     0.600     0.600 peak  3805 spectrum    1 weight  0.10000E+01 volume  0.31345E-02 ppm1      1.300 ppm2      0.941 CV     1
 ASSI { 3807}
   (( segid "    " and resid 51   and name HG  ))
   (  segid "    " and resid 62   and name HD1%)
      3.300     1.300     1.300 peak  3807 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      1.302 ppm2      0.399 CV     1
 ASSI { 3808}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 62   and name HD1%)
      3.500     1.500     1.500 peak  3808 spectrum    1 weight  0.10000E+01 volume  0.50167E-02 ppm1      0.776 ppm2      0.397 CV     1
 ASSI { 3809}
   (( segid "    " and resid 51   and name HB2 ))
   (  segid "    " and resid 62   and name HD1%)
      3.000     1.100     1.100 peak  3809 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      0.946 ppm2      0.403 CV     1
 ASSI { 3811}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 62   and name HD2%)
      3.300     1.400     1.400 peak  3811 spectrum    1 weight  0.10000E+01 volume  0.57512E-02 ppm1      0.778 ppm2     -0.162 CV     1
 ASSI { 3814}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 84   and name H   ))
      2.300     0.700     0.700 peak  3814 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      4.870 ppm2      8.105 CV     1
 ASSI { 3821}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
      3.300     1.300     1.300 peak  3821 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      4.876 ppm2      2.552 CV     1
 ASSI { 3828}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 132  and name H   ))
      2.400     0.700     0.700 peak  3828 spectrum    1 weight  0.10000E+01 volume  0.26032E-02 ppm1      4.434 ppm2      8.628 CV     1
 ASSI { 3829}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 131  and name HA  ))
      2.600     0.900     0.900 peak  3829 spectrum    1 weight  0.10000E+01 volume  0.11103E-02 ppm1      1.537 ppm2      4.432 CV     1
 ASSI { 3832}
   (  segid "    " and resid -4   and name HG2%)
   (( segid "    " and resid -4   and name HA  ))
      3.300     1.400     1.400 peak  3832 spectrum    1 weight  0.10000E+01 volume  0.16959E-02 ppm1      0.761 ppm2      4.124 CV     1
 ASSI { 3833}
   (( segid "    " and resid -4   and name HA  ))
   (( segid "    " and resid -4   and name HB  ))
      2.600     0.900     0.900 peak  3833 spectrum    1 weight  0.10000E+01 volume  0.45833E-02 ppm1      4.119 ppm2      1.728 CV     1
 ASSI { 3834}
   (( segid "    " and resid -4   and name HA  ))
   (( segid "    " and resid -4   and name HG13))
      3.300     1.400     1.400 peak  3834 spectrum    1 weight  0.10000E+01 volume  0.12491E-02 ppm1      4.117 ppm2      1.341 CV     1
 ASSI { 3835}
   (( segid "    " and resid -4   and name HA  ))
   (( segid "    " and resid -4   and name HG12))
      3.500     1.500     1.500 peak  3835 spectrum    1 weight  0.10000E+01 volume  0.18076E-02 ppm1      4.120 ppm2      1.075 CV     1
 ASSI { 3836}
   (( segid "    " and resid -4   and name HB  ))
   (  segid "    " and resid -4   and name HG2%)
      2.500     0.800     0.800 peak  3836 spectrum    1 weight  0.10000E+01 volume  0.82766E-02 ppm1      1.730 ppm2      0.783 CV     1
 OR { 3836}
   (( segid "    " and resid -4   and name HB  ))
   (  segid "    " and resid -4   and name HD1%)
 ASSI { 3837}
   (( segid "    " and resid -4   and name HB  ))
   (( segid "    " and resid -4   and name HG12))
      3.400     1.400     1.400 peak  3837 spectrum    1 weight  0.10000E+01 volume  0.13337E-02 ppm1      1.724 ppm2      1.076 CV     1
 ASSI { 3838}
   (( segid "    " and resid -4   and name HB  ))
   (( segid "    " and resid -4   and name HG13))
      3.000     1.100     1.100 peak  3838 spectrum    1 weight  0.10000E+01 volume  0.22545E-02 ppm1      1.727 ppm2      1.341 CV     1
 ASSI { 3842}
   (  segid "    " and resid -4   and name HD1%)
   (( segid "    " and resid -3   and name H   ))
      2.300     2.300     3.700 peak  3842 spectrum    1 weight  0.10000E+01 volume  0.17602E-02 ppm1      0.787 ppm2      8.373 CV     1
 ASSI { 3843}
   (( segid "    " and resid 90   and name HG12))
   (( segid "    " and resid 90   and name HA  ))
      3.500     1.600     1.600 peak  3843 spectrum    1 weight  0.10000E+01 volume  0.78874E-03 ppm1      1.104 ppm2      5.047 CV     1
 ASSI { 3844}
   (( segid "    " and resid 90   and name HG13))
   (( segid "    " and resid 90   and name HA  ))
      4.200     2.200     1.800 peak  3844 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      1.203 ppm2      5.042 CV     1
 ASSI { 3847}
   (( segid "    " and resid 90   and name HG12))
   (  segid "    " and resid 92   and name HE% )
      4.800     2.900     1.200 peak  3847 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      1.102 ppm2      1.903 CV     1
 ASSI { 3849}
   (( segid "    " and resid 90   and name HG13))
   (( segid "    " and resid 90   and name HG12))
      1.600     0.300     0.600 peak  3849 spectrum    1 weight  0.10000E+01 volume  0.80430E-02 ppm1      1.205 ppm2      1.107 CV     1
 ASSI { 3851}
   (( segid "    " and resid 90   and name HG13))
   (  segid "    " and resid 92   and name HE% )
      4.500     2.500     1.500 peak  3851 spectrum    1 weight  0.10000E+01 volume  0.83273E-03 ppm1      1.209 ppm2      1.905 CV     1
 ASSI { 3853}
   (( segid "    " and resid 90   and name HG12))
   (  segid "    " and resid 90   and name HD1%)
      2.100     0.500     0.500 peak  3853 spectrum    1 weight  0.10000E+01 volume  0.97355E-02 ppm1      1.107 ppm2      0.636 CV     1
 ASSI { 3855}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 65   and name H   ))
      4.800     2.800     1.200 peak  3855 spectrum    1 weight  0.10000E+01 volume  0.10697E-02 ppm1      2.046 ppm2      8.153 CV     1
 ASSI { 3856}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 64   and name H   ))
      2.400     0.700     0.700 peak  3856 spectrum    1 weight  0.10000E+01 volume  0.54129E-02 ppm1      4.217 ppm2      8.429 CV     1
 ASSI { 3859}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 63   and name H   ))
      3.400     1.500     1.500 peak  3859 spectrum    1 weight  0.10000E+01 volume  0.27826E-02 ppm1      2.283 ppm2      8.483 CV     1
 ASSI { 3860}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 63   and name H   ))
      2.900     1.100     1.100 peak  3860 spectrum    1 weight  0.10000E+01 volume  0.15842E-02 ppm1      2.056 ppm2      8.483 CV     1
 ASSI { 3862}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 65   and name H   ))
      2.600     0.800     0.800 peak  3862 spectrum    1 weight  0.10000E+01 volume  0.15402E-02 ppm1      2.282 ppm2      8.156 CV     1
 ASSI { 3863}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 63   and name HA  ))
      3.100     1.200     1.200 peak  3863 spectrum    1 weight  0.10000E+01 volume  0.53044E-02 ppm1      2.283 ppm2      4.214 CV     1
 ASSI { 3866}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 66   and name H   ))
      5.100     3.300     0.900 peak  3866 spectrum    1 weight  0.10000E+01 volume  0.88012E-03 ppm1      2.058 ppm2      7.475 CV     1
 ASSI { 3867}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 66   and name H   ))
      3.300     1.400     1.400 peak  3867 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      2.281 ppm2      7.467 CV     1
 ASSI { 3868}
   (( segid "    " and resid 186  and name HG3 ))
   (( segid "    " and resid 189  and name H   ))
      5.100     3.300     0.900 peak  3868 spectrum    1 weight  0.10000E+01 volume  0.65671E-03 ppm1      2.390 ppm2      6.932 CV     1
 ASSI { 3869}
   (( segid "    " and resid 63   and name HG2 ))
   (  segid "    " and resid 71   and name HE% )
      4.500     2.500     1.500 peak  3869 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      2.398 ppm2      6.857 CV     1
 ASSI { 3870}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name H   ))
      3.100     1.200     1.200 peak  3870 spectrum    1 weight  0.10000E+01 volume  0.13744E-02 ppm1      4.214 ppm2      8.485 CV     1
 ASSI { 3872}
   (  segid "    " and resid 180  and name HD1%)
   (( segid "    " and resid 179  and name HB  ))
      2.500     2.500     3.500 peak  3872 spectrum    1 weight  0.10000E+01 volume  0.11577E-02 ppm1      0.736 ppm2      4.708 CV     1
 ASSI { 3873}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 63   and name HA  ))
      2.900     1.000     1.000 peak  3873 spectrum    1 weight  0.10000E+01 volume  0.23967E-02 ppm1      2.054 ppm2      4.214 CV     1
 ASSI { 3874}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 64   and name HA  ))
      3.700     1.700     1.700 peak  3874 spectrum    1 weight  0.10000E+01 volume  0.12593E-02 ppm1      2.280 ppm2      3.895 CV     1
 ASSI { 3877}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 63   and name HB2 ))
      1.900     0.400     0.400 peak  3877 spectrum    1 weight  0.10000E+01 volume  0.67568E-02 ppm1      2.057 ppm2      1.924 CV     1
 ASSI { 3878}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 63   and name HG2 ))
      2.700     0.900     0.900 peak  3878 spectrum    1 weight  0.10000E+01 volume  0.23865E-02 ppm1      2.056 ppm2      2.396 CV     1
 ASSI { 3880}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 63   and name HB3 ))
      2.800     0.900     0.900 peak  3880 spectrum    1 weight  0.10000E+01 volume  0.64994E-02 ppm1      2.282 ppm2      2.054 CV     1
 ASSI { 3881}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 63   and name HB2 ))
      2.300     0.700     0.700 peak  3881 spectrum    1 weight  0.10000E+01 volume  0.48542E-02 ppm1      2.282 ppm2      1.921 CV     1
 ASSI { 3887}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 66   and name HB3 ))
      2.800     1.000     1.000 peak  3887 spectrum    1 weight  0.10000E+01 volume  0.18212E-02 ppm1      2.282 ppm2      1.520 CV     1
 ASSI { 3888}
   (( segid "    " and resid 63   and name HB3 ))
   (  segid "    " and resid 64   and name HB% )
      5.400     3.600     0.600 peak  3888 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      2.054 ppm2      1.521 CV     1
 ASSI { 3890}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 86   and name H   ))
      3.700     1.700     1.700 peak  3890 spectrum    1 weight  0.10000E+01 volume  0.61608E-03 ppm1      1.568 ppm2      9.304 CV     1
 ASSI { 3891}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 86   and name H   ))
      4.300     2.300     1.700 peak  3891 spectrum    1 weight  0.10000E+01 volume  0.14319E-02 ppm1      2.071 ppm2      9.313 CV     1
 ASSI { 3892}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 86   and name H   ))
      4.000     2.000     2.000 peak  3892 spectrum    1 weight  0.10000E+01 volume  0.13642E-02 ppm1      1.890 ppm2      9.311 CV     1
 ASSI { 3893}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 84   and name H   ))
      4.000     2.000     2.000 peak  3893 spectrum    1 weight  0.10000E+01 volume  0.72780E-03 ppm1      2.071 ppm2      8.078 CV     1
 ASSI { 3894}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 84   and name H   ))
      3.600     1.600     1.600 peak  3894 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      1.882 ppm2      8.074 CV     1
 ASSI { 3895}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name H   ))
      2.500     0.800     0.800 peak  3895 spectrum    1 weight  0.10000E+01 volume  0.34563E-02 ppm1      2.073 ppm2      7.126 CV     1
 ASSI { 3897}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name H   ))
      2.200     0.600     0.600 peak  3897 spectrum    1 weight  0.10000E+01 volume  0.37912E-02 ppm1      1.887 ppm2      7.125 CV     1
 ASSI { 3903}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HA  ))
      2.600     0.900     0.900 peak  3903 spectrum    1 weight  0.10000E+01 volume  0.29384E-02 ppm1      1.887 ppm2      4.686 CV     1
 ASSI { 3904}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 46   and name HA  ))
      3.700     1.700     1.700 peak  3904 spectrum    1 weight  0.10000E+01 volume  0.12999E-02 ppm1      1.886 ppm2      4.477 CV     1
 ASSI { 3905}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name HA  ))
      3.500     1.500     1.500 peak  3905 spectrum    1 weight  0.10000E+01 volume  0.24745E-02 ppm1      2.072 ppm2      4.688 CV     1
 ASSI { 3906}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 46   and name HA  ))
      4.100     2.100     1.900 peak  3906 spectrum    1 weight  0.10000E+01 volume  0.11408E-02 ppm1      2.073 ppm2      4.474 CV     1
 ASSI { 3907}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 103  and name HA  ))
      3.200     1.300     1.300 peak  3907 spectrum    1 weight  0.10000E+01 volume  0.10731E-02 ppm1      1.876 ppm2      4.183 CV     1
 ASSI { 3908}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 103  and name HA  ))
      4.400     2.400     1.600 peak  3908 spectrum    1 weight  0.10000E+01 volume  0.10968E-02 ppm1      2.071 ppm2      4.171 CV     1
 ASSI { 3913}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 101  and name HE% )
      2.600     0.900     0.900 peak  3913 spectrum    1 weight  0.10000E+01 volume  0.18246E-02 ppm1      1.566 ppm2      1.749 CV     1
 ASSI { 3914}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name HG2 ))
      1.400     0.300     0.800 peak  3914 spectrum    1 weight  0.10000E+01 volume  0.19759E-01 ppm1      2.072 ppm2      1.887 CV     1
 ASSI { 3916}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HB2 ))
      2.500     0.800     0.800 peak  3916 spectrum    1 weight  0.10000E+01 volume  0.54230E-02 ppm1      1.889 ppm2      1.557 CV     1
 ASSI { 3917}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name HB2 ))
      1.900     0.500     0.500 peak  3917 spectrum    1 weight  0.10000E+01 volume  0.66314E-02 ppm1      2.073 ppm2      1.555 CV     1
 ASSI { 3918}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name HB3 ))
      2.500     0.800     0.800 peak  3918 spectrum    1 weight  0.10000E+01 volume  0.57615E-02 ppm1      2.076 ppm2      1.617 CV     1
 ASSI { 3919}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HB3 ))
      2.400     0.700     0.700 peak  3919 spectrum    1 weight  0.10000E+01 volume  0.48645E-02 ppm1      1.889 ppm2      1.614 CV     1
 ASSI { 3921}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 84   and name HB2 ))
      3.300     1.400     1.400 peak  3921 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      1.885 ppm2      1.149 CV     1
 ASSI { 3922}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 83   and name HG2 ))
      2.900     1.100     1.100 peak  3922 spectrum    1 weight  0.10000E+01 volume  0.16553E-02 ppm1      2.077 ppm2      0.915 CV     1
 OR { 3922}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 83   and name HG3 ))
 ASSI { 3923}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 83   and name HG2 ))
      3.700     1.700     1.700 peak  3923 spectrum    1 weight  0.10000E+01 volume  0.13574E-02 ppm1      1.887 ppm2      0.925 CV     1
 OR { 3923}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 83   and name HG3 ))
 ASSI { 3924}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 84   and name HB2 ))
      4.200     2.200     1.800 peak  3924 spectrum    1 weight  0.10000E+01 volume  0.83611E-03 ppm1      2.068 ppm2      1.145 CV     1
 ASSI { 3925}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 83   and name HG2 ))
      4.300     2.300     1.700 peak  3925 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      1.613 ppm2      0.935 CV     1
 ASSI { 3926}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 46   and name HB3 ))
      3.200     1.300     1.300 peak  3926 spectrum    1 weight  0.10000E+01 volume  0.13270E-02 ppm1      1.886 ppm2      2.626 CV     1
 ASSI { 3927}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name H   ))
      3.000     1.100     1.100 peak  3927 spectrum    1 weight  0.10000E+01 volume  0.12525E-02 ppm1      4.806 ppm2      9.307 CV     1
 ASSI { 3928}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 86   and name H   ))
      2.600     0.800     0.800 peak  3928 spectrum    1 weight  0.10000E+01 volume  0.69395E-03 ppm1      1.508 ppm2      9.316 CV     1
 ASSI { 3929}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name H   ))
      4.700     2.800     1.300 peak  3929 spectrum    1 weight  0.10000E+01 volume  0.64655E-03 ppm1      1.456 ppm2      9.312 CV     1
 ASSI { 3930}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 86   and name HE  ))
      4.400     2.400     1.600 peak  3930 spectrum    1 weight  0.10000E+01 volume  0.59238E-03 ppm1      1.508 ppm2      7.382 CV     1
 ASSI { 3931}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 104  and name H   ))
      5.000     3.100     1.000 peak  3931 spectrum    1 weight  0.10000E+01 volume  0.57887E-03 ppm1      2.904 ppm2      8.379 CV     1
 ASSI { 3935}
   (( segid "    " and resid 86   and name HB3 ))
   (( segid "    " and resid 86   and name HA  ))
      3.000     1.200     1.200 peak  3935 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      1.811 ppm2      4.802 CV     1
 OR { 3935}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 3936}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HD3 ))
      1.800     0.400     0.400 peak  3936 spectrum    1 weight  0.10000E+01 volume  0.47865E-02 ppm1      2.979 ppm2      2.910 CV     1
 ASSI { 3937}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 86   and name HD2 ))
      2.700     0.900     0.900 peak  3937 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      1.495 ppm2      2.974 CV     1
 ASSI { 3938}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 86   and name HD3 ))
      3.000     1.100     1.100 peak  3938 spectrum    1 weight  0.10000E+01 volume  0.88012E-03 ppm1      1.517 ppm2      2.914 CV     1
 ASSI { 3939}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 104  and name HB2 ))
      3.200     1.300     1.300 peak  3939 spectrum    1 weight  0.10000E+01 volume  0.68379E-03 ppm1      1.449 ppm2      2.622 CV     1
 ASSI { 3940}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name HG3 ))
      2.900     1.000     1.000 peak  3940 spectrum    1 weight  0.10000E+01 volume  0.17467E-02 ppm1      2.909 ppm2      1.483 CV     1
 OR { 3940}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name HG2 ))
 ASSI { 3941}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HG2 ))
      2.600     0.800     0.800 peak  3941 spectrum    1 weight  0.10000E+01 volume  0.19363E-02 ppm1      2.983 ppm2      1.474 CV     1
 OR { 3941}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HG3 ))
 ASSI { 3942}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name HB2 ))
      3.400     1.500     1.500 peak  3942 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      2.903 ppm2      1.808 CV     1
 OR { 3942}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name HB3 ))
 ASSI { 3943}
   (( segid "    " and resid 86   and name HD3 ))
   (  segid "    " and resid 101  and name HE% )
      4.000     2.000     2.000 peak  3943 spectrum    1 weight  0.10000E+01 volume  0.69395E-03 ppm1      2.896 ppm2      1.726 CV     1
 ASSI { 3944}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HG3 ))
      3.500     1.500     1.500 peak  3944 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      4.819 ppm2      1.511 CV     1
 ASSI { 3945}
   (( segid "    " and resid 86   and name HG3 ))
   (  segid "    " and resid 102  and name HG2%)
      4.000     2.000     2.000 peak  3945 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      1.487 ppm2      0.741 CV     1
 OR { 3945}
   (( segid "    " and resid 86   and name HG3 ))
   (  segid "    " and resid 102  and name HG1%)
 ASSI { 3946}
   (( segid "    " and resid 86   and name HD3 ))
   (  segid "    " and resid 102  and name HG2%)
      3.000     1.100     1.100 peak  3946 spectrum    1 weight  0.10000E+01 volume  0.23594E-02 ppm1      2.909 ppm2      0.728 CV     1
 OR { 3946}
   (( segid "    " and resid 86   and name HD3 ))
   (  segid "    " and resid 102  and name HG1%)
 ASSI { 3948}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name H   ))
      3.500     1.500     1.500 peak  3948 spectrum    1 weight  0.10000E+01 volume  0.22917E-02 ppm1      4.168 ppm2      9.273 CV     1
 ASSI { 3949}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 54   and name H   ))
      2.800     0.900     0.900 peak  3949 spectrum    1 weight  0.10000E+01 volume  0.61303E-02 ppm1      2.540 ppm2      8.262 CV     1
 ASSI { 3951}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 55   and name H   ))
      2.600     0.800     0.800 peak  3951 spectrum    1 weight  0.10000E+01 volume  0.26438E-02 ppm1      2.542 ppm2      9.272 CV     1
 ASSI { 3953}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name H   ))
      2.200     0.600     0.600 peak  3953 spectrum    1 weight  0.10000E+01 volume  0.69971E-02 ppm1      4.127 ppm2      8.275 CV     1
 ASSI { 3956}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 55   and name H   ))
      3.900     1.900     1.900 peak  3956 spectrum    1 weight  0.10000E+01 volume  0.22714E-02 ppm1      2.453 ppm2      9.267 CV     1
 ASSI { 3958}
   (( segid "    " and resid 197  and name HB2 ))
   (( segid "    " and resid 197  and name H   ))
      2.700     0.900     0.900 peak  3958 spectrum    1 weight  0.10000E+01 volume  0.15741E-02 ppm1      2.424 ppm2      7.549 CV     1
 ASSI { 3959}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 55   and name HA  ))
      4.400     2.400     1.600 peak  3959 spectrum    1 weight  0.10000E+01 volume  0.62624E-03 ppm1      2.535 ppm2      4.940 CV     1
 ASSI { 3962}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 53   and name HA  ))
      3.800     1.800     1.800 peak  3962 spectrum    1 weight  0.10000E+01 volume  0.14285E-02 ppm1      4.166 ppm2      4.582 CV     1
 ASSI { 3963}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 54   and name HA  ))
      2.700     0.900     0.900 peak  3963 spectrum    1 weight  0.10000E+01 volume  0.86456E-02 ppm1      2.543 ppm2      4.168 CV     1
 ASSI { 3965}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 54   and name HB2 ))
      1.600     0.300     0.600 peak  3965 spectrum    1 weight  0.10000E+01 volume  0.26303E-01 ppm1      2.542 ppm2      2.453 CV     1
 ASSI { 3970}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 137  and name HB2 ))
      4.200     2.200     1.800 peak  3970 spectrum    1 weight  0.10000E+01 volume  0.13947E-02 ppm1      4.129 ppm2      1.685 CV     1
 ASSI { 3971}
   (( segid "    " and resid 197  and name HB2 ))
   (( segid "    " and resid 126  and name HB3 ))
      2.700     0.900     0.900 peak  3971 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      2.442 ppm2      2.106 CV     1
 ASSI { 3973}
   (( segid "    " and resid 197  and name HB2 ))
   (( segid "    " and resid 126  and name HB2 ))
      3.000     1.100     1.100 peak  3973 spectrum    1 weight  0.10000E+01 volume  0.14454E-02 ppm1      2.440 ppm2      1.811 CV     1
 ASSI { 3974}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 58   and name H   ))
      3.200     1.300     1.300 peak  3974 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      2.879 ppm2      8.047 CV     1
 ASSI { 3975}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 68   and name HA  ))
      3.900     1.900     1.900 peak  3975 spectrum    1 weight  0.10000E+01 volume  0.76166E-03 ppm1      4.865 ppm2      3.914 CV     1
 ASSI { 3976}
   (( segid "    " and resid 15   and name HD3 ))
   (( segid "    " and resid 15   and name HA  ))
      2.100     0.600     0.600 peak  3976 spectrum    1 weight  0.10000E+01 volume  0.39809E-02 ppm1      1.676 ppm2      4.684 CV     1
 ASSI { 3977}
   (( segid "    " and resid 15   and name HD2 ))
   (( segid "    " and resid 15   and name HA  ))
      3.100     1.200     1.200 peak  3977 spectrum    1 weight  0.10000E+01 volume  0.44107E-02 ppm1      1.582 ppm2      4.689 CV     1
 ASSI { 3978}
   (( segid "    " and resid 81   and name HB3 ))
   (( segid "    " and resid 82   and name H   ))
      4.600     2.600     1.400 peak  3978 spectrum    1 weight  0.10000E+01 volume  0.56532E-03 ppm1      3.104 ppm2      8.667 CV     1
 ASSI { 3979}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 49   and name HB3 ))
      4.000     2.000     2.000 peak  3979 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      5.417 ppm2      1.288 CV     1
 ASSI { 3980}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 82   and name HG2 ))
      4.100     2.100     1.900 peak  3980 spectrum    1 weight  0.10000E+01 volume  0.68379E-03 ppm1      5.419 ppm2      1.472 CV     1
 ASSI { 3983}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 118  and name H   ))
      3.200     1.300     1.300 peak  3983 spectrum    1 weight  0.10000E+01 volume  0.35002E-02 ppm1      1.893 ppm2      7.673 CV     1
 ASSI { 3984}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 118  and name H   ))
      3.100     1.200     1.200 peak  3984 spectrum    1 weight  0.10000E+01 volume  0.44073E-02 ppm1      3.157 ppm2      7.673 CV     1
 ASSI { 3986}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 118  and name H   ))
      3.200     1.300     1.300 peak  3986 spectrum    1 weight  0.10000E+01 volume  0.34798E-02 ppm1      1.776 ppm2      7.672 CV     1
 ASSI { 3987}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 117  and name H   ))
      5.300     3.500     0.700 peak  3987 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      1.774 ppm2      7.782 CV     1
 ASSI { 3988}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 119  and name H   ))
      3.900     1.900     1.900 peak  3988 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      1.776 ppm2      7.463 CV     1
 ASSI { 3989}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 119  and name H   ))
      4.300     2.300     1.700 peak  3989 spectrum    1 weight  0.10000E+01 volume  0.16452E-02 ppm1      3.158 ppm2      7.457 CV     1
 ASSI { 3990}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 119  and name H   ))
      3.600     1.600     1.600 peak  3990 spectrum    1 weight  0.10000E+01 volume  0.14387E-02 ppm1      1.899 ppm2      7.460 CV     1
 ASSI { 3991}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 120  and name H   ))
      3.400     1.400     1.400 peak  3991 spectrum    1 weight  0.10000E+01 volume  0.10122E-02 ppm1      4.097 ppm2      7.552 CV     1
 ASSI { 3994}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name H   ))
      2.800     1.000     1.000 peak  3994 spectrum    1 weight  0.10000E+01 volume  0.22105E-02 ppm1      4.110 ppm2      8.629 CV     1
 ASSI { 3995}
   (( segid "    " and resid 91   and name HD3 ))
   (( segid "    " and resid 95   and name HA2 ))
      3.000     1.200     1.200 peak  3995 spectrum    1 weight  0.10000E+01 volume  0.16012E-02 ppm1      3.158 ppm2      4.288 CV     1
 ASSI { 3996}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 118  and name HA  ))
      2.000     0.500     0.500 peak  3996 spectrum    1 weight  0.10000E+01 volume  0.17508E-01 ppm1      3.157 ppm2      4.104 CV     1
 OR { 3996}
   (( segid "    " and resid 118  and name HD2 ))
   (( segid "    " and resid 118  and name HA  ))
 ASSI { 3997}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 118  and name HA  ))
      3.500     1.500     1.500 peak  3997 spectrum    1 weight  0.10000E+01 volume  0.34258E-02 ppm1      1.775 ppm2      4.104 CV     1
 ASSI { 3998}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 115  and name HA  ))
      4.000     2.000     2.000 peak  3998 spectrum    1 weight  0.10000E+01 volume  0.89028E-03 ppm1      1.954 ppm2      3.370 CV     1
 ASSI { 4001}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 115  and name HA  ))
      2.800     1.000     1.000 peak  4001 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      1.773 ppm2      3.361 CV     1
 ASSI { 4002}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HD3 ))
      3.200     1.300     1.300 peak  4002 spectrum    1 weight  0.10000E+01 volume  0.58732E-02 ppm1      4.105 ppm2      3.154 CV     1
 ASSI { 4006}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 118  and name HB2 ))
      2.000     0.500     0.500 peak  4006 spectrum    1 weight  0.10000E+01 volume  0.62456E-02 ppm1      1.776 ppm2      1.905 CV     1
 OR { 4006}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 4007}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 118  and name HB2 ))
      2.000     0.500     0.500 peak  4007 spectrum    1 weight  0.10000E+01 volume  0.54907E-02 ppm1      1.774 ppm2      1.953 CV     1
 ASSI { 4008}
   (( segid "    " and resid 118  and name HG2 ))
   (( segid "    " and resid 118  and name HB2 ))
      2.000     0.500     0.500 peak  4008 spectrum    1 weight  0.10000E+01 volume  0.65503E-02 ppm1      1.636 ppm2      1.955 CV     1
 ASSI { 4009}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 118  and name HB3 ))
      2.300     0.700     0.700 peak  4009 spectrum    1 weight  0.10000E+01 volume  0.10446E-01 ppm1      3.156 ppm2      1.899 CV     1
 OR { 4009}
   (( segid "    " and resid 118  and name HD2 ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 4010}
   (( segid "    " and resid 118  and name HD2 ))
   (( segid "    " and resid 118  and name HG3 ))
      1.900     0.400     0.400 peak  4010 spectrum    1 weight  0.10000E+01 volume  0.15592E-01 ppm1      3.156 ppm2      1.773 CV     1
 OR { 4010}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 118  and name HG3 ))
 ASSI { 4011}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 118  and name HB2 ))
      2.800     1.000     1.000 peak  4011 spectrum    1 weight  0.10000E+01 volume  0.89400E-02 ppm1      3.158 ppm2      1.949 CV     1
 OR { 4011}
   (( segid "    " and resid 118  and name HD2 ))
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 4014}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 118  and name HG3 ))
      2.100     0.500     0.500 peak  4014 spectrum    1 weight  0.10000E+01 volume  0.58021E-02 ppm1      1.898 ppm2      1.790 CV     1
 ASSI { 4016}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HG2 ))
      3.000     1.100     1.100 peak  4016 spectrum    1 weight  0.10000E+01 volume  0.29619E-02 ppm1      4.106 ppm2      1.628 CV     1
 ASSI { 4017}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 117  and name HB% )
      3.400     1.500     1.500 peak  4017 spectrum    1 weight  0.10000E+01 volume  0.21326E-02 ppm1      4.109 ppm2      1.426 CV     1
 ASSI { 4019}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 118  and name HG2 ))
      2.600     0.900     0.900 peak  4019 spectrum    1 weight  0.10000E+01 volume  0.41026E-02 ppm1      1.895 ppm2      1.631 CV     1
 ASSI { 4020}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 118  and name HG2 ))
      1.700     0.400     0.500 peak  4020 spectrum    1 weight  0.10000E+01 volume  0.16837E-01 ppm1      3.156 ppm2      1.633 CV     1
 OR { 4020}
   (( segid "    " and resid 118  and name HD2 ))
   (( segid "    " and resid 118  and name HG2 ))
 ASSI { 4021}
   (( segid "    " and resid 118  and name HG3 ))
   (( segid "    " and resid 118  and name HG2 ))
      1.400     0.200     0.800 peak  4021 spectrum    1 weight  0.10000E+01 volume  0.15175E-01 ppm1      1.777 ppm2      1.634 CV     1
 ASSI { 4022}
   (( segid "    " and resid 91   and name HD3 ))
   (( segid "    " and resid 91   and name HG3 ))
      2.800     1.000     1.000 peak  4022 spectrum    1 weight  0.10000E+01 volume  0.29857E-02 ppm1      3.160 ppm2      1.424 CV     1
 OR { 4022}
   (( segid "    " and resid 91   and name HD3 ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI { 4023}
   (( segid "    " and resid 118  and name HD2 ))
   (( segid "    " and resid 100  and name HG12))
      4.000     2.000     2.000 peak  4023 spectrum    1 weight  0.10000E+01 volume  0.18212E-02 ppm1      3.157 ppm2      1.257 CV     1
 OR { 4023}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 100  and name HG12))
 ASSI { 4024}
   (( segid "    " and resid 118  and name HD2 ))
   (  segid "    " and resid 114  and name HG2%)
      2.600     0.800     0.800 peak  4024 spectrum    1 weight  0.10000E+01 volume  0.44311E-02 ppm1      3.157 ppm2      1.163 CV     1
 OR { 4024}
   (( segid "    " and resid 118  and name HD3 ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 4025}
   (( segid "    " and resid 118  and name HD2 ))
   (( segid "    " and resid 100  and name HG13))
      2.700     0.900     0.900 peak  4025 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      3.156 ppm2      1.072 CV     1
 OR { 4025}
   (( segid "    " and resid 118  and name HD3 ))
   (( segid "    " and resid 100  and name HG13))
 ASSI { 4026}
   (( segid "    " and resid 132  and name HA  ))
   (  segid "    " and resid 192  and name HD1%)
      3.900     1.900     1.900 peak  4026 spectrum    1 weight  0.10000E+01 volume  0.35240E-02 ppm1      4.110 ppm2      0.713 CV     1
 ASSI { 4029}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 119  and name HD1%)
      2.400     0.700     0.700 peak  4029 spectrum    1 weight  0.10000E+01 volume  0.20852E-02 ppm1      1.954 ppm2      0.639 CV     1
 ASSI { 4030}
   (( segid "    " and resid 118  and name HB3 ))
   (  segid "    " and resid 100  and name HG2%)
      4.200     2.200     1.800 peak  4030 spectrum    1 weight  0.10000E+01 volume  0.23527E-02 ppm1      1.892 ppm2      0.641 CV     1
 OR { 4030}
   (( segid "    " and resid 118  and name HB3 ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 4032}
   (( segid "    " and resid 118  and name HD2 ))
   (  segid "    " and resid 100  and name HD1%)
      3.200     1.300     1.300 peak  4032 spectrum    1 weight  0.10000E+01 volume  0.73356E-02 ppm1      3.157 ppm2      0.681 CV     1
 ASSI { 4033}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
      2.500     0.800     0.800 peak  4033 spectrum    1 weight  0.10000E+01 volume  0.38522E-02 ppm1      3.587 ppm2      1.902 CV     1
 ASSI { 4036}
   (  segid "    " and resid 101  and name HE% )
   (  segid "    " and resid 102  and name HG2%)
      4.000     2.000     2.000 peak  4036 spectrum    1 weight  0.10000E+01 volume  0.34765E-02 ppm1      1.749 ppm2      0.732 CV     1
 ASSI { 4037}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name HB2 ))
      1.800     0.400     0.400 peak  4037 spectrum    1 weight  0.10000E+01 volume  0.92786E-02 ppm1      1.746 ppm2      1.899 CV     1
 OR { 4037}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 4038}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name HB2 ))
      1.900     0.500     0.500 peak  4038 spectrum    1 weight  0.10000E+01 volume  0.49356E-02 ppm1      1.747 ppm2      1.903 CV     1
 ASSI { 4040}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 101  and name HG3 ))
      2.200     0.600     0.600 peak  4040 spectrum    1 weight  0.10000E+01 volume  0.13805E-01 ppm1      1.748 ppm2      2.498 CV     1
 ASSI { 4041}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 101  and name HG2 ))
      2.700     0.900     0.900 peak  4041 spectrum    1 weight  0.10000E+01 volume  0.11415E-01 ppm1      1.748 ppm2      2.444 CV     1
 ASSI { 4042}
   (  segid "    " and resid 113  and name HE% )
   (( segid "    " and resid 113  and name HG3 ))
      2.900     1.100     1.100 peak  4042 spectrum    1 weight  0.10000E+01 volume  0.40148E-02 ppm1      1.743 ppm2      2.315 CV     1
 ASSI { 4046}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name HG3 ))
      3.100     1.200     1.200 peak  4046 spectrum    1 weight  0.10000E+01 volume  0.35103E-02 ppm1      1.749 ppm2      2.300 CV     1
 ASSI { 4047}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 113  and name HG3 ))
      1.900     0.500     0.500 peak  4047 spectrum    1 weight  0.10000E+01 volume  0.10111E-01 ppm1      1.744 ppm2      2.300 CV     1
 OR { 4047}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name HG3 ))
 ASSI { 4050}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 113  and name HA  ))
      3.200     1.200     1.200 peak  4050 spectrum    1 weight  0.10000E+01 volume  0.22105E-02 ppm1      1.746 ppm2      3.588 CV     1
 OR { 4050}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name HA  ))
 ASSI { 4051}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 87   and name HD2 ))
      3.200     1.300     1.300 peak  4051 spectrum    1 weight  0.10000E+01 volume  0.54163E-02 ppm1      1.749 ppm2      3.645 CV     1
 ASSI { 4052}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 87   and name HD3 ))
      2.100     0.600     0.600 peak  4052 spectrum    1 weight  0.10000E+01 volume  0.81918E-02 ppm1      1.749 ppm2      3.513 CV     1
 ASSI { 4053}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 83   and name HE3 ))
      2.500     0.800     0.800 peak  4053 spectrum    1 weight  0.10000E+01 volume  0.30873E-02 ppm1      1.748 ppm2      2.783 CV     1
 ASSI { 4054}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 100  and name HA  ))
      2.200     2.200     3.800 peak  4054 spectrum    1 weight  0.10000E+01 volume  0.22849E-02 ppm1      1.748 ppm2      4.268 CV     1
 ASSI { 4057}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 85   and name HE21))
      4.800     2.800     1.200 peak  4057 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      1.750 ppm2      6.469 CV     1
 ASSI { 4058}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 85   and name HE22))
      4.800     2.900     1.200 peak  4058 spectrum    1 weight  0.10000E+01 volume  0.16756E-02 ppm1      1.750 ppm2      7.286 CV     1
 ASSI { 4059}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 85   and name H   ))
      3.500     1.600     1.600 peak  4059 spectrum    1 weight  0.10000E+01 volume  0.26980E-02 ppm1      1.752 ppm2      7.124 CV     1
 ASSI { 4062}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 114  and name H   ))
      4.600     2.600     1.400 peak  4062 spectrum    1 weight  0.10000E+01 volume  0.98846E-03 ppm1      2.306 ppm2      7.465 CV     1
 ASSI { 4063}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name H   ))
      3.700     1.700     1.700 peak  4063 spectrum    1 weight  0.10000E+01 volume  0.73796E-03 ppm1      1.749 ppm2      7.643 CV     1
 ASSI { 4064}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name H   ))
      3.300     1.300     1.300 peak  4064 spectrum    1 weight  0.10000E+01 volume  0.19261E-02 ppm1      1.746 ppm2      7.642 CV     1
 OR { 4064}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 113  and name H   ))
 ASSI { 4065}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 86   and name H   ))
      2.600     0.900     0.900 peak  4065 spectrum    1 weight  0.10000E+01 volume  0.39910E-02 ppm1      1.749 ppm2      9.317 CV     1
 ASSI { 4066}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 88   and name H   ))
      3.400     1.500     1.500 peak  4066 spectrum    1 weight  0.10000E+01 volume  0.24745E-02 ppm1      1.747 ppm2      9.018 CV     1
 ASSI { 4067}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 102  and name H   ))
      2.900     1.100     1.100 peak  4067 spectrum    1 weight  0.10000E+01 volume  0.45937E-02 ppm1      1.748 ppm2      8.819 CV     1
 ASSI { 4068}
   (( segid "    " and resid 87   and name HB3 ))
   (( segid "    " and resid 88   and name H   ))
      4.500     2.500     1.500 peak  4068 spectrum    1 weight  0.10000E+01 volume  0.11475E-02 ppm1      1.918 ppm2      9.011 CV     1
 ASSI { 4069}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 101  and name H   ))
      3.600     1.600     1.600 peak  4069 spectrum    1 weight  0.10000E+01 volume  0.44445E-02 ppm1      1.749 ppm2      8.323 CV     1
 ASSI { 4070}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.300     0.700     0.700 peak  4070 spectrum    1 weight  0.10000E+01 volume  0.12173E-01 ppm1      4.651 ppm2      2.845 CV     1
 OR { 4070}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB3 ))
 ASSI { 4072}
   (( segid "    " and resid 183  and name HA  ))
   (( segid "    " and resid 183  and name H   ))
      2.900     1.000     1.000 peak  4072 spectrum    1 weight  0.10000E+01 volume  0.25084E-02 ppm1      4.493 ppm2      7.162 CV     1
 ASSI { 4073}
   (( segid "    " and resid 183  and name HB2 ))
   (( segid "    " and resid 183  and name H   ))
      3.000     1.100     1.100 peak  4073 spectrum    1 weight  0.10000E+01 volume  0.92075E-03 ppm1      2.161 ppm2      7.164 CV     1
 ASSI { 4076}
   (( segid "    " and resid 183  and name HG2 ))
   (( segid "    " and resid 183  and name HE21))
      3.400     1.400     1.400 peak  4076 spectrum    1 weight  0.10000E+01 volume  0.90382E-03 ppm1      2.237 ppm2      6.512 CV     1
 ASSI { 4077}
   (( segid "    " and resid 183  and name HG3 ))
   (( segid "    " and resid 183  and name HE21))
      3.200     1.200     1.200 peak  4077 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      2.515 ppm2      6.488 CV     1
 ASSI { 4078}
   (( segid "    " and resid 183  and name HA  ))
   (( segid "    " and resid 183  and name HE21))
      5.000     3.100     1.000 peak  4078 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      4.504 ppm2      6.497 CV     1
 ASSI { 4079}
   (( segid "    " and resid 183  and name HA  ))
   (( segid "    " and resid 184  and name H   ))
      3.200     1.300     1.300 peak  4079 spectrum    1 weight  0.10000E+01 volume  0.16587E-02 ppm1      4.494 ppm2      7.707 CV     1
 ASSI { 4084}
   (( segid "    " and resid 183  and name HG2 ))
   (( segid "    " and resid 183  and name HG3 ))
      2.300     0.600     0.600 peak  4084 spectrum    1 weight  0.10000E+01 volume  0.20344E-02 ppm1      2.250 ppm2      2.540 CV     1
 ASSI { 4087}
   (( segid "    " and resid 183  and name HG2 ))
   (( segid "    " and resid 183  and name HB3 ))
      2.900     1.000     1.000 peak  4087 spectrum    1 weight  0.10000E+01 volume  0.13608E-02 ppm1      2.255 ppm2      2.062 CV     1
 ASSI { 4088}
   (( segid "    " and resid 183  and name HB2 ))
   (( segid "    " and resid 183  and name HG3 ))
      3.200     1.300     1.300 peak  4088 spectrum    1 weight  0.10000E+01 volume  0.82257E-03 ppm1      2.155 ppm2      2.534 CV     1
 ASSI { 4089}
   (( segid "    " and resid 183  and name HB3 ))
   (( segid "    " and resid 183  and name HG3 ))
      3.500     1.500     1.500 peak  4089 spectrum    1 weight  0.10000E+01 volume  0.14454E-02 ppm1      2.049 ppm2      2.531 CV     1
 ASSI { 4090}
   (( segid "    " and resid 183  and name HA  ))
   (( segid "    " and resid 183  and name HG3 ))
      3.100     1.200     1.200 peak  4090 spectrum    1 weight  0.10000E+01 volume  0.24440E-02 ppm1      4.494 ppm2      2.542 CV     1
 ASSI { 4091}
   (( segid "    " and resid 183  and name HA  ))
   (( segid "    " and resid 183  and name HB2 ))
      3.000     1.100     1.100 peak  4091 spectrum    1 weight  0.10000E+01 volume  0.35847E-02 ppm1      4.494 ppm2      2.167 CV     1
 ASSI { 4092}
   (( segid "    " and resid 183  and name HA  ))
   (( segid "    " and resid 183  and name HB3 ))
      2.600     0.900     0.900 peak  4092 spectrum    1 weight  0.10000E+01 volume  0.32428E-02 ppm1      4.493 ppm2      2.065 CV     1
 ASSI { 4093}
   (( segid "    " and resid 183  and name HA  ))
   (( segid "    " and resid 183  and name HG2 ))
      2.800     1.000     1.000 peak  4093 spectrum    1 weight  0.10000E+01 volume  0.29213E-02 ppm1      4.492 ppm2      2.247 CV     1
 ASSI { 4095}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 91   and name HE  ))
      3.000     1.100     1.100 peak  4095 spectrum    1 weight  0.10000E+01 volume  0.35679E-02 ppm1      0.696 ppm2      7.892 CV     1
 ASSI { 4096}
   (( segid "    " and resid 193  and name HG  ))
   (( segid "    " and resid 193  and name H   ))
      3.700     1.700     1.700 peak  4096 spectrum    1 weight  0.10000E+01 volume  0.10934E-02 ppm1      1.368 ppm2      7.893 CV     1
 ASSI { 4097}
   (( segid "    " and resid 192  and name HG  ))
   (( segid "    " and resid 192  and name H   ))
      2.600     0.900     0.900 peak  4097 spectrum    1 weight  0.10000E+01 volume  0.17839E-02 ppm1      1.368 ppm2      9.086 CV     1
 ASSI { 4098}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 192  and name H   ))
      3.200     1.300     1.300 peak  4098 spectrum    1 weight  0.10000E+01 volume  0.35475E-02 ppm1      0.697 ppm2      9.089 CV     1
 ASSI { 4100}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 128  and name H   ))
      3.300     1.400     1.400 peak  4100 spectrum    1 weight  0.10000E+01 volume  0.30500E-02 ppm1      0.735 ppm2      8.851 CV     1
 ASSI { 4105}
   (( segid "    " and resid 192  and name HB3 ))
   (( segid "    " and resid 192  and name HA  ))
      2.800     1.000     1.000 peak  4105 spectrum    1 weight  0.10000E+01 volume  0.10392E-02 ppm1      1.540 ppm2      4.707 CV     1
 ASSI { 4107}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 75   and name HB2 ))
      4.100     2.100     1.900 peak  4107 spectrum    1 weight  0.10000E+01 volume  0.18280E-02 ppm1      0.696 ppm2      2.605 CV     1
 ASSI { 4110}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 192  and name HG  ))
      1.700     0.400     0.500 peak  4110 spectrum    1 weight  0.10000E+01 volume  0.37439E-01 ppm1      0.696 ppm2      1.365 CV     1
 ASSI { 4111}
   (( segid "    " and resid 193  and name HG  ))
   (( segid "    " and resid 193  and name HB3 ))
      3.400     1.400     1.400 peak  4111 spectrum    1 weight  0.10000E+01 volume  0.12491E-02 ppm1      1.377 ppm2      1.826 CV     1
 ASSI { 4112}
   (( segid "    " and resid 192  and name HG  ))
   (( segid "    " and resid 192  and name HB3 ))
      2.800     1.000     1.000 peak  4112 spectrum    1 weight  0.10000E+01 volume  0.36628E-02 ppm1      1.370 ppm2      1.537 CV     1
 ASSI { 4113}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name HG  ))
      1.900     0.500     0.500 peak  4113 spectrum    1 weight  0.10000E+01 volume  0.18652E-01 ppm1      0.777 ppm2      1.300 CV     1
 ASSI { 4116}
   (( segid "    " and resid 192  and name HG  ))
   (  segid "    " and resid 130  and name HG2%)
      3.700     1.800     1.800 peak  4116 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      1.363 ppm2      0.486 CV     1
 ASSI { 4117}
   (( segid "    " and resid 192  and name HB2 ))
   (  segid "    " and resid 192  and name HD2%)
      3.100     1.200     1.200 peak  4117 spectrum    1 weight  0.10000E+01 volume  0.21902E-02 ppm1      1.405 ppm2      0.705 CV     1
 OR { 4117}
   (( segid "    " and resid 192  and name HB2 ))
   (  segid "    " and resid 192  and name HD1%)
 ASSI { 4118}
   (( segid "    " and resid 191  and name HB2 ))
   (( segid "    " and resid 191  and name H   ))
      3.200     1.300     1.300 peak  4118 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      1.616 ppm2      8.423 CV     1
 ASSI { 4119}
   (( segid "    " and resid 191  and name HA  ))
   (( segid "    " and resid 191  and name H   ))
      3.100     1.200     1.200 peak  4119 spectrum    1 weight  0.10000E+01 volume  0.93090E-03 ppm1      4.892 ppm2      8.428 CV     1
 ASSI { 4120}
   (( segid "    " and resid 191  and name HB2 ))
   (( segid "    " and resid 192  and name H   ))
      4.100     2.100     1.900 peak  4120 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      1.611 ppm2      9.086 CV     1
 ASSI { 4122}
   (( segid "    " and resid 191  and name HA  ))
   (( segid "    " and resid 191  and name HB3 ))
      2.800     0.900     0.900 peak  4122 spectrum    1 weight  0.10000E+01 volume  0.11475E-02 ppm1      4.895 ppm2      1.250 CV     1
 ASSI { 4124}
   (( segid "    " and resid 181  and name HG3 ))
   (( segid "    " and resid 181  and name H   ))
      4.500     2.500     1.500 peak  4124 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      1.616 ppm2      8.765 CV     1
 ASSI { 4125}
   (( segid "    " and resid 191  and name HG  ))
   (( segid "    " and resid 191  and name H   ))
      3.400     1.500     1.500 peak  4125 spectrum    1 weight  0.10000E+01 volume  0.15436E-02 ppm1      1.631 ppm2      8.443 CV     1
 ASSI { 4126}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 47   and name HE% )
      4.900     3.000     1.100 peak  4126 spectrum    1 weight  0.10000E+01 volume  0.59577E-03 ppm1      2.551 ppm2      7.092 CV     1
 ASSI { 4128}
   (( segid "    " and resid 173  and name HA  ))
   (  segid "    " and resid 174  and name HD2%)
      3.900     1.900     1.900 peak  4128 spectrum    1 weight  0.10000E+01 volume  0.18483E-02 ppm1      4.656 ppm2      0.672 CV     1
 ASSI { 4132}
   (( segid "    " and resid 127  and name HB3 ))
   (  segid "    " and resid 127  and name HE% )
      4.600     2.600     1.400 peak  4132 spectrum    1 weight  0.10000E+01 volume  0.74473E-03 ppm1      2.817 ppm2      6.629 CV     1
 OR { 4132}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 127  and name HE% )
 ASSI { 4134}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 61   and name HH2 ))
      3.400     1.400     1.400 peak  4134 spectrum    1 weight  0.10000E+01 volume  0.12627E-02 ppm1      2.145 ppm2      6.494 CV     1
 ASSI { 4135}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 61   and name HZ2 ))
      3.800     1.800     1.800 peak  4135 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      2.144 ppm2      7.148 CV     1
 ASSI { 4140}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 51   and name H   ))
      4.300     2.300     1.700 peak  4140 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      2.131 ppm2      8.428 CV     1
 ASSI { 4141}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 50   and name H   ))
      3.100     1.200     1.200 peak  4141 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      2.175 ppm2      9.135 CV     1
 ASSI { 4144}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 50   and name HA  ))
      3.200     1.300     1.300 peak  4144 spectrum    1 weight  0.10000E+01 volume  0.14116E-02 ppm1      2.143 ppm2      4.707 CV     1
 ASSI { 4145}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
      2.800     1.000     1.000 peak  4145 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      2.434 ppm2      4.710 CV     1
 ASSI { 4150}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 82   and name HB3 ))
      3.800     1.800     1.800 peak  4150 spectrum    1 weight  0.10000E+01 volume  0.18043E-02 ppm1      2.140 ppm2      1.697 CV     1
 ASSI { 4151}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HB3 ))
      2.700     0.900     0.900 peak  4151 spectrum    1 weight  0.10000E+01 volume  0.16485E-02 ppm1      2.436 ppm2      1.694 CV     1
 ASSI { 4152}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HG2 ))
      2.500     0.800     0.800 peak  4152 spectrum    1 weight  0.10000E+01 volume  0.32090E-02 ppm1      2.436 ppm2      1.459 CV     1
 OR { 4152}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI { 4153}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 82   and name HG2 ))
      2.500     0.800     0.800 peak  4153 spectrum    1 weight  0.10000E+01 volume  0.36323E-02 ppm1      2.140 ppm2      1.463 CV     1
 OR { 4153}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI { 4154}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 82   and name HG3 ))
      2.600     0.800     0.800 peak  4154 spectrum    1 weight  0.10000E+01 volume  0.22071E-02 ppm1      2.140 ppm2      1.540 CV     1
 ASSI { 4156}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HB2 ))
      3.800     1.800     1.800 peak  4156 spectrum    1 weight  0.10000E+01 volume  0.75489E-03 ppm1      4.881 ppm2      3.030 CV     1
 ASSI { 4157}
   (  segid "    " and resid 0    and name HG2%)
   (( segid "    " and resid 1    and name H   ))
      3.900     1.900     1.900 peak  4157 spectrum    1 weight  0.10000E+01 volume  0.35917E-02 ppm1      1.138 ppm2      8.150 CV     1
 ASSI { 4158}
   (  segid "    " and resid 0    and name HG2%)
   (( segid "    " and resid 0    and name H   ))
      2.400     0.700     0.700 peak  4158 spectrum    1 weight  0.10000E+01 volume  0.98032E-02 ppm1      1.138 ppm2      8.043 CV     1
 ASSI { 4159}
   (  segid "    " and resid 0    and name HG2%)
   (( segid "    " and resid 2    and name H   ))
      4.300     2.300     1.700 peak  4159 spectrum    1 weight  0.10000E+01 volume  0.15910E-02 ppm1      1.136 ppm2      7.966 CV     1
 ASSI { 4160}
   (( segid "    " and resid 0    and name HA  ))
   (( segid "    " and resid 2    and name H   ))
      4.000     2.000     2.000 peak  4160 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      4.200 ppm2      7.968 CV     1
 ASSI { 4161}
   (( segid "    " and resid 0    and name HA  ))
   (( segid "    " and resid -1   and name HA  ))
      4.500     2.600     1.500 peak  4161 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      4.199 ppm2      4.526 CV     1
 ASSI { 4162}
   (  segid "    " and resid 0    and name HG2%)
   (( segid "    " and resid -1   and name HA  ))
      4.100     2.100     1.900 peak  4162 spectrum    1 weight  0.10000E+01 volume  0.25354E-02 ppm1      1.140 ppm2      4.532 CV     1
 ASSI { 4163}
   (  segid "    " and resid 0    and name HG2%)
   (( segid "    " and resid 0    and name HA  ))
      1.900     0.500     0.500 peak  4163 spectrum    1 weight  0.10000E+01 volume  0.41962E-01 ppm1      1.139 ppm2      4.201 CV     1
 ASSI { 4164}
   (  segid "    " and resid 0    and name HG2%)
   (( segid "    " and resid 0    and name HB  ))
      1.800     0.400     0.400 peak  4164 spectrum    1 weight  0.10000E+01 volume  0.29759E-01 ppm1      1.137 ppm2      4.139 CV     1
 ASSI { 4165}
   (( segid "    " and resid 0    and name HB  ))
   (( segid "    " and resid 1    and name HB3 ))
      4.800     2.900     1.200 peak  4165 spectrum    1 weight  0.10000E+01 volume  0.80228E-03 ppm1      4.142 ppm2      1.960 CV     1
 ASSI { 4167}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 28   and name HB% )
      3.300     1.400     1.400 peak  4167 spectrum    1 weight  0.10000E+01 volume  0.52842E-02 ppm1      2.052 ppm2      1.013 CV     1
 ASSI { 4168}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 68   and name HD1%)
      2.200     2.200     3.800 peak  4168 spectrum    1 weight  0.10000E+01 volume  0.21259E-02 ppm1      2.054 ppm2      0.315 CV     1
 ASSI { 4169}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 31   and name H   ))
      3.000     1.100     1.100 peak  4169 spectrum    1 weight  0.10000E+01 volume  0.44073E-02 ppm1      2.050 ppm2      8.328 CV     1
 ASSI { 4170}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 32   and name H   ))
      3.700     1.700     1.700 peak  4170 spectrum    1 weight  0.10000E+01 volume  0.19634E-02 ppm1      2.051 ppm2      8.096 CV     1
 ASSI { 4171}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 28   and name H   ))
      3.400     1.400     1.400 peak  4171 spectrum    1 weight  0.10000E+01 volume  0.23391E-02 ppm1      2.051 ppm2      8.609 CV     1
 ASSI { 4172}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 20   and name H   ))
      2.700     0.900     0.900 peak  4172 spectrum    1 weight  0.10000E+01 volume  0.28265E-02 ppm1      2.051 ppm2      9.210 CV     1
 ASSI { 4173}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 19   and name HD% )
      2.000     0.500     0.500 peak  4173 spectrum    1 weight  0.10000E+01 volume  0.11239E-01 ppm1      2.051 ppm2      7.066 CV     1
 ASSI { 4174}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 19   and name HA  ))
      2.600     0.800     0.800 peak  4174 spectrum    1 weight  0.10000E+01 volume  0.53553E-02 ppm1      2.050 ppm2      4.850 CV     1
 ASSI { 4175}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 28   and name HA  ))
      2.100     0.600     0.600 peak  4175 spectrum    1 weight  0.10000E+01 volume  0.59409E-02 ppm1      2.051 ppm2      4.239 CV     1
 ASSI { 4176}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 31   and name HA  ))
      3.600     1.600     1.600 peak  4176 spectrum    1 weight  0.10000E+01 volume  0.61678E-02 ppm1      2.052 ppm2      3.880 CV     1
 ASSI { 4177}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 31   and name HB3 ))
      2.800     1.000     1.000 peak  4177 spectrum    1 weight  0.10000E+01 volume  0.71630E-02 ppm1      2.051 ppm2      2.345 CV     1
 ASSI { 4178}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 17   and name HE% )
      2.500     0.800     0.800 peak  4178 spectrum    1 weight  0.10000E+01 volume  0.11557E-01 ppm1      2.051 ppm2      1.675 CV     1
 ASSI { 4179}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 30   and name HG2 ))
      2.600     0.900     0.900 peak  4179 spectrum    1 weight  0.10000E+01 volume  0.77383E-02 ppm1      2.048 ppm2      1.468 CV     1
 ASSI { 4180}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 23   and name HG2%)
      1.900     0.500     0.500 peak  4180 spectrum    1 weight  0.10000E+01 volume  0.21983E-01 ppm1      2.051 ppm2      1.365 CV     1
 ASSI { 4181}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 13   and name H   ))
      3.000     1.100     1.100 peak  4181 spectrum    1 weight  0.10000E+01 volume  0.35917E-02 ppm1      4.650 ppm2      8.086 CV     1
 ASSI { 4183}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name H   ))
      2.700     0.900     0.900 peak  4183 spectrum    1 weight  0.10000E+01 volume  0.25895E-02 ppm1      4.678 ppm2      8.893 CV     1
 ASSI { 4184}
   (( segid "    " and resid 15   and name HB3 ))
   (( segid "    " and resid 15   and name H   ))
      3.900     1.900     1.900 peak  4184 spectrum    1 weight  0.10000E+01 volume  0.12390E-02 ppm1      1.713 ppm2      8.896 CV     1
 ASSI { 4185}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name H   ))
      2.600     0.800     0.800 peak  4185 spectrum    1 weight  0.10000E+01 volume  0.18043E-02 ppm1      1.475 ppm2      8.894 CV     1
 ASSI { 4188}
   (( segid "    " and resid 15   and name HD3 ))
   (( segid "    " and resid 16   and name H   ))
      3.900     1.900     1.900 peak  4188 spectrum    1 weight  0.10000E+01 volume  0.15402E-02 ppm1      1.677 ppm2      8.592 CV     1
 ASSI { 4190}
   (( segid "    " and resid 15   and name HB3 ))
   (( segid "    " and resid 15   and name HA  ))
      2.800     0.900     0.900 peak  4190 spectrum    1 weight  0.10000E+01 volume  0.18110E-02 ppm1      1.707 ppm2      4.673 CV     1
 ASSI { 4191}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
      3.200     1.300     1.300 peak  4191 spectrum    1 weight  0.10000E+01 volume  0.16249E-02 ppm1      1.478 ppm2      4.676 CV     1
 ASSI { 4193}
   (( segid "    " and resid 15   and name HB3 ))
   (( segid "    " and resid 15   and name HG2 ))
      3.100     1.200     1.200 peak  4193 spectrum    1 weight  0.10000E+01 volume  0.28097E-02 ppm1      1.710 ppm2      1.306 CV     1
 ASSI { 4194}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 98   and name HG3 ))
      2.600     0.800     0.800 peak  4194 spectrum    1 weight  0.10000E+01 volume  0.37439E-02 ppm1      1.642 ppm2      1.304 CV     1
 OR { 4194}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 98   and name HG2 ))
 ASSI { 4195}
   (( segid "    " and resid 15   and name HB3 ))
   (( segid "    " and resid 15   and name HG3 ))
      2.800     1.000     1.000 peak  4195 spectrum    1 weight  0.10000E+01 volume  0.25185E-02 ppm1      1.714 ppm2      1.261 CV     1
 OR { 4195}
   (( segid "    " and resid 15   and name HB3 ))
   (( segid "    " and resid 15   and name HG2 ))
 ASSI { 4197}
   (( segid "    " and resid 15   and name HB3 ))
   (( segid "    " and resid 15   and name HB2 ))
      1.800     0.400     0.400 peak  4197 spectrum    1 weight  0.10000E+01 volume  0.60153E-02 ppm1      1.713 ppm2      1.477 CV     1
 ASSI { 4200}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name HB2 ))
      1.600     0.300     0.600 peak  4200 spectrum    1 weight  0.10000E+01 volume  0.87201E-02 ppm1      1.515 ppm2      1.641 CV     1
 ASSI { 4202}
   (( segid "    " and resid 58   and name HE2 ))
   (( segid "    " and resid 58   and name HA  ))
      3.800     1.800     1.800 peak  4202 spectrum    1 weight  0.10000E+01 volume  0.29790E-02 ppm1      2.921 ppm2      4.344 CV     1
 OR { 4202}
   (( segid "    " and resid 58   and name HE3 ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI { 4203}
   (( segid "    " and resid 98   and name HE3 ))
   (( segid "    " and resid 100  and name HA  ))
      3.200     1.300     1.300 peak  4203 spectrum    1 weight  0.10000E+01 volume  0.28368E-02 ppm1      2.904 ppm2      4.235 CV     1
 ASSI { 4204}
   (( segid "    " and resid 98   and name HE2 ))
   (( segid "    " and resid 118  and name HB2 ))
      2.500     0.800     0.800 peak  4204 spectrum    1 weight  0.10000E+01 volume  0.29180E-02 ppm1      2.907 ppm2      1.987 CV     1
 ASSI { 4205}
   (( segid "    " and resid 98   and name HE2 ))
   (( segid "    " and resid 118  and name HB3 ))
      2.000     0.500     0.500 peak  4205 spectrum    1 weight  0.10000E+01 volume  0.57344E-02 ppm1      2.913 ppm2      1.904 CV     1
 ASSI { 4206}
   (( segid "    " and resid 98   and name HE3 ))
   (  segid "    " and resid 100  and name HG2%)
      3.200     1.300     1.300 peak  4206 spectrum    1 weight  0.10000E+01 volume  0.31379E-02 ppm1      2.899 ppm2      0.673 CV     1
 OR { 4206}
   (( segid "    " and resid 98   and name HE2 ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI { 4207}
   (( segid "    " and resid 15   and name HD2 ))
   (  segid "    " and resid 13   and name HG2%)
      3.500     1.500     1.500 peak  4207 spectrum    1 weight  0.10000E+01 volume  0.49624E-02 ppm1      1.584 ppm2      0.822 CV     1
 ASSI { 4208}
   (( segid "    " and resid 98   and name HD3 ))
   (  segid "    " and resid 119  and name HG2%)
      3.500     1.600     1.600 peak  4208 spectrum    1 weight  0.10000E+01 volume  0.44210E-02 ppm1      1.582 ppm2      0.763 CV     1
 ASSI { 4211}
   (( segid "    " and resid 15   and name HD3 ))
   (  segid "    " and resid 36   and name HD1%)
      4.200     2.200     1.800 peak  4211 spectrum    1 weight  0.10000E+01 volume  0.26200E-02 ppm1      1.672 ppm2      0.670 CV     1
 ASSI { 4212}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 36   and name HG12))
      4.100     2.100     1.900 peak  4212 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.492 ppm2      0.916 CV     1
 ASSI { 4213}
   (( segid "    " and resid 15   and name HB2 ))
   (  segid "    " and resid 36   and name HG2%)
      3.500     1.500     1.500 peak  4213 spectrum    1 weight  0.10000E+01 volume  0.12694E-02 ppm1      1.482 ppm2      0.821 CV     1
 ASSI { 4214}
   (( segid "    " and resid 15   and name HB2 ))
   (  segid "    " and resid 36   and name HD1%)
      2.400     0.700     0.700 peak  4214 spectrum    1 weight  0.10000E+01 volume  0.25761E-02 ppm1      1.489 ppm2      0.664 CV     1
 ASSI { 4216}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 15   and name H   ))
      3.000     1.100     1.100 peak  4216 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      1.308 ppm2      8.896 CV     1
 ASSI { 4217}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 15   and name H   ))
      4.100     2.100     1.900 peak  4217 spectrum    1 weight  0.10000E+01 volume  0.12796E-02 ppm1      1.243 ppm2      8.899 CV     1
 ASSI { 4219}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 16   and name H   ))
      4.700     2.800     1.300 peak  4219 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      1.306 ppm2      8.591 CV     1
 ASSI { 4220}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 14   and name HA  ))
      3.400     1.500     1.500 peak  4220 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      1.322 ppm2      4.987 CV     1
 ASSI { 4221}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 99   and name HA  ))
      4.300     2.400     1.700 peak  4221 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      1.245 ppm2      4.981 CV     1
 ASSI { 4224}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HE2 ))
      2.400     0.700     0.700 peak  4224 spectrum    1 weight  0.10000E+01 volume  0.87302E-02 ppm1      1.315 ppm2      2.905 CV     1
 OR { 4224}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HE3 ))
 ASSI { 4225}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 98   and name HE3 ))
      3.400     1.400     1.400 peak  4225 spectrum    1 weight  0.10000E+01 volume  0.22206E-02 ppm1      1.249 ppm2      2.902 CV     1
 ASSI { 4226}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 15   and name HE3 ))
      2.800     1.000     1.000 peak  4226 spectrum    1 weight  0.10000E+01 volume  0.25659E-02 ppm1      1.250 ppm2      2.802 CV     1
 OR { 4226}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 15   and name HE2 ))
 ASSI { 4227}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 15   and name HE2 ))
      2.900     1.000     1.000 peak  4227 spectrum    1 weight  0.10000E+01 volume  0.25727E-02 ppm1      1.309 ppm2      2.803 CV     1
 OR { 4227}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 15   and name HE3 ))
 ASSI { 4228}
   (( segid "    " and resid 138  and name HG3 ))
   (( segid "    " and resid 170  and name HG2 ))
      3.300     1.400     1.400 peak  4228 spectrum    1 weight  0.10000E+01 volume  0.21292E-02 ppm1      1.312 ppm2      2.140 CV     1
 OR { 4228}
   (( segid "    " and resid 138  and name HG3 ))
   (( segid "    " and resid 170  and name HG3 ))
 OR { 4228}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 170  and name HG2 ))
 OR { 4228}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 170  and name HG3 ))
 ASSI { 4229}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 8    and name HB  ))
      3.900     1.900     1.900 peak  4229 spectrum    1 weight  0.10000E+01 volume  0.15639E-02 ppm1      1.306 ppm2      2.076 CV     1
 ASSI { 4230}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 8    and name HB  ))
      4.400     2.400     1.600 peak  4230 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      1.251 ppm2      2.073 CV     1
 ASSI { 4234}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 15   and name HB3 ))
      2.500     0.800     0.800 peak  4234 spectrum    1 weight  0.10000E+01 volume  0.49185E-02 ppm1      1.246 ppm2      1.690 CV     1
 OR { 4234}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 15   and name HD3 ))
 ASSI { 4238}
   (( segid "    " and resid 15   and name HG3 ))
   (  segid "    " and resid 36   and name HG2%)
      2.500     0.800     0.800 peak  4238 spectrum    1 weight  0.10000E+01 volume  0.30095E-02 ppm1      1.247 ppm2      0.824 CV     1
 ASSI { 4240}
   (( segid "    " and resid 15   and name HG2 ))
   (  segid "    " and resid 36   and name HD1%)
      3.500     1.500     1.500 peak  4240 spectrum    1 weight  0.10000E+01 volume  0.37607E-02 ppm1      1.309 ppm2      0.668 CV     1
 ASSI { 4242}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name H   ))
      4.300     2.300     1.700 peak  4242 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.335 ppm2      8.673 CV     1
 ASSI { 4244}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name H   ))
      4.100     2.100     1.900 peak  4244 spectrum    1 weight  0.10000E+01 volume  0.17332E-02 ppm1      1.464 ppm2      8.670 CV     1
 OR { 4244}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name H   ))
 ASSI { 4245}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name H   ))
      3.200     1.300     1.300 peak  4245 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      1.139 ppm2      8.678 CV     1
 ASSI { 4247}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 8    and name H   ))
      4.500     2.600     1.500 peak  4247 spectrum    1 weight  0.10000E+01 volume  0.93429E-03 ppm1      1.195 ppm2      9.035 CV     1
 ASSI { 4248}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 8    and name H   ))
      5.100     3.200     0.900 peak  4248 spectrum    1 weight  0.10000E+01 volume  0.10528E-02 ppm1      1.144 ppm2      9.031 CV     1
 ASSI { 4252}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 8    and name H   ))
      4.700     2.800     1.300 peak  4252 spectrum    1 weight  0.10000E+01 volume  0.13676E-02 ppm1      1.463 ppm2      9.039 CV     1
 ASSI { 4253}
   (( segid "    " and resid 89   and name HD3 ))
   (( segid "    " and resid 90   and name H   ))
      4.900     3.000     1.100 peak  4253 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      1.505 ppm2      8.800 CV     1
 ASSI { 4254}
   (( segid "    " and resid 89   and name HD2 ))
   (( segid "    " and resid 90   and name H   ))
      4.900     3.000     1.100 peak  4254 spectrum    1 weight  0.10000E+01 volume  0.62285E-03 ppm1      1.457 ppm2      8.802 CV     1
 ASSI { 4255}
   (( segid "    " and resid 89   and name HD3 ))
   (( segid "    " and resid 89   and name H   ))
      3.600     1.600     1.600 peak  4255 spectrum    1 weight  0.10000E+01 volume  0.92413E-03 ppm1      1.502 ppm2      8.475 CV     1
 ASSI { 4256}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 84   and name H   ))
      4.800     2.800     1.200 peak  4256 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      1.457 ppm2      8.109 CV     1
 OR { 4256}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 84   and name H   ))
 ASSI { 4257}
   (( segid "    " and resid 83   and name HE3 ))
   (( segid "    " and resid 84   and name H   ))
      4.700     2.700     1.300 peak  4257 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      2.814 ppm2      8.091 CV     1
 ASSI { 4258}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 107  and name H   ))
      4.400     2.400     1.600 peak  4258 spectrum    1 weight  0.10000E+01 volume  0.74134E-03 ppm1      1.140 ppm2      8.527 CV     1
 ASSI { 4259}
   (( segid "    " and resid 83   and name HE3 ))
   (( segid "    " and resid 85   and name H   ))
      3.500     1.500     1.500 peak  4259 spectrum    1 weight  0.10000E+01 volume  0.31007E-02 ppm1      2.817 ppm2      7.118 CV     1
 ASSI { 4260}
   (( segid "    " and resid 83   and name HE2 ))
   (( segid "    " and resid 85   and name H   ))
      3.900     1.900     1.900 peak  4260 spectrum    1 weight  0.10000E+01 volume  0.27081E-02 ppm1      2.775 ppm2      7.119 CV     1
 ASSI { 4261}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 78   and name HA  ))
      5.000     3.100     1.000 peak  4261 spectrum    1 weight  0.10000E+01 volume  0.72780E-03 ppm1      1.205 ppm2      5.329 CV     1
 ASSI { 4262}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 78   and name HA  ))
      4.300     2.400     1.700 peak  4262 spectrum    1 weight  0.10000E+01 volume  0.69733E-03 ppm1      1.149 ppm2      5.325 CV     1
 ASSI { 4263}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 78   and name HA  ))
      4.300     2.300     1.700 peak  4263 spectrum    1 weight  0.10000E+01 volume  0.15876E-02 ppm1      1.463 ppm2      5.332 CV     1
 OR { 4263}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI { 4267}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 6    and name HA  ))
      4.800     2.900     1.200 peak  4267 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      1.807 ppm2      4.939 CV     1
 ASSI { 4269}
   (( segid "    " and resid 89   and name HD2 ))
   (( segid "    " and resid 99   and name HA  ))
      3.600     1.600     1.600 peak  4269 spectrum    1 weight  0.10000E+01 volume  0.16587E-02 ppm1      1.466 ppm2      4.962 CV     1
 ASSI { 4270}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HA  ))
      3.900     1.900     1.900 peak  4270 spectrum    1 weight  0.10000E+01 volume  0.19803E-02 ppm1      1.462 ppm2      4.507 CV     1
 OR { 4270}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HA  ))
 ASSI { 4271}
   (( segid "    " and resid 98   and name HE3 ))
   (( segid "    " and resid 99   and name HA  ))
      3.500     1.500     1.500 peak  4271 spectrum    1 weight  0.10000E+01 volume  0.13066E-02 ppm1      2.907 ppm2      4.926 CV     1
 ASSI { 4272}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 16   and name HA  ))
      4.300     2.400     1.700 peak  4272 spectrum    1 weight  0.10000E+01 volume  0.13134E-02 ppm1      1.143 ppm2      4.961 CV     1
 ASSI { 4274}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HA  ))
      2.700     0.900     0.900 peak  4274 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      1.205 ppm2      4.500 CV     1
 ASSI { 4276}
   (( segid "    " and resid 89   and name HD2 ))
   (( segid "    " and resid 99   and name HB  ))
      4.400     2.500     1.600 peak  4276 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1      1.464 ppm2      3.860 CV     1
 ASSI { 4277}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 83   and name HA  ))
      3.700     1.700     1.700 peak  4277 spectrum    1 weight  0.10000E+01 volume  0.19803E-02 ppm1      1.458 ppm2      3.526 CV     1
 ASSI { 4278}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HE3 ))
      3.000     1.100     1.100 peak  4278 spectrum    1 weight  0.10000E+01 volume  0.22308E-02 ppm1      1.202 ppm2      2.800 CV     1
 OR { 4278}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HE2 ))
 ASSI { 4280}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 103  and name HB3 ))
      4.300     2.300     1.700 peak  4280 spectrum    1 weight  0.10000E+01 volume  0.10460E-02 ppm1      1.132 ppm2      2.593 CV     1
 ASSI { 4282}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HE2 ))
      3.600     1.600     1.600 peak  4282 spectrum    1 weight  0.10000E+01 volume  0.12525E-02 ppm1      1.831 ppm2      2.801 CV     1
 OR { 4282}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HE3 ))
 OR { 4282}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name HE3 ))
 OR { 4282}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name HE2 ))
 ASSI { 4284}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HE2 ))
      3.300     1.400     1.400 peak  4284 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      1.343 ppm2      2.800 CV     1
 OR { 4284}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HE3 ))
 ASSI { 4285}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 85   and name HG3 ))
      3.100     1.200     1.200 peak  4285 spectrum    1 weight  0.10000E+01 volume  0.15470E-02 ppm1      1.449 ppm2      2.033 CV     1
 ASSI { 4287}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HB2 ))
      2.100     0.500     0.500 peak  4287 spectrum    1 weight  0.10000E+01 volume  0.25456E-02 ppm1      1.347 ppm2      1.824 CV     1
 ASSI { 4289}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HD3 ))
      2.700     0.900     0.900 peak  4289 spectrum    1 weight  0.10000E+01 volume  0.31583E-02 ppm1      1.343 ppm2      1.457 CV     1
 OR { 4289}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HD2 ))
 ASSI { 4290}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HG2 ))
      3.000     1.200     1.200 peak  4290 spectrum    1 weight  0.10000E+01 volume  0.19938E-02 ppm1      1.341 ppm2      1.175 CV     1
 OR { 4290}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HG3 ))
 ASSI { 4294}
   (( segid "    " and resid 7    and name HD3 ))
   (  segid "    " and resid 78   and name HG2%)
      3.600     1.700     1.700 peak  4294 spectrum    1 weight  0.10000E+01 volume  0.33478E-02 ppm1      1.463 ppm2      1.002 CV     1
 OR { 4294}
   (( segid "    " and resid 7    and name HD2 ))
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 4295}
   (( segid "    " and resid 7    and name HD3 ))
   (  segid "    " and resid 14   and name HG1%)
      3.600     1.600     1.600 peak  4295 spectrum    1 weight  0.10000E+01 volume  0.34460E-02 ppm1      1.457 ppm2      0.775 CV     1
 OR { 4295}
   (( segid "    " and resid 7    and name HD2 ))
   (  segid "    " and resid 14   and name HG1%)
 ASSI { 4298}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HG3 ))
      2.300     0.700     0.700 peak  4298 spectrum    1 weight  0.10000E+01 volume  0.85676E-02 ppm1      1.463 ppm2      1.185 CV     1
 OR { 4298}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HG2 ))
 OR { 4298}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HG3 ))
 OR { 4298}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HG2 ))
 ASSI { 4301}
   (( segid "    " and resid 7    and name HG2 ))
   (  segid "    " and resid 16   and name HG2%)
      3.100     1.200     1.200 peak  4301 spectrum    1 weight  0.10000E+01 volume  0.17670E-02 ppm1      1.201 ppm2      0.935 CV     1
 ASSI { 4302}
   (( segid "    " and resid 7    and name HG3 ))
   (  segid "    " and resid 16   and name HG2%)
      3.900     1.900     1.900 peak  4302 spectrum    1 weight  0.10000E+01 volume  0.14590E-02 ppm1      1.142 ppm2      0.938 CV     1
 ASSI { 4303}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HD2 ))
      2.700     0.900     0.900 peak  4303 spectrum    1 weight  0.10000E+01 volume  0.46443E-02 ppm1      1.201 ppm2      1.459 CV     1
 OR { 4303}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HD3 ))
 ASSI { 4305}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HB2 ))
      3.100     1.200     1.200 peak  4305 spectrum    1 weight  0.10000E+01 volume  0.25625E-02 ppm1      1.191 ppm2      1.830 CV     1
 ASSI { 4307}
   (( segid "    " and resid 7    and name HG2 ))
   (  segid "    " and resid 14   and name HG2%)
      3.600     1.600     1.600 peak  4307 spectrum    1 weight  0.10000E+01 volume  0.20378E-02 ppm1      1.200 ppm2      0.716 CV     1
 ASSI { 4311}
   (( segid "    " and resid 17   and name HG3 ))
   (( segid "    " and resid 18   and name H   ))
      4.400     2.400     1.600 peak  4311 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      2.075 ppm2      7.667 CV     1
 ASSI { 4312}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 18   and name H   ))
      3.900     1.900     1.900 peak  4312 spectrum    1 weight  0.10000E+01 volume  0.15301E-02 ppm1      2.132 ppm2      7.661 CV     1
 ASSI { 4313}
   (( segid "    " and resid 17   and name HG3 ))
   (  segid "    " and resid 19   and name HE% )
      4.200     2.200     1.800 peak  4313 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1      2.070 ppm2      7.122 CV     1
 ASSI { 4314}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 17   and name H   ))
      4.200     2.200     1.800 peak  4314 spectrum    1 weight  0.10000E+01 volume  0.80567E-03 ppm1      2.126 ppm2      9.140 CV     1
 ASSI { 4316}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 17   and name HA  ))
      2.600     0.800     0.800 peak  4316 spectrum    1 weight  0.10000E+01 volume  0.25795E-02 ppm1      2.125 ppm2      4.379 CV     1
 ASSI { 4317}
   (( segid "    " and resid 17   and name HG3 ))
   (( segid "    " and resid 17   and name HA  ))
      3.300     1.400     1.400 peak  4317 spectrum    1 weight  0.10000E+01 volume  0.34325E-02 ppm1      2.070 ppm2      4.380 CV     1
 ASSI { 4319}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 17   and name HB2 ))
      2.600     0.900     0.900 peak  4319 spectrum    1 weight  0.10000E+01 volume  0.42414E-02 ppm1      2.128 ppm2      1.475 CV     1
 OR { 4319}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 17   and name HB3 ))
 ASSI { 4320}
   (( segid "    " and resid 17   and name HG3 ))
   (( segid "    " and resid 17   and name HB2 ))
      2.300     0.700     0.700 peak  4320 spectrum    1 weight  0.10000E+01 volume  0.50134E-02 ppm1      2.071 ppm2      1.477 CV     1
 OR { 4320}
   (( segid "    " and resid 17   and name HG3 ))
   (( segid "    " and resid 17   and name HB3 ))
 ASSI { 4321}
   (( segid "    " and resid 17   and name HG3 ))
   (  segid "    " and resid 17   and name HE% )
      2.600     0.800     0.800 peak  4321 spectrum    1 weight  0.10000E+01 volume  0.57005E-02 ppm1      2.078 ppm2      1.683 CV     1
 ASSI { 4322}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 6    and name HD1%)
      4.800     2.900     1.200 peak  4322 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      4.851 ppm2      0.706 CV     1
 ASSI { 4324}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 23   and name H   ))
      4.700     2.700     1.300 peak  4324 spectrum    1 weight  0.10000E+01 volume  0.68379E-03 ppm1      2.127 ppm2      7.743 CV     1
 ASSI { 4325}
   (( segid "    " and resid 20   and name HG3 ))
   (( segid "    " and resid 23   and name H   ))
      5.000     3.100     1.000 peak  4325 spectrum    1 weight  0.10000E+01 volume  0.96137E-03 ppm1      2.368 ppm2      7.722 CV     1
 OR { 4325}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 23   and name H   ))
 ASSI { 4326}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HA  ))
      3.400     1.500     1.500 peak  4326 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      1.898 ppm2      4.651 CV     1
 ASSI { 4327}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 20   and name HB3 ))
      2.400     0.700     0.700 peak  4327 spectrum    1 weight  0.10000E+01 volume  0.66958E-02 ppm1      2.361 ppm2      2.119 CV     1
 OR { 4327}
   (( segid "    " and resid 20   and name HG3 ))
   (( segid "    " and resid 20   and name HB3 ))
 ASSI { 4328}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 22   and name H   ))
      3.400     1.400     1.400 peak  4328 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      2.097 ppm2      7.378 CV     1
 ASSI { 4329}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 22   and name H   ))
      4.300     2.300     1.700 peak  4329 spectrum    1 weight  0.10000E+01 volume  0.85304E-03 ppm1      2.324 ppm2      7.384 CV     1
 ASSI { 4331}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 4    and name H   ))
      5.000     3.100     1.000 peak  4331 spectrum    1 weight  0.10000E+01 volume  0.73119E-03 ppm1      3.878 ppm2      8.725 CV     1
 ASSI { 4332}
   (( segid "    " and resid 21   and name HD3 ))
   (( segid "    " and resid 4    and name H   ))
      3.500     1.500     1.500 peak  4332 spectrum    1 weight  0.10000E+01 volume  0.75827E-03 ppm1      3.811 ppm2      8.729 CV     1
 ASSI { 4334}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 20   and name HA  ))
      4.100     2.100     1.900 peak  4334 spectrum    1 weight  0.10000E+01 volume  0.73119E-03 ppm1      4.102 ppm2      4.645 CV     1
 ASSI { 4336}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 21   and name HD3 ))
      4.100     2.100     1.900 peak  4336 spectrum    1 weight  0.10000E+01 volume  0.12829E-02 ppm1      2.120 ppm2      3.841 CV     1
 OR { 4336}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 21   and name HD2 ))
 ASSI { 4337}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HD3 ))
      3.600     1.600     1.600 peak  4337 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      4.104 ppm2      3.780 CV     1
 ASSI { 4339}
   (( segid "    " and resid -2   and name HB3 ))
   (( segid "    " and resid -2   and name HD3 ))
      3.400     1.400     1.400 peak  4339 spectrum    1 weight  0.10000E+01 volume  0.29552E-02 ppm1      2.094 ppm2      3.797 CV     1
 ASSI { 4342}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 32   and name H   ))
      3.800     1.800     1.800 peak  4342 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      3.869 ppm2      8.087 CV     1
 ASSI { 4344}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 33   and name H   ))
      4.500     2.500     1.500 peak  4344 spectrum    1 weight  0.10000E+01 volume  0.59577E-03 ppm1      1.561 ppm2      7.444 CV     1
 ASSI { 4350}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 32   and name HG2%)
      3.500     1.500     1.500 peak  4350 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      3.557 ppm2      0.733 CV     1
 ASSI { 4352}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HB3 ))
      2.700     0.900     0.900 peak  4352 spectrum    1 weight  0.10000E+01 volume  0.28368E-02 ppm1      3.558 ppm2      1.712 CV     1
 OR { 4352}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HB2 ))
 ASSI { 4353}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HD2 ))
      4.700     2.700     1.300 peak  4353 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      3.561 ppm2      3.036 CV     1
 OR { 4353}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HD3 ))
 ASSI { 4354}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name H   ))
      2.900     1.000     1.000 peak  4354 spectrum    1 weight  0.10000E+01 volume  0.13710E-02 ppm1      3.555 ppm2      7.456 CV     1
 ASSI { 4355}
   (( segid "    " and resid 33   and name HB3 ))
   (  segid "    " and resid 40   and name HD1%)
      3.600     1.600     1.600 peak  4355 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      1.736 ppm2      0.852 CV     1
 OR { 4355}
   (( segid "    " and resid 33   and name HB2 ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 4357}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HA  ))
      3.600     1.600     1.600 peak  4357 spectrum    1 weight  0.10000E+01 volume  0.64994E-03 ppm1      1.766 ppm2      3.555 CV     1
 ASSI { 4358}
   (( segid "    " and resid 33   and name HB3 ))
   (( segid "    " and resid 33   and name HA  ))
      3.300     1.300     1.300 peak  4358 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      1.707 ppm2      3.554 CV     1
 ASSI { 4360}
   (( segid "    " and resid 43   and name HD3 ))
   (( segid "    " and resid 43   and name HG2 ))
      2.500     0.800     0.800 peak  4360 spectrum    1 weight  0.10000E+01 volume  0.37235E-02 ppm1      3.672 ppm2      1.977 CV     1
 OR { 4360}
   (( segid "    " and resid 43   and name HD2 ))
   (( segid "    " and resid 43   and name HG3 ))
 OR { 4360}
   (( segid "    " and resid 43   and name HD3 ))
   (( segid "    " and resid 43   and name HG3 ))
 OR { 4360}
   (( segid "    " and resid 43   and name HD2 ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI { 4362}
   (( segid "    " and resid 43   and name HD2 ))
   (( segid "    " and resid 42   and name H   ))
      3.900     1.900     1.900 peak  4362 spectrum    1 weight  0.10000E+01 volume  0.10392E-02 ppm1      3.675 ppm2      7.591 CV     1
 ASSI { 4364}
   (( segid "    " and resid 43   and name HD2 ))
   (( segid "    " and resid 43   and name HA  ))
      4.000     2.000     2.000 peak  4364 spectrum    1 weight  0.10000E+01 volume  0.58223E-03 ppm1      3.677 ppm2      4.700 CV     1
 OR { 4364}
   (( segid "    " and resid 43   and name HD3 ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI { 4367}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HD2 ))
      4.500     2.500     1.500 peak  4367 spectrum    1 weight  0.10000E+01 volume  0.10968E-02 ppm1      2.157 ppm2      3.791 CV     1
 ASSI { 4368}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HD2 ))
      4.600     2.600     1.400 peak  4368 spectrum    1 weight  0.10000E+01 volume  0.86319E-03 ppm1      2.176 ppm2      3.752 CV     1
 OR { 4368}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HD3 ))
 ASSI { 4369}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HD2 ))
      3.800     1.800     1.800 peak  4369 spectrum    1 weight  0.10000E+01 volume  0.10325E-02 ppm1      4.221 ppm2      3.750 CV     1
 OR { 4369}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HD3 ))
 ASSI { 4370}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HA  ))
      3.000     1.100     1.100 peak  4370 spectrum    1 weight  0.10000E+01 volume  0.29823E-02 ppm1      2.158 ppm2      4.225 CV     1
 ASSI { 4371}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HA  ))
      2.500     0.800     0.800 peak  4371 spectrum    1 weight  0.10000E+01 volume  0.30906E-02 ppm1      1.999 ppm2      4.223 CV     1
 ASSI { 4372}
   (( segid "    " and resid 44   and name HD3 ))
   (( segid "    " and resid 43   and name HA  ))
      3.300     1.300     1.300 peak  4372 spectrum    1 weight  0.10000E+01 volume  0.16993E-02 ppm1      3.747 ppm2      4.697 CV     1
 ASSI { 4373}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 43   and name HA  ))
      4.100     2.100     1.900 peak  4373 spectrum    1 weight  0.10000E+01 volume  0.92413E-03 ppm1      4.225 ppm2      4.689 CV     1
 ASSI { 4374}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 43   and name HA  ))
      2.500     0.800     0.800 peak  4374 spectrum    1 weight  0.10000E+01 volume  0.19769E-02 ppm1      3.799 ppm2      4.694 CV     1
 ASSI { 4375}
   (( segid "    " and resid 44   and name HD3 ))
   (( segid "    " and resid 44   and name HA  ))
      3.900     1.900     1.900 peak  4375 spectrum    1 weight  0.10000E+01 volume  0.68718E-03 ppm1      3.744 ppm2      4.226 CV     1
 ASSI { 4376}
   (( segid "    " and resid 80   and name HB2 ))
   (  segid "    " and resid 50   and name HE% )
      4.600     2.700     1.400 peak  4376 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      1.992 ppm2      6.494 CV     1
 ASSI { 4378}
   (( segid "    " and resid 44   and name HB3 ))
   (  segid "    " and resid 47   and name HD% )
      4.700     2.800     1.300 peak  4378 spectrum    1 weight  0.10000E+01 volume  0.68379E-03 ppm1      1.997 ppm2      6.732 CV     1
 ASSI { 4381}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 44   and name HA  ))
      4.000     2.000     2.000 peak  4381 spectrum    1 weight  0.10000E+01 volume  0.19566E-02 ppm1      1.903 ppm2      4.213 CV     1
 ASSI { 4383}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 43   and name HA  ))
      4.400     2.400     1.600 peak  4383 spectrum    1 weight  0.10000E+01 volume  0.19329E-02 ppm1      2.079 ppm2      4.703 CV     1
 ASSI { 4384}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 45   and name HA  ))
      3.500     1.500     1.500 peak  4384 spectrum    1 weight  0.10000E+01 volume  0.13879E-02 ppm1      2.085 ppm2      4.635 CV     1
 ASSI { 4385}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 43   and name HA  ))
      4.800     2.900     1.200 peak  4385 spectrum    1 weight  0.10000E+01 volume  0.16215E-02 ppm1      1.898 ppm2      4.703 CV     1
 ASSI { 4386}
   (( segid "    " and resid 87   and name HG3 ))
   (( segid "    " and resid 87   and name HA  ))
      4.200     2.200     1.800 peak  4386 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.893 ppm2      4.629 CV     1
 ASSI { 4387}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HD2 ))
      3.400     1.500     1.500 peak  4387 spectrum    1 weight  0.10000E+01 volume  0.14217E-02 ppm1      2.003 ppm2      3.783 CV     1
 OR { 4387}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HD3 ))
 ASSI { 4388}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 44   and name HD2 ))
      2.400     0.700     0.700 peak  4388 spectrum    1 weight  0.10000E+01 volume  0.35612E-02 ppm1      2.079 ppm2      3.789 CV     1
 ASSI { 4389}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 44   and name HD3 ))
      2.700     0.900     0.900 peak  4389 spectrum    1 weight  0.10000E+01 volume  0.34597E-02 ppm1      2.075 ppm2      3.752 CV     1
 OR { 4389}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 44   and name HD2 ))
 ASSI { 4390}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 87   and name HD2 ))
      2.500     0.800     0.800 peak  4390 spectrum    1 weight  0.10000E+01 volume  0.24136E-02 ppm1      2.087 ppm2      3.645 CV     1
 ASSI { 4391}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 87   and name HD3 ))
      3.200     1.300     1.300 peak  4391 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      2.085 ppm2      3.514 CV     1
 ASSI { 4392}
   (( segid "    " and resid 87   and name HG3 ))
   (( segid "    " and resid 87   and name HD3 ))
      2.600     0.800     0.800 peak  4392 spectrum    1 weight  0.10000E+01 volume  0.21462E-02 ppm1      1.873 ppm2      3.514 CV     1
 ASSI { 4393}
   (( segid "    " and resid 87   and name HG3 ))
   (( segid "    " and resid 87   and name HD2 ))
      3.100     1.200     1.200 peak  4393 spectrum    1 weight  0.10000E+01 volume  0.23459E-02 ppm1      1.875 ppm2      3.643 CV     1
 ASSI { 4395}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 44   and name HG3 ))
      1.600     0.300     0.600 peak  4395 spectrum    1 weight  0.10000E+01 volume  0.16110E-01 ppm1      2.081 ppm2      1.892 CV     1
 ASSI { 4396}
   (( segid "    " and resid 87   and name HG2 ))
   (  segid "    " and resid 101  and name HE% )
      4.000     2.000     2.000 peak  4396 spectrum    1 weight  0.10000E+01 volume  0.22138E-02 ppm1      2.082 ppm2      1.753 CV     1
 ASSI { 4397}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 87   and name HB2 ))
      2.600     0.800     0.800 peak  4397 spectrum    1 weight  0.10000E+01 volume  0.26404E-02 ppm1      2.087 ppm2      1.669 CV     1
 ASSI { 4399}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HG2 ))
      3.900     1.900     1.900 peak  4399 spectrum    1 weight  0.10000E+01 volume  0.16926E-02 ppm1      4.229 ppm2      2.073 CV     1
 ASSI { 4401}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 47   and name HB3 ))
      4.000     2.000     2.000 peak  4401 spectrum    1 weight  0.10000E+01 volume  0.18754E-02 ppm1      4.227 ppm2      1.896 CV     1
 ASSI { 4402}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HG3 ))
      2.800     1.000     1.000 peak  4402 spectrum    1 weight  0.10000E+01 volume  0.36085E-02 ppm1      2.156 ppm2      1.900 CV     1
 ASSI { 4403}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HB3 ))
      1.900     0.400     0.400 peak  4403 spectrum    1 weight  0.10000E+01 volume  0.69901E-02 ppm1      2.158 ppm2      1.997 CV     1
 ASSI { 4404}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 47   and name H   ))
      4.600     2.700     1.400 peak  4404 spectrum    1 weight  0.10000E+01 volume  0.74811E-03 ppm1      2.758 ppm2      7.494 CV     1
 ASSI { 4410}
   (( segid "    " and resid 46   and name HB2 ))
   (  segid "    " and resid 47   and name HE% )
      3.800     1.800     1.800 peak  4410 spectrum    1 weight  0.10000E+01 volume  0.72103E-03 ppm1      2.352 ppm2      7.103 CV     1
 ASSI { 4414}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HB3 ))
      2.300     0.700     0.700 peak  4414 spectrum    1 weight  0.10000E+01 volume  0.20141E-02 ppm1      2.318 ppm2      2.631 CV     1
 ASSI { 4417}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HB2 ))
      3.200     1.300     1.300 peak  4417 spectrum    1 weight  0.10000E+01 volume  0.29857E-02 ppm1      4.478 ppm2      2.319 CV     1
 ASSI { 4418}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 170  and name HB2 ))
      4.000     2.000     2.000 peak  4418 spectrum    1 weight  0.10000E+01 volume  0.15842E-02 ppm1      4.455 ppm2      1.797 CV     1
 ASSI { 4419}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 83   and name HG3 ))
      4.100     2.100     1.900 peak  4419 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      4.488 ppm2      0.918 CV     1
 ASSI { 4420}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 49   and name HB2 ))
      2.600     0.900     0.900 peak  4420 spectrum    1 weight  0.10000E+01 volume  0.91398E-02 ppm1      0.869 ppm2      1.476 CV     1
 ASSI { 4421}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 49   and name HB3 ))
      2.200     0.600     0.600 peak  4421 spectrum    1 weight  0.10000E+01 volume  0.51622E-02 ppm1      0.869 ppm2      1.276 CV     1
 ASSI { 4422}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HB3 ))
      2.000     0.500     0.500 peak  4422 spectrum    1 weight  0.10000E+01 volume  0.15910E-02 ppm1      1.518 ppm2      1.279 CV     1
 ASSI { 4423}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HG  ))
      2.900     1.000     1.000 peak  4423 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.515 ppm2      1.771 CV     1
 ASSI { 4424}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name HB3 ))
      2.200     0.600     0.600 peak  4424 spectrum    1 weight  0.10000E+01 volume  0.10369E-01 ppm1      0.776 ppm2      1.495 CV     1
 ASSI { 4425}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB3 ))
      3.000     1.100     1.100 peak  4425 spectrum    1 weight  0.10000E+01 volume  0.17027E-02 ppm1      4.412 ppm2      1.493 CV     1
 ASSI { 4427}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 58   and name H   ))
      3.700     1.700     1.700 peak  4427 spectrum    1 weight  0.10000E+01 volume  0.13303E-02 ppm1      4.355 ppm2      8.037 CV     1
 ASSI { 4428}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 57   and name H   ))
      4.300     2.300     1.700 peak  4428 spectrum    1 weight  0.10000E+01 volume  0.91736E-03 ppm1      2.364 ppm2      8.125 CV     1
 ASSI { 4434}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 59   and name H   ))
      3.700     1.800     1.800 peak  4434 spectrum    1 weight  0.10000E+01 volume  0.64316E-03 ppm1      4.347 ppm2      7.327 CV     1
 ASSI { 4437}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 55   and name HA  ))
      4.100     2.100     1.900 peak  4437 spectrum    1 weight  0.10000E+01 volume  0.32361E-02 ppm1      2.028 ppm2      4.931 CV     1
 OR { 4437}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI { 4438}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 55   and name HA  ))
      5.200     3.400     0.800 peak  4438 spectrum    1 weight  0.10000E+01 volume  0.58223E-03 ppm1      2.365 ppm2      4.937 CV     1
 ASSI { 4440}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HD2 ))
      4.100     2.100     1.900 peak  4440 spectrum    1 weight  0.10000E+01 volume  0.10663E-02 ppm1      4.357 ppm2      4.039 CV     1
 ASSI { 4441}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HD3 ))
      3.500     1.500     1.500 peak  4441 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      4.352 ppm2      3.984 CV     1
 ASSI { 4445}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HA  ))
      3.400     1.500     1.500 peak  4445 spectrum    1 weight  0.10000E+01 volume  0.43058E-02 ppm1      2.028 ppm2      4.349 CV     1
 ASSI { 4446}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 56   and name HD2 ))
      2.200     0.600     0.600 peak  4446 spectrum    1 weight  0.10000E+01 volume  0.72610E-02 ppm1      2.028 ppm2      4.035 CV     1
 OR { 4446}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HD2 ))
 ASSI { 4447}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HD3 ))
      2.400     0.700     0.700 peak  4447 spectrum    1 weight  0.10000E+01 volume  0.69901E-02 ppm1      2.028 ppm2      3.989 CV     1
 OR { 4447}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 56   and name HD3 ))
 ASSI { 4448}
   (( segid "    " and resid 56   and name HD2 ))
   (( segid "    " and resid 55   and name HB3 ))
      2.700     0.900     0.900 peak  4448 spectrum    1 weight  0.10000E+01 volume  0.75150E-03 ppm1      4.041 ppm2      2.447 CV     1
 ASSI { 4449}
   (( segid "    " and resid 56   and name HD3 ))
   (( segid "    " and resid 55   and name HB3 ))
      4.500     2.500     1.500 peak  4449 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      3.988 ppm2      2.434 CV     1
 ASSI { 4450}
   (( segid "    " and resid 56   and name HD2 ))
   (( segid "    " and resid 56   and name HB3 ))
      4.400     2.400     1.600 peak  4450 spectrum    1 weight  0.10000E+01 volume  0.93768E-03 ppm1      4.061 ppm2      2.365 CV     1
 ASSI { 4451}
   (( segid "    " and resid 56   and name HD3 ))
   (( segid "    " and resid 56   and name HB3 ))
      3.400     1.500     1.500 peak  4451 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      3.986 ppm2      2.359 CV     1
 ASSI { 4452}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 55   and name HB3 ))
      3.700     1.700     1.700 peak  4452 spectrum    1 weight  0.10000E+01 volume  0.17264E-02 ppm1      2.026 ppm2      2.435 CV     1
 ASSI { 4456}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HG2 ))
      3.300     1.300     1.300 peak  4456 spectrum    1 weight  0.10000E+01 volume  0.23899E-02 ppm1      4.143 ppm2      1.430 CV     1
 OR { 4456}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI { 4457}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB3 ))
      2.600     0.900     0.900 peak  4457 spectrum    1 weight  0.10000E+01 volume  0.40148E-02 ppm1      4.138 ppm2      1.781 CV     1
 OR { 4457}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI { 4459}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 59   and name H   ))
      3.700     1.700     1.700 peak  4459 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      4.148 ppm2      7.333 CV     1
 ASSI { 4460}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 57   and name H   ))
      2.100     2.100     3.900 peak  4460 spectrum    1 weight  0.10000E+01 volume  0.30061E-02 ppm1      2.953 ppm2      8.128 CV     1
 OR { 4460}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 57   and name H   ))
 ASSI { 4461}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 184  and name H   ))
      3.300     1.300     1.300 peak  4461 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      2.951 ppm2      7.709 CV     1
 OR { 4461}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 184  and name H   ))
 ASSI { 4462}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 58   and name H   ))
      4.500     2.500     1.500 peak  4462 spectrum    1 weight  0.10000E+01 volume  0.68379E-03 ppm1      1.413 ppm2      8.021 CV     1
 ASSI { 4465}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 183  and name HA  ))
      3.800     1.800     1.800 peak  4465 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      2.949 ppm2      4.475 CV     1
 ASSI { 4466}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 182  and name HA  ))
      3.200     1.300     1.300 peak  4466 spectrum    1 weight  0.10000E+01 volume  0.13371E-02 ppm1      2.954 ppm2      4.382 CV     1
 OR { 4466}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 182  and name HA  ))
 ASSI { 4467}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 57   and name HA  ))
      3.600     1.600     1.600 peak  4467 spectrum    1 weight  0.10000E+01 volume  0.26776E-02 ppm1      2.953 ppm2      4.135 CV     1
 OR { 4467}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI { 4468}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 184  and name HA3 ))
      3.100     1.200     1.200 peak  4468 spectrum    1 weight  0.10000E+01 volume  0.24237E-02 ppm1      2.952 ppm2      4.047 CV     1
 OR { 4468}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 184  and name HA3 ))
 ASSI { 4469}
   (( segid "    " and resid 57   and name HG3 ))
   (( segid "    " and resid 57   and name HA  ))
      4.200     2.200     1.800 peak  4469 spectrum    1 weight  0.10000E+01 volume  0.12153E-02 ppm1      1.456 ppm2      4.134 CV     1
 ASSI { 4470}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 57   and name HA  ))
      3.400     1.400     1.400 peak  4470 spectrum    1 weight  0.10000E+01 volume  0.12829E-02 ppm1      1.410 ppm2      4.137 CV     1
 ASSI { 4471}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 184  and name HA2 ))
      3.000     1.100     1.100 peak  4471 spectrum    1 weight  0.10000E+01 volume  0.23357E-02 ppm1      2.952 ppm2      3.661 CV     1
 OR { 4471}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 184  and name HA2 ))
 ASSI { 4474}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 57   and name HB3 ))
      2.600     0.800     0.800 peak  4474 spectrum    1 weight  0.10000E+01 volume  0.10186E-01 ppm1      2.952 ppm2      1.778 CV     1
 OR { 4474}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 57   and name HB3 ))
 OR { 4474}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 57   and name HB2 ))
 OR { 4474}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI { 4475}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 57   and name HD3 ))
      1.900     0.400     0.400 peak  4475 spectrum    1 weight  0.10000E+01 volume  0.24217E-01 ppm1      2.952 ppm2      1.642 CV     1
 OR { 4475}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 57   and name HD2 ))
 OR { 4475}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 57   and name HD3 ))
 OR { 4475}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 57   and name HD2 ))
 ASSI { 4476}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 57   and name HG2 ))
      3.000     1.100     1.100 peak  4476 spectrum    1 weight  0.10000E+01 volume  0.72982E-02 ppm1      2.952 ppm2      1.400 CV     1
 OR { 4476}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 57   and name HG2 ))
 ASSI { 4477}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 56   and name HG2 ))
      3.700     1.700     1.700 peak  4477 spectrum    1 weight  0.10000E+01 volume  0.16079E-02 ppm1      2.951 ppm2      2.032 CV     1
 OR { 4477}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 56   and name HG2 ))
 OR { 4477}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 4478}
   (( segid "    " and resid 57   and name HG3 ))
   (( segid "    " and resid 57   and name HD2 ))
      2.800     1.000     1.000 peak  4478 spectrum    1 weight  0.10000E+01 volume  0.27521E-02 ppm1      1.463 ppm2      1.644 CV     1
 OR { 4478}
   (( segid "    " and resid 57   and name HG3 ))
   (( segid "    " and resid 57   and name HD3 ))
 ASSI { 4482}
   (( segid "    " and resid 58   and name HE2 ))
   (( segid "    " and resid 58   and name H   ))
      3.800     1.900     1.900 peak  4482 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      2.924 ppm2      8.038 CV     1
 OR { 4482}
   (( segid "    " and resid 58   and name HE3 ))
   (( segid "    " and resid 58   and name H   ))
 ASSI { 4483}
   (( segid "    " and resid 138  and name HE3 ))
   (( segid "    " and resid 169  and name H   ))
      4.500     2.500     1.500 peak  4483 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      2.909 ppm2      8.341 CV     1
 OR { 4483}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 169  and name H   ))
 ASSI { 4487}
   (( segid "    " and resid 98   and name HE3 ))
   (( segid "    " and resid 99   and name H   ))
      3.700     1.700     1.700 peak  4487 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      2.898 ppm2      8.451 CV     1
 ASSI { 4488}
   (( segid "    " and resid 98   and name HE3 ))
   (( segid "    " and resid 98   and name H   ))
      4.300     2.300     1.700 peak  4488 spectrum    1 weight  0.10000E+01 volume  0.97153E-03 ppm1      2.901 ppm2      9.120 CV     1
 ASSI { 4489}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 50   and name HA  ))
      5.000     3.100     1.000 peak  4489 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      0.833 ppm2      4.701 CV     1
 ASSI { 4491}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HG12))
      2.200     0.600     0.600 peak  4491 spectrum    1 weight  0.10000E+01 volume  0.13046E-01 ppm1      0.788 ppm2      0.926 CV     1
 ASSI { 4492}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 105  and name HB3 ))
      3.700     1.700     1.700 peak  4492 spectrum    1 weight  0.10000E+01 volume  0.59915E-03 ppm1      3.026 ppm2      2.408 CV     1
 ASSI { 4494}
   (  segid "    " and resid 62   and name HD2%)
   (  segid "    " and resid 71   and name HD% )
      2.600     0.900     0.900 peak  4494 spectrum    1 weight  0.10000E+01 volume  0.42618E-02 ppm1     -0.161 ppm2      7.233 CV     1
 ASSI { 4495}
   (  segid "    " and resid 62   and name HD1%)
   (  segid "    " and resid 71   and name HD% )
      3.600     1.600     1.600 peak  4495 spectrum    1 weight  0.10000E+01 volume  0.27014E-02 ppm1      0.403 ppm2      7.229 CV     1
 ASSI { 4496}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 66   and name HD2 ))
      5.000     3.200     1.000 peak  4496 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      1.927 ppm2      0.495 CV     1
 ASSI { 4497}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 66   and name HD2 ))
      3.000     1.100     1.100 peak  4497 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      2.395 ppm2      0.497 CV     1
 ASSI { 4498}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 66   and name HD3 ))
      3.300     1.300     1.300 peak  4498 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      2.286 ppm2      0.855 CV     1
 ASSI { 4499}
   (( segid "    " and resid 63   and name HG3 ))
   (  segid "    " and resid 25   and name HG1%)
      4.400     2.400     1.600 peak  4499 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      2.292 ppm2      0.751 CV     1
 ASSI { 4500}
   (( segid "    " and resid 66   and name HE3 ))
   (  segid "    " and resid 71   and name HE% )
      3.900     1.900     1.900 peak  4500 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      2.245 ppm2      6.869 CV     1
 OR { 4500}
   (( segid "    " and resid 66   and name HE2 ))
   (  segid "    " and resid 71   and name HE% )
 ASSI { 4501}
   (( segid "    " and resid 68   and name HB3 ))
   (  segid "    " and resid 73   and name HD1%)
      3.000     1.100     1.100 peak  4501 spectrum    1 weight  0.10000E+01 volume  0.85304E-03 ppm1      1.085 ppm2      0.823 CV     1
 ASSI { 4507}
   (( segid "    " and resid 178  and name HA  ))
   (( segid "    " and resid 178  and name HD3 ))
      4.100     2.100     1.900 peak  4507 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      4.880 ppm2      3.076 CV     1
 OR { 4507}
   (( segid "    " and resid 178  and name HA  ))
   (( segid "    " and resid 178  and name HD2 ))
 ASSI { 4509}
   (( segid "    " and resid 179  and name HA  ))
   (( segid "    " and resid 108  and name H   ))
      4.000     2.000     2.000 peak  4509 spectrum    1 weight  0.10000E+01 volume  0.64316E-03 ppm1      4.579 ppm2      7.909 CV     1
 ASSI { 4510}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 182  and name H   ))
      3.100     1.200     1.200 peak  4510 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      1.177 ppm2      8.002 CV     1
 ASSI { 4511}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 180  and name H   ))
      3.300     1.300     1.300 peak  4511 spectrum    1 weight  0.10000E+01 volume  0.31312E-02 ppm1      1.175 ppm2      8.967 CV     1
 ASSI { 4512}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 179  and name H   ))
      2.200     0.600     0.600 peak  4512 spectrum    1 weight  0.10000E+01 volume  0.67769E-02 ppm1      1.175 ppm2      9.378 CV     1
 ASSI { 4513}
   (( segid "    " and resid 180  and name HA  ))
   (( segid "    " and resid 180  and name HB3 ))
      2.800     1.000     1.000 peak  4513 spectrum    1 weight  0.10000E+01 volume  0.14184E-02 ppm1      3.838 ppm2      1.173 CV     1
 ASSI { 4515}
   (  segid "    " and resid 180  and name HD2%)
   (  segid "    " and resid 180  and name HD1%)
      2.000     0.500     0.500 peak  4515 spectrum    1 weight  0.10000E+01 volume  0.21120E-01 ppm1      0.596 ppm2      0.745 CV     1
 ASSI { 4516}
   (  segid "    " and resid 180  and name HD1%)
   (( segid "    " and resid 180  and name HB3 ))
      2.800     1.000     1.000 peak  4516 spectrum    1 weight  0.10000E+01 volume  0.34901E-02 ppm1      0.740 ppm2      1.169 CV     1
 ASSI { 4517}
   (  segid "    " and resid 180  and name HD1%)
   (  segid "    " and resid 108  and name HG2%)
      3.900     1.900     1.900 peak  4517 spectrum    1 weight  0.10000E+01 volume  0.25861E-02 ppm1      0.740 ppm2      0.926 CV     1
 ASSI { 4518}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 180  and name HB3 ))
      2.500     0.800     0.800 peak  4518 spectrum    1 weight  0.10000E+01 volume  0.34529E-02 ppm1      0.594 ppm2      1.173 CV     1
 ASSI { 4519}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 180  and name HG  ))
      2.200     0.600     0.600 peak  4519 spectrum    1 weight  0.10000E+01 volume  0.66958E-02 ppm1      0.596 ppm2      1.681 CV     1
 ASSI { 4520}
   (  segid "    " and resid 180  and name HD1%)
   (( segid "    " and resid 180  and name HG  ))
      2.300     0.700     0.700 peak  4520 spectrum    1 weight  0.10000E+01 volume  0.49322E-02 ppm1      0.739 ppm2      1.679 CV     1
 ASSI { 4521}
   (( segid "    " and resid 180  and name HB3 ))
   (( segid "    " and resid 180  and name HG  ))
      3.700     1.700     1.700 peak  4521 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      1.178 ppm2      1.678 CV     1
 ASSI { 4524}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 180  and name HA  ))
      2.400     0.700     0.700 peak  4524 spectrum    1 weight  0.10000E+01 volume  0.61711E-02 ppm1      0.596 ppm2      3.836 CV     1
 ASSI { 4525}
   (  segid "    " and resid 180  and name HD1%)
   (( segid "    " and resid 180  and name HA  ))
      4.200     2.200     1.800 peak  4525 spectrum    1 weight  0.10000E+01 volume  0.21495E-02 ppm1      0.739 ppm2      3.837 CV     1
 ASSI { 4527}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 180  and name H   ))
      3.500     1.500     1.500 peak  4527 spectrum    1 weight  0.10000E+01 volume  0.20344E-02 ppm1      0.592 ppm2      8.964 CV     1
 ASSI { 4528}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 181  and name H   ))
      4.500     2.600     1.500 peak  4528 spectrum    1 weight  0.10000E+01 volume  0.12762E-02 ppm1      0.591 ppm2      8.757 CV     1
 ASSI { 4529}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 111  and name H   ))
      2.600     2.600     3.400 peak  4529 spectrum    1 weight  0.10000E+01 volume  0.73796E-03 ppm1      0.598 ppm2      8.434 CV     1
 ASSI { 4530}
   (  segid "    " and resid 180  and name HD1%)
   (( segid "    " and resid 181  and name H   ))
      2.400     2.400     3.600 peak  4530 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      0.739 ppm2      8.756 CV     1
 ASSI { 4532}
   (( segid "    " and resid 181  and name HA  ))
   (( segid "    " and resid 181  and name H   ))
      3.000     1.200     1.200 peak  4532 spectrum    1 weight  0.10000E+01 volume  0.19329E-02 ppm1      3.977 ppm2      8.751 CV     1
 ASSI { 4533}
   (( segid "    " and resid 181  and name HB3 ))
   (( segid "    " and resid 181  and name H   ))
      3.300     1.400     1.400 peak  4533 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      1.810 ppm2      8.751 CV     1
 ASSI { 4539}
   (( segid "    " and resid 181  and name HA  ))
   (( segid "    " and resid 181  and name HB3 ))
      3.200     1.300     1.300 peak  4539 spectrum    1 weight  0.10000E+01 volume  0.23865E-02 ppm1      3.980 ppm2      1.790 CV     1
 ASSI { 4540}
   (( segid "    " and resid 181  and name HA  ))
   (( segid "    " and resid 181  and name HB2 ))
      2.900     1.000     1.000 peak  4540 spectrum    1 weight  0.10000E+01 volume  0.21529E-02 ppm1      3.977 ppm2      2.086 CV     1
 ASSI { 4541}
   (( segid "    " and resid 181  and name HA  ))
   (( segid "    " and resid 181  and name HG3 ))
      3.000     1.100     1.100 peak  4541 spectrum    1 weight  0.10000E+01 volume  0.21394E-02 ppm1      3.976 ppm2      1.599 CV     1
 ASSI { 4542}
   (( segid "    " and resid 181  and name HA  ))
   (( segid "    " and resid 181  and name HG2 ))
      3.300     1.400     1.400 peak  4542 spectrum    1 weight  0.10000E+01 volume  0.16655E-02 ppm1      3.975 ppm2      1.535 CV     1
 ASSI { 4543}
   (( segid "    " and resid 174  and name HB2 ))
   (  segid "    " and resid 174  and name HD1%)
      3.000     1.100     1.100 peak  4543 spectrum    1 weight  0.10000E+01 volume  0.18076E-02 ppm1      1.259 ppm2      0.674 CV     1
 OR { 4543}
   (( segid "    " and resid 174  and name HB2 ))
   (  segid "    " and resid 174  and name HD2%)
 ASSI { 4544}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 174  and name H   ))
      2.900     1.100     1.100 peak  4544 spectrum    1 weight  0.10000E+01 volume  0.13574E-02 ppm1      4.275 ppm2      8.449 CV     1
 ASSI { 4548}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 129  and name H   ))
      4.900     3.000     1.100 peak  4548 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      0.665 ppm2      8.884 CV     1
 ASSI { 4550}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 175  and name H   ))
      4.500     2.600     1.500 peak  4550 spectrum    1 weight  0.10000E+01 volume  0.18990E-02 ppm1      0.664 ppm2      9.103 CV     1
 ASSI { 4551}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 175  and name H   ))
      2.600     0.800     0.800 peak  4551 spectrum    1 weight  0.10000E+01 volume  0.29045E-02 ppm1      4.264 ppm2      9.111 CV     1
 ASSI { 4552}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 175  and name H   ))
      3.700     1.700     1.700 peak  4552 spectrum    1 weight  0.10000E+01 volume  0.47764E-02 ppm1      0.679 ppm2      9.107 CV     1
 ASSI { 4553}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 173  and name H   ))
      2.500     2.500     3.500 peak  4553 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      0.674 ppm2      7.695 CV     1
 ASSI { 4554}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 183  and name HE22))
      2.700     0.900     0.900 peak  4554 spectrum    1 weight  0.10000E+01 volume  0.16316E-02 ppm1      0.680 ppm2      7.286 CV     1
 ASSI { 4555}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 183  and name HE22))
      3.100     1.200     1.200 peak  4555 spectrum    1 weight  0.10000E+01 volume  0.89028E-03 ppm1      0.662 ppm2      7.286 CV     1
 ASSI { 4556}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 183  and name HE21))
      3.700     1.700     1.700 peak  4556 spectrum    1 weight  0.10000E+01 volume  0.11137E-02 ppm1      0.681 ppm2      6.507 CV     1
 ASSI { 4557}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 183  and name HE21))
      4.200     2.200     1.800 peak  4557 spectrum    1 weight  0.10000E+01 volume  0.86319E-03 ppm1      0.666 ppm2      6.478 CV     1
 ASSI { 4558}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 129  and name HA  ))
      2.600     2.600     3.400 peak  4558 spectrum    1 weight  0.10000E+01 volume  0.74134E-03 ppm1      0.665 ppm2      5.584 CV     1
 ASSI { 4559}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 130  and name HA  ))
      3.900     1.900     1.900 peak  4559 spectrum    1 weight  0.10000E+01 volume  0.19498E-02 ppm1      0.664 ppm2      4.394 CV     1
 ASSI { 4560}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 174  and name HA  ))
      3.700     1.800     1.800 peak  4560 spectrum    1 weight  0.10000E+01 volume  0.25456E-02 ppm1      0.665 ppm2      4.262 CV     1
 ASSI { 4561}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 130  and name HA  ))
      3.500     1.600     1.600 peak  4561 spectrum    1 weight  0.10000E+01 volume  0.24339E-02 ppm1      0.679 ppm2      4.391 CV     1
 ASSI { 4562}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 174  and name HA  ))
      2.100     0.600     0.600 peak  4562 spectrum    1 weight  0.10000E+01 volume  0.10514E-01 ppm1      0.679 ppm2      4.264 CV     1
 ASSI { 4564}
   (( segid "    " and resid 174  and name HB3 ))
   (( segid "    " and resid 174  and name HA  ))
      2.900     1.000     1.000 peak  4564 spectrum    1 weight  0.10000E+01 volume  0.92413E-03 ppm1      1.639 ppm2      4.264 CV     1
 ASSI { 4566}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 180  and name HA  ))
      3.900     1.900     1.900 peak  4566 spectrum    1 weight  0.10000E+01 volume  0.14082E-02 ppm1      0.666 ppm2      3.836 CV     1
 ASSI { 4567}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 131  and name HD3 ))
      2.500     0.800     0.800 peak  4567 spectrum    1 weight  0.10000E+01 volume  0.26676E-02 ppm1      0.680 ppm2      3.063 CV     1
 ASSI { 4568}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 131  and name HD2 ))
      2.600     0.800     0.800 peak  4568 spectrum    1 weight  0.10000E+01 volume  0.35475E-02 ppm1      0.678 ppm2      2.954 CV     1
 ASSI { 4569}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 172  and name HB3 ))
      2.900     1.000     1.000 peak  4569 spectrum    1 weight  0.10000E+01 volume  0.18720E-02 ppm1      0.679 ppm2      2.599 CV     1
 ASSI { 4570}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 183  and name HG3 ))
      3.800     1.800     1.800 peak  4570 spectrum    1 weight  0.10000E+01 volume  0.17975E-02 ppm1      0.679 ppm2      2.551 CV     1
 ASSI { 4571}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 131  and name HD2 ))
      2.600     0.800     0.800 peak  4571 spectrum    1 weight  0.10000E+01 volume  0.12153E-02 ppm1      0.666 ppm2      2.967 CV     1
 ASSI { 4572}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 174  and name HB3 ))
      2.100     0.600     0.600 peak  4572 spectrum    1 weight  0.10000E+01 volume  0.10609E-01 ppm1      0.665 ppm2      1.618 CV     1
 ASSI { 4573}
   (( segid "    " and resid 174  and name HB2 ))
   (( segid "    " and resid 174  and name HB3 ))
      2.100     0.600     0.600 peak  4573 spectrum    1 weight  0.10000E+01 volume  0.13540E-02 ppm1      1.258 ppm2      1.640 CV     1
 ASSI { 4574}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 174  and name HB3 ))
      2.000     0.500     0.500 peak  4574 spectrum    1 weight  0.10000E+01 volume  0.15186E-01 ppm1      0.679 ppm2      1.616 CV     1
 ASSI { 4575}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 183  and name HG2 ))
      3.300     1.400     1.400 peak  4575 spectrum    1 weight  0.10000E+01 volume  0.18821E-02 ppm1      0.681 ppm2      2.240 CV     1
 ASSI { 4576}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 183  and name HB2 ))
      3.300     1.400     1.400 peak  4576 spectrum    1 weight  0.10000E+01 volume  0.27487E-02 ppm1      0.679 ppm2      2.158 CV     1
 ASSI { 4577}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 183  and name HB3 ))
      3.000     1.200     1.200 peak  4577 spectrum    1 weight  0.10000E+01 volume  0.29281E-02 ppm1      0.678 ppm2      2.062 CV     1
 ASSI { 4578}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 131  and name HB2 ))
      2.900     1.000     1.000 peak  4578 spectrum    1 weight  0.10000E+01 volume  0.35747E-02 ppm1      0.680 ppm2      1.989 CV     1
 ASSI { 4579}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 174  and name HB2 ))
      2.900     1.100     1.100 peak  4579 spectrum    1 weight  0.10000E+01 volume  0.60458E-02 ppm1      0.679 ppm2      1.249 CV     1
 ASSI { 4580}
   (  segid "    " and resid 174  and name HD2%)
   (  segid "    " and resid 108  and name HG2%)
      3.400     1.500     1.500 peak  4580 spectrum    1 weight  0.10000E+01 volume  0.31684E-02 ppm1      0.681 ppm2      0.929 CV     1
 ASSI { 4581}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 174  and name HB2 ))
      2.400     0.700     0.700 peak  4581 spectrum    1 weight  0.10000E+01 volume  0.46815E-02 ppm1      0.665 ppm2      1.245 CV     1
 ASSI { 4582}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 129  and name HB2 ))
      3.200     1.300     1.300 peak  4582 spectrum    1 weight  0.10000E+01 volume  0.37540E-02 ppm1      0.666 ppm2      1.169 CV     1
 ASSI { 4585}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 174  and name HB2 ))
      3.300     1.400     1.400 peak  4585 spectrum    1 weight  0.10000E+01 volume  0.12220E-02 ppm1      4.264 ppm2      1.249 CV     1
 ASSI { 4586}
   (( segid "    " and resid 174  and name HB3 ))
   (  segid "    " and resid 174  and name HD1%)
      2.700     0.900     0.900 peak  4586 spectrum    1 weight  0.10000E+01 volume  0.21529E-02 ppm1      1.650 ppm2      0.672 CV     1
 OR { 4586}
   (( segid "    " and resid 174  and name HB3 ))
   (  segid "    " and resid 174  and name HD2%)
 ASSI { 4587}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 171  and name H   ))
      2.600     0.900     0.900 peak  4587 spectrum    1 weight  0.10000E+01 volume  0.65164E-02 ppm1      0.617 ppm2      8.193 CV     1
 ASSI { 4589}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 171  and name HA  ))
      1.900     0.500     0.500 peak  4589 spectrum    1 weight  0.10000E+01 volume  0.21932E-01 ppm1      0.617 ppm2      4.140 CV     1
 ASSI { 4590}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 91   and name HD2 ))
      2.100     0.600     0.600 peak  4590 spectrum    1 weight  0.10000E+01 volume  0.91230E-02 ppm1      0.696 ppm2      2.988 CV     1
 ASSI { 4592}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 170  and name HB3 ))
      2.200     2.200     3.800 peak  4592 spectrum    1 weight  0.10000E+01 volume  0.24339E-02 ppm1      0.616 ppm2      1.927 CV     1
 ASSI { 4593}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 171  and name HG  ))
      1.900     0.500     0.500 peak  4593 spectrum    1 weight  0.10000E+01 volume  0.22826E-01 ppm1      0.617 ppm2      1.428 CV     1
 ASSI { 4594}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 171  and name HB2 ))
      2.800     1.000     1.000 peak  4594 spectrum    1 weight  0.10000E+01 volume  0.10612E-01 ppm1      0.617 ppm2      1.347 CV     1
 ASSI { 4595}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 173  and name HD1 ))
      5.500     3.800     0.500 peak  4595 spectrum    1 weight  0.10000E+01 volume  0.10460E-02 ppm1      0.616 ppm2      7.272 CV     1
 ASSI { 4596}
   (( segid "    " and resid 194  and name HG2 ))
   (( segid "    " and resid 193  and name H   ))
      3.400     1.400     1.400 peak  4596 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      1.433 ppm2      7.886 CV     1
 ASSI { 4597}
   (( segid "    " and resid 171  and name HG  ))
   (( segid "    " and resid 172  and name H   ))
      4.200     2.200     1.800 peak  4597 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1      1.428 ppm2      8.336 CV     1
 ASSI { 4598}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 75   and name H   ))
      3.200     1.200     1.200 peak  4598 spectrum    1 weight  0.10000E+01 volume  0.41569E-02 ppm1      0.692 ppm2      8.345 CV     1
 ASSI { 4603}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 172  and name H   ))
      2.500     2.500     3.500 peak  4603 spectrum    1 weight  0.10000E+01 volume  0.70782E-02 ppm1      4.143 ppm2      8.333 CV     1
 ASSI { 4605}
   (  segid "    " and resid 171  and name HD1%)
   (( segid "    " and resid 173  and name HE1 ))
      2.400     0.700     0.700 peak  4605 spectrum    1 weight  0.10000E+01 volume  0.40453E-02 ppm1      0.692 ppm2     10.155 CV     1
 ASSI { 4606}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 173  and name HE1 ))
      4.600     2.700     1.400 peak  4606 spectrum    1 weight  0.10000E+01 volume  0.15571E-02 ppm1      0.618 ppm2     10.160 CV     1
 ASSI { 4607}
   (  segid "    " and resid 112  and name HD2%)
   (  segid "    " and resid 127  and name HD% )
      3.500     1.500     1.500 peak  4607 spectrum    1 weight  0.10000E+01 volume  0.29518E-02 ppm1      0.694 ppm2      6.838 CV     1
 ASSI { 4608}
   (  segid "    " and resid 112  and name HD2%)
   (  segid "    " and resid 127  and name HE% )
      4.600     2.700     1.400 peak  4608 spectrum    1 weight  0.10000E+01 volume  0.13134E-02 ppm1      0.694 ppm2      6.650 CV     1
 ASSI { 4609}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 129  and name HA  ))
      3.700     1.700     1.700 peak  4609 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      0.690 ppm2      5.575 CV     1
 ASSI { 4612}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 172  and name HA  ))
      4.700     2.800     1.300 peak  4612 spectrum    1 weight  0.10000E+01 volume  0.61608E-03 ppm1      4.142 ppm2      4.777 CV     1
 ASSI { 4613}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 176  and name HB3 ))
      4.200     2.300     1.800 peak  4613 spectrum    1 weight  0.10000E+01 volume  0.17298E-02 ppm1      0.688 ppm2      3.550 CV     1
 ASSI { 4614}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 172  and name HB3 ))
      4.200     2.300     1.800 peak  4614 spectrum    1 weight  0.10000E+01 volume  0.10291E-02 ppm1      4.140 ppm2      2.630 CV     1
 ASSI { 4615}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 172  and name HB2 ))
      3.200     1.300     1.300 peak  4615 spectrum    1 weight  0.10000E+01 volume  0.10561E-02 ppm1      4.139 ppm2      2.836 CV     1
 ASSI { 4616}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 170  and name HB3 ))
      4.500     2.500     1.500 peak  4616 spectrum    1 weight  0.10000E+01 volume  0.64655E-03 ppm1      4.147 ppm2      1.946 CV     1
 ASSI { 4617}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 170  and name HB2 ))
      2.300     2.300     3.700 peak  4617 spectrum    1 weight  0.10000E+01 volume  0.17873E-02 ppm1      0.616 ppm2      1.812 CV     1
 ASSI { 4619}
   (( segid "    " and resid 171  and name HB3 ))
   (( segid "    " and resid 171  and name HB2 ))
      1.700     0.400     0.500 peak  4619 spectrum    1 weight  0.10000E+01 volume  0.62761E-02 ppm1      0.853 ppm2      1.345 CV     1
 ASSI { 4620}
   (( segid "    " and resid 171  and name HB2 ))
   (( segid "    " and resid 171  and name HG  ))
      2.300     0.700     0.700 peak  4620 spectrum    1 weight  0.10000E+01 volume  0.35036E-02 ppm1      1.346 ppm2      1.415 CV     1
 ASSI { 4621}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 171  and name HB2 ))
      2.900     1.100     1.100 peak  4621 spectrum    1 weight  0.10000E+01 volume  0.28231E-02 ppm1      4.142 ppm2      1.344 CV     1
 ASSI { 4622}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 171  and name HB3 ))
      2.300     0.600     0.600 peak  4622 spectrum    1 weight  0.10000E+01 volume  0.97965E-02 ppm1      0.618 ppm2      0.852 CV     1
 ASSI { 4623}
   (( segid "    " and resid 171  and name HB3 ))
   (  segid "    " and resid 171  and name HD1%)
      2.600     0.800     0.800 peak  4623 spectrum    1 weight  0.10000E+01 volume  0.40081E-02 ppm1      0.852 ppm2      0.693 CV     1
 ASSI { 4625}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 171  and name HB3 ))
      2.400     0.700     0.700 peak  4625 spectrum    1 weight  0.10000E+01 volume  0.31617E-02 ppm1      4.145 ppm2      0.849 CV     1
 ASSI { 4629}
   (( segid "    " and resid 171  and name HB2 ))
   (  segid "    " and resid 171  and name HD1%)
      2.700     0.900     0.900 peak  4629 spectrum    1 weight  0.10000E+01 volume  0.48374E-02 ppm1      1.346 ppm2      0.694 CV     1
 ASSI { 4631}
   (( segid "    " and resid 171  and name HB2 ))
   (  segid "    " and resid 130  and name HG2%)
      3.800     1.800     1.800 peak  4631 spectrum    1 weight  0.10000E+01 volume  0.10934E-02 ppm1      1.347 ppm2      0.482 CV     1
 ASSI { 4639}
   (( segid "    " and resid 170  and name HG2 ))
   (( segid "    " and resid 170  and name H   ))
      3.000     1.100     1.100 peak  4639 spectrum    1 weight  0.10000E+01 volume  0.48813E-02 ppm1      2.127 ppm2      7.891 CV     1
 OR { 4639}
   (( segid "    " and resid 170  and name HG3 ))
   (( segid "    " and resid 170  and name H   ))
 ASSI { 4640}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 137  and name H   ))
      2.800     1.000     1.000 peak  4640 spectrum    1 weight  0.10000E+01 volume  0.35646E-02 ppm1      2.140 ppm2      8.178 CV     1
 ASSI { 4643}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 171  and name H   ))
      2.100     0.600     0.600 peak  4643 spectrum    1 weight  0.10000E+01 volume  0.11767E-01 ppm1      4.210 ppm2      8.191 CV     1
 ASSI { 4644}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name H   ))
      2.100     0.600     0.600 peak  4644 spectrum    1 weight  0.10000E+01 volume  0.70850E-02 ppm1      2.143 ppm2      8.366 CV     1
 ASSI { 4645}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 135  and name H   ))
      2.500     0.800     0.800 peak  4645 spectrum    1 weight  0.10000E+01 volume  0.73356E-02 ppm1      2.149 ppm2      8.276 CV     1
 ASSI { 4646}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 172  and name HD21))
      5.000     3.200     1.000 peak  4646 spectrum    1 weight  0.10000E+01 volume  0.10054E-02 ppm1      2.138 ppm2      7.403 CV     1
 OR { 4646}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 172  and name HD21))
 ASSI { 4647}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 172  and name HD22))
      4.100     2.100     1.900 peak  4647 spectrum    1 weight  0.10000E+01 volume  0.14658E-02 ppm1      2.142 ppm2      6.992 CV     1
 OR { 4647}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 172  and name HD22))
 ASSI { 4649}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 135  and name HA  ))
      2.400     0.700     0.700 peak  4649 spectrum    1 weight  0.10000E+01 volume  0.18422E-01 ppm1      2.145 ppm2      4.128 CV     1
 ASSI { 4650}
   (( segid "    " and resid 170  and name HG3 ))
   (( segid "    " and resid 170  and name HA  ))
      2.700     0.900     0.900 peak  4650 spectrum    1 weight  0.10000E+01 volume  0.65942E-02 ppm1      2.131 ppm2      4.207 CV     1
 OR { 4650}
   (( segid "    " and resid 170  and name HG2 ))
   (( segid "    " and resid 170  and name HA  ))
 ASSI { 4651}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 137  and name HE3 ))
      3.400     1.500     1.500 peak  4651 spectrum    1 weight  0.10000E+01 volume  0.26844E-02 ppm1      2.141 ppm2      2.902 CV     1
 ASSI { 4654}
   (( segid "    " and resid 170  and name HB3 ))
   (( segid "    " and resid 170  and name HG3 ))
      2.300     0.600     0.600 peak  4654 spectrum    1 weight  0.10000E+01 volume  0.18226E-01 ppm1      1.938 ppm2      2.120 CV     1
 ASSI { 4656}
   (( segid "    " and resid 170  and name HG2 ))
   (( segid "    " and resid 170  and name HB2 ))
      2.200     0.600     0.600 peak  4656 spectrum    1 weight  0.10000E+01 volume  0.13253E-01 ppm1      2.127 ppm2      1.798 CV     1
 OR { 4656}
   (( segid "    " and resid 170  and name HG3 ))
   (( segid "    " and resid 170  and name HB2 ))
 ASSI { 4658}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 133  and name HG  ))
      3.600     1.600     1.600 peak  4658 spectrum    1 weight  0.10000E+01 volume  0.30906E-02 ppm1      2.142 ppm2      1.482 CV     1
 OR { 4658}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 133  and name HG  ))
 ASSI { 4660}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 62   and name HB3 ))
      3.500     1.500     1.500 peak  4660 spectrum    1 weight  0.10000E+01 volume  0.17535E-02 ppm1      4.211 ppm2      1.433 CV     1
 ASSI { 4662}
   (( segid "    " and resid 181  and name HB3 ))
   (( segid "    " and resid 181  and name HG3 ))
      3.400     1.500     1.500 peak  4662 spectrum    1 weight  0.10000E+01 volume  0.15910E-02 ppm1      1.800 ppm2      1.591 CV     1
 ASSI { 4663}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 192  and name HG  ))
      3.300     1.400     1.400 peak  4663 spectrum    1 weight  0.10000E+01 volume  0.13303E-02 ppm1      1.933 ppm2      1.367 CV     1
 ASSI { 4664}
   (( segid "    " and resid 135  and name HG2 ))
   (  segid "    " and resid 133  and name HD1%)
      2.800     1.000     1.000 peak  4664 spectrum    1 weight  0.10000E+01 volume  0.28265E-02 ppm1      2.139 ppm2      0.817 CV     1
 OR { 4664}
   (( segid "    " and resid 135  and name HG3 ))
   (  segid "    " and resid 133  and name HD1%)
 ASSI { 4665}
   (( segid "    " and resid 170  and name HG3 ))
   (  segid "    " and resid 171  and name HD2%)
      4.500     2.500     1.500 peak  4665 spectrum    1 weight  0.10000E+01 volume  0.16215E-02 ppm1      2.141 ppm2      0.618 CV     1
 OR { 4665}
   (( segid "    " and resid 170  and name HG2 ))
   (  segid "    " and resid 171  and name HD2%)
 ASSI { 4666}
   (( segid "    " and resid 170  and name HA  ))
   (  segid "    " and resid 171  and name HD2%)
      3.900     1.900     1.900 peak  4666 spectrum    1 weight  0.10000E+01 volume  0.89028E-03 ppm1      4.222 ppm2      0.615 CV     1
 ASSI { 4672}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 172  and name HD22))
      4.000     2.000     2.000 peak  4672 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      4.453 ppm2      6.992 CV     1
 ASSI { 4674}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 170  and name HA  ))
      3.400     1.400     1.400 peak  4674 spectrum    1 weight  0.10000E+01 volume  0.29857E-02 ppm1      4.453 ppm2      4.200 CV     1
 ASSI { 4677}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 138  and name HG2 ))
      4.600     2.600     1.400 peak  4677 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      4.457 ppm2      1.329 CV     1
 ASSI { 4678}
   (( segid "    " and resid 169  and name HA  ))
   (  segid "    " and resid 171  and name HD2%)
      4.300     2.300     1.700 peak  4678 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      4.457 ppm2      0.628 CV     1
 ASSI { 4679}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 169  and name H   ))
      2.500     2.500     3.500 peak  4679 spectrum    1 weight  0.10000E+01 volume  0.10697E-01 ppm1      4.197 ppm2      8.325 CV     1
 ASSI { 4680}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name H   ))
      2.400     0.700     0.700 peak  4680 spectrum    1 weight  0.10000E+01 volume  0.53382E-02 ppm1      4.198 ppm2      8.094 CV     1
 ASSI { 4681}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 127  and name H   ))
      3.100     1.200     1.200 peak  4681 spectrum    1 weight  0.10000E+01 volume  0.11814E-02 ppm1      4.187 ppm2      7.827 CV     1
 ASSI { 4682}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name H   ))
      2.800     1.000     1.000 peak  4682 spectrum    1 weight  0.10000E+01 volume  0.18720E-02 ppm1      4.189 ppm2      7.671 CV     1
 ASSI { 4683}
   (( segid "    " and resid 138  and name HB3 ))
   (( segid "    " and resid 170  and name H   ))
      3.500     1.500     1.500 peak  4683 spectrum    1 weight  0.10000E+01 volume  0.88012E-03 ppm1      1.792 ppm2      7.889 CV     1
 ASSI { 4689}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 170  and name H   ))
      4.400     2.400     1.600 peak  4689 spectrum    1 weight  0.10000E+01 volume  0.11171E-02 ppm1      2.905 ppm2      7.877 CV     1
 OR { 4689}
   (( segid "    " and resid 138  and name HE3 ))
   (( segid "    " and resid 170  and name H   ))
 ASSI { 4695}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 197  and name HE% )
      4.200     2.300     1.800 peak  4695 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      4.188 ppm2      7.110 CV     1
 ASSI { 4696}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 197  and name HD% )
      2.500     0.800     0.800 peak  4696 spectrum    1 weight  0.10000E+01 volume  0.22612E-02 ppm1      4.194 ppm2      7.009 CV     1
 ASSI { 4698}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 125  and name HA  ))
      3.000     3.000     3.000 peak  4698 spectrum    1 weight  0.10000E+01 volume  0.25016E-02 ppm1      4.199 ppm2      4.452 CV     1
 ASSI { 4702}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name HA  ))
      2.400     0.700     0.700 peak  4702 spectrum    1 weight  0.10000E+01 volume  0.62996E-02 ppm1      1.698 ppm2      4.199 CV     1
 ASSI { 4713}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HG2 ))
      2.600     0.800     0.800 peak  4713 spectrum    1 weight  0.10000E+01 volume  0.61574E-02 ppm1      4.197 ppm2      1.325 CV     1
 ASSI { 4716}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 196  and name HB3 ))
      3.200     1.300     1.300 peak  4716 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      4.201 ppm2      0.813 CV     1
 ASSI { 4717}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name H   ))
      2.300     0.600     0.600 peak  4717 spectrum    1 weight  0.10000E+01 volume  0.11865E-01 ppm1      4.262 ppm2      8.102 CV     1
 ASSI { 4719}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HA  ))
      3.000     1.100     1.100 peak  4719 spectrum    1 weight  0.10000E+01 volume  0.29686E-02 ppm1      1.281 ppm2      4.607 CV     1
 ASSI { 4720}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HA  ))
      3.000     1.200     1.200 peak  4720 spectrum    1 weight  0.10000E+01 volume  0.37912E-02 ppm1      1.358 ppm2      4.259 CV     1
 ASSI { 4721}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HA  ))
      2.600     0.900     0.900 peak  4721 spectrum    1 weight  0.10000E+01 volume  0.38016E-02 ppm1      1.312 ppm2      4.259 CV     1
 ASSI { 4724}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HG2 ))
      2.500     0.800     0.800 peak  4724 spectrum    1 weight  0.10000E+01 volume  0.69834E-02 ppm1      4.261 ppm2      1.323 CV     1
 OR { 4724}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HG3 ))
 ASSI { 4725}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 169  and name H   ))
      2.600     0.800     0.800 peak  4725 spectrum    1 weight  0.10000E+01 volume  0.74879E-02 ppm1      1.982 ppm2      8.367 CV     1
 ASSI { 4729}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 135  and name H   ))
      2.900     1.100     1.100 peak  4729 spectrum    1 weight  0.10000E+01 volume  0.49728E-02 ppm1      1.977 ppm2      8.276 CV     1
 ASSI { 4731}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 137  and name H   ))
      3.000     1.100     1.100 peak  4731 spectrum    1 weight  0.10000E+01 volume  0.17061E-02 ppm1      2.185 ppm2      8.144 CV     1
 ASSI { 4736}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 137  and name HG3 ))
      2.800     0.900     0.900 peak  4736 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      2.190 ppm2      1.340 CV     1
 ASSI { 4737}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name H   ))
      3.300     1.300     1.300 peak  4737 spectrum    1 weight  0.10000E+01 volume  0.30736E-02 ppm1      2.411 ppm2      8.187 CV     1
 ASSI { 4739}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name H   ))
      2.100     2.100     3.900 peak  4739 spectrum    1 weight  0.10000E+01 volume  0.11300E-01 ppm1      4.420 ppm2      8.275 CV     1
 ASSI { 4740}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name H   ))
      2.400     0.700     0.700 peak  4740 spectrum    1 weight  0.10000E+01 volume  0.61642E-02 ppm1      4.421 ppm2      8.184 CV     1
 ASSI { 4741}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name HG2 ))
      2.400     0.700     0.700 peak  4741 spectrum    1 weight  0.10000E+01 volume  0.34392E-02 ppm1      1.920 ppm2      2.415 CV     1
 ASSI { 4743}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name HA  ))
      3.700     1.700     1.700 peak  4743 spectrum    1 weight  0.10000E+01 volume  0.37607E-02 ppm1      2.411 ppm2      4.417 CV     1
 ASSI { 4746}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HB3 ))
      2.400     0.700     0.700 peak  4746 spectrum    1 weight  0.10000E+01 volume  0.71932E-02 ppm1      4.420 ppm2      1.911 CV     1
 ASSI { 4747}
   (( segid "    " and resid 134  and name HG2 ))
   (  segid "    " and resid 133  and name HD1%)
      5.500     3.700     0.500 peak  4747 spectrum    1 weight  0.10000E+01 volume  0.12457E-02 ppm1      2.414 ppm2      0.807 CV     1
 ASSI { 4749}
   (( segid "    " and resid 31   and name HG3 ))
   (  segid "    " and resid 23   and name HG2%)
      4.400     2.400     1.600 peak  4749 spectrum    1 weight  0.10000E+01 volume  0.81580E-03 ppm1      2.551 ppm2      1.341 CV     1
 ASSI { 4750}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 132  and name H   ))
      3.500     1.500     1.500 peak  4750 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      0.829 ppm2      8.627 CV     1
 ASSI { 4752}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 133  and name H   ))
      2.700     0.900     0.900 peak  4752 spectrum    1 weight  0.10000E+01 volume  0.61236E-02 ppm1      0.826 ppm2      8.196 CV     1
 ASSI { 4754}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 172  and name HD22))
      4.100     2.100     1.900 peak  4754 spectrum    1 weight  0.10000E+01 volume  0.15944E-02 ppm1      0.825 ppm2      6.988 CV     1
 ASSI { 4755}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 132  and name HA  ))
      5.000     3.100     1.000 peak  4755 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      1.484 ppm2      4.113 CV     1
 ASSI { 4758}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 131  and name HA  ))
      3.500     1.600     1.600 peak  4758 spectrum    1 weight  0.10000E+01 volume  0.16993E-02 ppm1      0.828 ppm2      4.426 CV     1
 ASSI { 4759}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 133  and name HA  ))
      2.500     0.800     0.800 peak  4759 spectrum    1 weight  0.10000E+01 volume  0.73796E-02 ppm1      0.826 ppm2      4.300 CV     1
 ASSI { 4762}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 131  and name HD2 ))
      4.200     2.200     1.800 peak  4762 spectrum    1 weight  0.10000E+01 volume  0.18212E-02 ppm1      0.825 ppm2      2.926 CV     1
 ASSI { 4763}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 172  and name HB2 ))
      3.900     1.900     1.900 peak  4763 spectrum    1 weight  0.10000E+01 volume  0.14488E-02 ppm1      0.828 ppm2      2.835 CV     1
 ASSI { 4764}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 172  and name HB3 ))
      4.700     2.700     1.300 peak  4764 spectrum    1 weight  0.10000E+01 volume  0.13744E-02 ppm1      0.829 ppm2      2.628 CV     1
 ASSI { 4765}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 134  and name HG2 ))
      4.900     3.000     1.100 peak  4765 spectrum    1 weight  0.10000E+01 volume  0.11069E-02 ppm1      0.832 ppm2      2.416 CV     1
 ASSI { 4766}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 135  and name HG3 ))
      4.100     2.100     1.900 peak  4766 spectrum    1 weight  0.10000E+01 volume  0.59238E-03 ppm1      1.480 ppm2      2.152 CV     1
 ASSI { 4768}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 135  and name HG3 ))
      3.400     1.400     1.400 peak  4768 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      1.568 ppm2      2.134 CV     1
 ASSI { 4772}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name HB2 ))
      1.500     0.300     0.700 peak  4772 spectrum    1 weight  0.10000E+01 volume  0.12312E-01 ppm1      1.485 ppm2      1.569 CV     1
 ASSI { 4773}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HB2 ))
      2.700     0.900     0.900 peak  4773 spectrum    1 weight  0.10000E+01 volume  0.52131E-02 ppm1      4.300 ppm2      1.570 CV     1
 ASSI { 4774}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HB3 ))
      2.000     0.500     0.500 peak  4774 spectrum    1 weight  0.10000E+01 volume  0.79990E-02 ppm1      4.302 ppm2      1.490 CV     1
 ASSI { 4775}
   (( segid "    " and resid 133  and name HB3 ))
   (  segid "    " and resid 133  and name HD2%)
      2.300     0.600     0.600 peak  4775 spectrum    1 weight  0.10000E+01 volume  0.66653E-02 ppm1      1.485 ppm2      0.808 CV     1
 OR { 4775}
   (( segid "    " and resid 133  and name HB3 ))
   (  segid "    " and resid 133  and name HD1%)
 ASSI { 4776}
   (( segid "    " and resid 133  and name HB2 ))
   (  segid "    " and resid 133  and name HD1%)
      2.300     0.700     0.700 peak  4776 spectrum    1 weight  0.10000E+01 volume  0.71493E-02 ppm1      1.570 ppm2      0.809 CV     1
 OR { 4776}
   (( segid "    " and resid 133  and name HB2 ))
   (  segid "    " and resid 133  and name HD2%)
 ASSI { 4777}
   (( segid "    " and resid 133  and name HA  ))
   (  segid "    " and resid 133  and name HD2%)
      2.500     0.800     0.800 peak  4777 spectrum    1 weight  0.10000E+01 volume  0.99895E-02 ppm1      4.300 ppm2      0.797 CV     1
 OR { 4777}
   (( segid "    " and resid 133  and name HA  ))
   (  segid "    " and resid 133  and name HD1%)
 ASSI { 4778}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name H   ))
      2.500     0.800     0.800 peak  4778 spectrum    1 weight  0.10000E+01 volume  0.28603E-02 ppm1      1.930 ppm2      8.627 CV     1
 ASSI { 4779}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name H   ))
      2.800     1.000     1.000 peak  4779 spectrum    1 weight  0.10000E+01 volume  0.21563E-02 ppm1      2.122 ppm2      8.628 CV     1
 ASSI { 4780}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name H   ))
      3.200     1.300     1.300 peak  4780 spectrum    1 weight  0.10000E+01 volume  0.22172E-02 ppm1      2.014 ppm2      8.627 CV     1
 ASSI { 4781}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 133  and name H   ))
      4.300     2.300     1.700 peak  4781 spectrum    1 weight  0.10000E+01 volume  0.16485E-02 ppm1      2.012 ppm2      8.205 CV     1
 ASSI { 4782}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 133  and name H   ))
      3.500     1.500     1.500 peak  4782 spectrum    1 weight  0.10000E+01 volume  0.17467E-02 ppm1      1.825 ppm2      8.200 CV     1
 ASSI { 4783}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 133  and name H   ))
      3.700     1.700     1.700 peak  4783 spectrum    1 weight  0.10000E+01 volume  0.30906E-02 ppm1      1.933 ppm2      8.199 CV     1
 ASSI { 4784}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 191  and name HA  ))
      5.300     3.500     0.700 peak  4784 spectrum    1 weight  0.10000E+01 volume  0.76166E-03 ppm1      1.843 ppm2      4.888 CV     1
 ASSI { 4785}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HA  ))
      3.100     1.200     1.200 peak  4785 spectrum    1 weight  0.10000E+01 volume  0.36491E-02 ppm1      2.118 ppm2      4.107 CV     1
 ASSI { 4786}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HA  ))
      2.500     0.800     0.800 peak  4786 spectrum    1 weight  0.10000E+01 volume  0.39336E-02 ppm1      2.015 ppm2      4.110 CV     1
 ASSI { 4787}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 131  and name HA  ))
      5.300     3.600     0.700 peak  4787 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      1.829 ppm2      4.455 CV     1
 ASSI { 4788}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HB2 ))
      1.700     0.400     0.500 peak  4788 spectrum    1 weight  0.10000E+01 volume  0.13043E-01 ppm1      1.836 ppm2      1.930 CV     1
 ASSI { 4789}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HG2 ))
      1.500     0.300     0.700 peak  4789 spectrum    1 weight  0.10000E+01 volume  0.22135E-01 ppm1      2.118 ppm2      2.012 CV     1
 ASSI { 4790}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HB2 ))
      2.200     0.600     0.600 peak  4790 spectrum    1 weight  0.10000E+01 volume  0.75623E-02 ppm1      2.119 ppm2      1.929 CV     1
 ASSI { 4791}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HB3 ))
      2.700     0.900     0.900 peak  4791 spectrum    1 weight  0.10000E+01 volume  0.66720E-02 ppm1      2.119 ppm2      1.839 CV     1
 ASSI { 4792}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HB3 ))
      2.400     0.700     0.700 peak  4792 spectrum    1 weight  0.10000E+01 volume  0.73695E-02 ppm1      2.014 ppm2      1.840 CV     1
 ASSI { 4794}
   (( segid "    " and resid 132  and name HG2 ))
   (  segid "    " and resid 192  and name HD2%)
      3.200     1.300     1.300 peak  4794 spectrum    1 weight  0.10000E+01 volume  0.38998E-02 ppm1      2.015 ppm2      0.710 CV     1
 OR { 4794}
   (( segid "    " and resid 132  and name HG2 ))
   (  segid "    " and resid 192  and name HD1%)
 ASSI { 4797}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 82   and name HA  ))
      4.500     2.500     1.500 peak  4797 spectrum    1 weight  0.10000E+01 volume  0.13033E-02 ppm1      1.528 ppm2      4.714 CV     1
 ASSI { 4798}
   (( segid "    " and resid 25   and name HB  ))
   (  segid "    " and resid 64   and name HB% )
      4.600     2.600     1.400 peak  4798 spectrum    1 weight  0.10000E+01 volume  0.96137E-03 ppm1      2.755 ppm2      1.529 CV     1
 ASSI { 4799}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 26   and name H   ))
      3.400     1.400     1.400 peak  4799 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      2.730 ppm2      8.707 CV     1
 ASSI { 4801}
   (  segid "    " and resid 41   and name HB% )
   (( segid "    " and resid 39   and name H   ))
      2.600     2.600     3.400 peak  4801 spectrum    1 weight  0.10000E+01 volume  0.82257E-03 ppm1      1.357 ppm2      7.995 CV     1
 ASSI { 4802}
   (  segid "    " and resid 41   and name HB% )
   (  segid "    " and resid 40   and name HD2%)
      3.900     1.900     1.900 peak  4802 spectrum    1 weight  0.10000E+01 volume  0.23628E-02 ppm1      1.351 ppm2      0.748 CV     1
 ASSI { 4805}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name H   ))
      2.500     0.800     0.800 peak  4805 spectrum    1 weight  0.10000E+01 volume  0.21123E-02 ppm1      3.522 ppm2      8.106 CV     1
 ASSI { 4807}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 48   and name H   ))
      4.100     2.100     1.900 peak  4807 spectrum    1 weight  0.10000E+01 volume  0.85642E-03 ppm1      3.522 ppm2      8.612 CV     1
 ASSI { 4808}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 83   and name HB2 ))
      1.700     0.400     0.500 peak  4808 spectrum    1 weight  0.10000E+01 volume  0.88521E-02 ppm1      1.531 ppm2      1.338 CV     1
 ASSI { 4809}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 83   and name HD3 ))
      2.700     0.900     0.900 peak  4809 spectrum    1 weight  0.10000E+01 volume  0.50911E-02 ppm1      1.530 ppm2      1.456 CV     1
 ASSI { 4810}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 83   and name HE3 ))
      3.400     1.400     1.400 peak  4810 spectrum    1 weight  0.10000E+01 volume  0.84627E-03 ppm1      1.532 ppm2      2.799 CV     1
 OR { 4810}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 83   and name HE2 ))
 ASSI { 4811}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HE2 ))
      2.700     0.900     0.900 peak  4811 spectrum    1 weight  0.10000E+01 volume  0.33276E-02 ppm1      0.913 ppm2      2.788 CV     1
 OR { 4811}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HE3 ))
 OR { 4811}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 83   and name HE2 ))
 OR { 4811}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 83   and name HE3 ))
 ASSI { 4812}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HB2 ))
      2.700     0.900     0.900 peak  4812 spectrum    1 weight  0.10000E+01 volume  0.14962E-02 ppm1      3.528 ppm2      1.332 CV     1
 ASSI { 4815}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name HG2 ))
      5.200     3.400     0.800 peak  4815 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      3.516 ppm2      0.534 CV     1
 ASSI { 4816}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 83   and name HG2 ))
      2.400     0.700     0.700 peak  4816 spectrum    1 weight  0.10000E+01 volume  0.43228E-02 ppm1      1.531 ppm2      0.912 CV     1
 OR { 4816}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 83   and name HG3 ))
 ASSI { 4817}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HG3 ))
      2.700     0.900     0.900 peak  4817 spectrum    1 weight  0.10000E+01 volume  0.21428E-02 ppm1      3.525 ppm2      0.916 CV     1
 OR { 4817}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 4819}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HD3 ))
      2.300     0.700     0.700 peak  4819 spectrum    1 weight  0.10000E+01 volume  0.42381E-02 ppm1      1.339 ppm2      1.451 CV     1
 ASSI { 4821}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 83   and name HG3 ))
      2.000     0.500     0.500 peak  4821 spectrum    1 weight  0.10000E+01 volume  0.13127E-01 ppm1      1.453 ppm2      0.914 CV     1
 OR { 4821}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 83   and name HG2 ))
 OR { 4821}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 83   and name HG3 ))
 OR { 4821}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 4822}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HE3 ))
      4.000     2.000     2.000 peak  4822 spectrum    1 weight  0.10000E+01 volume  0.62624E-03 ppm1      1.339 ppm2      2.795 CV     1
 OR { 4822}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HE2 ))
 ASSI { 4823}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 47   and name HB3 ))
      4.400     2.400     1.600 peak  4823 spectrum    1 weight  0.10000E+01 volume  0.82257E-03 ppm1      1.333 ppm2      1.828 CV     1
 ASSI { 4826}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 83   and name HB2 ))
      2.400     0.700     0.700 peak  4826 spectrum    1 weight  0.10000E+01 volume  0.50743E-02 ppm1      0.913 ppm2      1.334 CV     1
 OR { 4826}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HB2 ))
 ASSI { 4828}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 83   and name HA  ))
      3.100     1.200     1.200 peak  4828 spectrum    1 weight  0.10000E+01 volume  0.18550E-02 ppm1      1.530 ppm2      3.524 CV     1
 ASSI { 4830}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 47   and name HA  ))
      2.600     0.900     0.900 peak  4830 spectrum    1 weight  0.10000E+01 volume  0.12119E-02 ppm1      3.521 ppm2      4.874 CV     1
 ASSI { 4831}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 82   and name HA  ))
      4.100     2.100     1.900 peak  4831 spectrum    1 weight  0.10000E+01 volume  0.59915E-03 ppm1      3.541 ppm2      4.715 CV     1
 ASSI { 4832}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 82   and name HA  ))
      4.400     2.400     1.600 peak  4832 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      1.338 ppm2      4.711 CV     1
 ASSI { 4833}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 47   and name HA  ))
      4.000     2.000     2.000 peak  4833 spectrum    1 weight  0.10000E+01 volume  0.85304E-03 ppm1      0.911 ppm2      4.872 CV     1
 OR { 4833}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 4836}
   (( segid "    " and resid 83   and name HB2 ))
   (  segid "    " and resid 47   and name HE% )
      3.100     1.200     1.200 peak  4836 spectrum    1 weight  0.10000E+01 volume  0.14387E-02 ppm1      1.337 ppm2      7.103 CV     1
 ASSI { 4838}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 85   and name H   ))
      2.100     0.500     0.500 peak  4838 spectrum    1 weight  0.10000E+01 volume  0.45937E-02 ppm1      0.914 ppm2      7.119 CV     1
 OR { 4838}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 85   and name H   ))
 ASSI { 4839}
   (( segid "    " and resid 83   and name HG3 ))
   (  segid "    " and resid 47   and name HD% )
      3.400     1.500     1.500 peak  4839 spectrum    1 weight  0.10000E+01 volume  0.10291E-02 ppm1      0.911 ppm2      6.703 CV     1
 OR { 4839}
   (( segid "    " and resid 83   and name HG2 ))
   (  segid "    " and resid 47   and name HD% )
 ASSI { 4841}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 84   and name H   ))
      4.100     2.100     1.900 peak  4841 spectrum    1 weight  0.10000E+01 volume  0.11035E-02 ppm1      1.538 ppm2      8.107 CV     1
 ASSI { 4843}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 83   and name H   ))
      2.500     0.800     0.800 peak  4843 spectrum    1 weight  0.10000E+01 volume  0.32565E-02 ppm1      1.533 ppm2      8.418 CV     1
 ASSI { 4844}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name H   ))
      2.700     0.900     0.900 peak  4844 spectrum    1 weight  0.10000E+01 volume  0.26572E-02 ppm1      1.340 ppm2      8.419 CV     1
 ASSI { 4845}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 84   and name H   ))
      3.100     1.200     1.200 peak  4845 spectrum    1 weight  0.10000E+01 volume  0.17400E-02 ppm1      0.913 ppm2      8.102 CV     1
 OR { 4845}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 84   and name H   ))
 ASSI { 4846}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name H   ))
      3.900     1.900     1.900 peak  4846 spectrum    1 weight  0.10000E+01 volume  0.17095E-02 ppm1      0.918 ppm2      8.417 CV     1
 OR { 4846}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 83   and name H   ))
 ASSI { 4847}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name H   ))
      3.300     1.400     1.400 peak  4847 spectrum    1 weight  0.10000E+01 volume  0.15368E-02 ppm1      4.443 ppm2      7.671 CV     1
 ASSI { 4850}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 125  and name H   ))
      2.500     0.800     0.800 peak  4850 spectrum    1 weight  0.10000E+01 volume  0.37034E-02 ppm1      2.401 ppm2      8.008 CV     1
 ASSI { 4852}
   (( segid "    " and resid 125  and name HB3 ))
   (( segid "    " and resid 127  and name H   ))
      4.400     2.400     1.600 peak  4852 spectrum    1 weight  0.10000E+01 volume  0.85642E-03 ppm1      2.481 ppm2      7.833 CV     1
 ASSI { 4853}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 124  and name HD2 ))
      4.500     2.500     1.500 peak  4853 spectrum    1 weight  0.10000E+01 volume  0.73119E-03 ppm1      4.439 ppm2      7.081 CV     1
 ASSI { 4855}
   (( segid "    " and resid 125  and name HB3 ))
   (( segid "    " and resid 125  and name HB2 ))
      1.700     0.400     0.500 peak  4855 spectrum    1 weight  0.10000E+01 volume  0.23520E-01 ppm1      2.484 ppm2      2.400 CV     1
 ASSI { 4858}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HB2 ))
      2.600     0.800     0.800 peak  4858 spectrum    1 weight  0.10000E+01 volume  0.77993E-02 ppm1      4.433 ppm2      2.406 CV     1
 ASSI { 4859}
   (( segid "    " and resid 125  and name HB3 ))
   (( segid "    " and resid 126  and name HG3 ))
      4.500     2.500     1.500 peak  4859 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      2.480 ppm2      2.113 CV     1
 ASSI { 4860}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 126  and name HG2 ))
      4.200     2.200     1.800 peak  4860 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      2.395 ppm2      1.821 CV     1
 ASSI { 4862}
   (( segid "    " and resid -1   and name HA  ))
   (( segid "    " and resid 0    and name H   ))
      2.100     0.600     0.600 peak  4862 spectrum    1 weight  0.10000E+01 volume  0.15287E-01 ppm1      4.532 ppm2      8.043 CV     1
 ASSI { 4863}
   (( segid "    " and resid -1   and name HA  ))
   (  segid "    " and resid -1   and name HD% )
      2.700     0.900     0.900 peak  4863 spectrum    1 weight  0.10000E+01 volume  0.72341E-02 ppm1      4.531 ppm2      7.216 CV     1
 ASSI { 4864}
   (( segid "    " and resid -1   and name HA  ))
   (( segid "    " and resid -1   and name HB2 ))
      2.500     0.800     0.800 peak  4864 spectrum    1 weight  0.10000E+01 volume  0.11811E-01 ppm1      4.532 ppm2      3.102 CV     1
 ASSI { 4865}
   (( segid "    " and resid -1   and name HA  ))
   (( segid "    " and resid -1   and name HB3 ))
      2.400     0.700     0.700 peak  4865 spectrum    1 weight  0.10000E+01 volume  0.86015E-02 ppm1      4.532 ppm2      2.987 CV     1
 ASSI { 4867}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 183  and name HE21))
      3.500     1.500     1.500 peak  4867 spectrum    1 weight  0.10000E+01 volume  0.95799E-03 ppm1      0.595 ppm2      6.506 CV     1
 ASSI { 4869}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HG2 ))
      3.300     1.400     1.400 peak  4869 spectrum    1 weight  0.10000E+01 volume  0.17400E-02 ppm1      4.571 ppm2      2.450 CV     1
 OR { 4869}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 4870}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HB3 ))
      2.600     0.900     0.900 peak  4870 spectrum    1 weight  0.10000E+01 volume  0.27588E-02 ppm1      4.571 ppm2      2.256 CV     1
 ASSI { 4871}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 92   and name HG2 ))
      2.100     0.500     0.500 peak  4871 spectrum    1 weight  0.10000E+01 volume  0.41435E-02 ppm1      2.587 ppm2      2.451 CV     1
 OR { 4871}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 4872}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HB3 ))
      2.200     0.600     0.600 peak  4872 spectrum    1 weight  0.10000E+01 volume  0.21902E-02 ppm1      2.449 ppm2      2.255 CV     1
 OR { 4872}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 92   and name HB3 ))
 ASSI { 4876}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 92   and name HA  ))
      3.300     1.300     1.300 peak  4876 spectrum    1 weight  0.10000E+01 volume  0.92413E-03 ppm1      2.590 ppm2      4.564 CV     1
 ASSI { 4878}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 92   and name H   ))
      3.800     1.800     1.800 peak  4878 spectrum    1 weight  0.10000E+01 volume  0.12220E-02 ppm1      2.583 ppm2      8.934 CV     1
 ASSI { 4879}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name H   ))
      2.800     1.000     1.000 peak  4879 spectrum    1 weight  0.10000E+01 volume  0.11780E-02 ppm1      2.445 ppm2      8.939 CV     1
 OR { 4879}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 92   and name H   ))
 ASSI { 4882}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
      4.800     2.800     1.200 peak  4882 spectrum    1 weight  0.10000E+01 volume  0.61608E-03 ppm1      2.449 ppm2      4.799 CV     1
 ASSI { 4883}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name H   ))
      3.100     1.200     1.200 peak  4883 spectrum    1 weight  0.10000E+01 volume  0.90382E-03 ppm1      4.166 ppm2      8.061 CV     1
 ASSI { 4884}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 105  and name H   ))
      4.600     2.700     1.400 peak  4884 spectrum    1 weight  0.10000E+01 volume  0.69056E-03 ppm1      4.180 ppm2      8.618 CV     1
 ASSI { 4885}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 107  and name H   ))
      2.700     0.900     0.900 peak  4885 spectrum    1 weight  0.10000E+01 volume  0.31684E-02 ppm1      4.499 ppm2      8.524 CV     1
 ASSI { 4889}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 19   and name HZ  ))
      4.000     2.000     2.000 peak  4889 spectrum    1 weight  0.10000E+01 volume  0.29146E-02 ppm1      2.052 ppm2      6.975 CV     1
 ASSI { 4890}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 112  and name H   ))
      4.000     2.000     2.000 peak  4890 spectrum    1 weight  0.10000E+01 volume  0.20107E-02 ppm1      1.951 ppm2      8.754 CV     1
 ASSI { 4891}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 111  and name H   ))
      3.600     1.700     1.700 peak  4891 spectrum    1 weight  0.10000E+01 volume  0.31413E-02 ppm1      1.951 ppm2      8.396 CV     1
 ASSI { 4892}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 110  and name H   ))
      2.500     2.500     3.500 peak  4892 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      1.952 ppm2      7.016 CV     1
 ASSI { 4893}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 111  and name HA  ))
      4.000     2.000     2.000 peak  4893 spectrum    1 weight  0.10000E+01 volume  0.23391E-02 ppm1      1.950 ppm2      4.009 CV     1
 ASSI { 4894}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 107  and name HA  ))
      3.600     1.600     1.600 peak  4894 spectrum    1 weight  0.10000E+01 volume  0.20311E-02 ppm1      1.949 ppm2      3.831 CV     1
 ASSI { 4895}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 108  and name HA  ))
      2.500     0.800     0.800 peak  4895 spectrum    1 weight  0.10000E+01 volume  0.24914E-02 ppm1      1.950 ppm2      3.457 CV     1
 ASSI { 4896}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 131  and name HD2 ))
      3.500     1.500     1.500 peak  4896 spectrum    1 weight  0.10000E+01 volume  0.13168E-02 ppm1      1.949 ppm2      2.975 CV     1
 ASSI { 4897}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 106  and name HE3 ))
      2.500     2.500     3.500 peak  4897 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      1.951 ppm2      2.847 CV     1
 ASSI { 4898}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 111  and name HG2 ))
      2.600     0.800     0.800 peak  4898 spectrum    1 weight  0.10000E+01 volume  0.91093E-02 ppm1      1.950 ppm2      2.574 CV     1
 ASSI { 4899}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 111  and name HG3 ))
      2.300     0.700     0.700 peak  4899 spectrum    1 weight  0.10000E+01 volume  0.92279E-02 ppm1      1.950 ppm2      2.242 CV     1
 ASSI { 4901}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 106  and name HD2 ))
      3.000     1.100     1.100 peak  4901 spectrum    1 weight  0.10000E+01 volume  0.27554E-02 ppm1      1.946 ppm2      1.462 CV     1
 ASSI { 4902}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 106  and name HG2 ))
      2.200     2.200     3.800 peak  4902 spectrum    1 weight  0.10000E+01 volume  0.25287E-02 ppm1      1.949 ppm2      1.318 CV     1
 ASSI { 4903}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 180  and name HB3 ))
      3.400     1.400     1.400 peak  4903 spectrum    1 weight  0.10000E+01 volume  0.49929E-02 ppm1      1.950 ppm2      1.171 CV     1
 ASSI { 4904}
   (  segid "    " and resid 111  and name HE% )
   (  segid "    " and resid 108  and name HG2%)
      2.900     1.100     1.100 peak  4904 spectrum    1 weight  0.10000E+01 volume  0.39843E-02 ppm1      1.950 ppm2      0.929 CV     1
 ASSI { 4905}
   (  segid "    " and resid 111  and name HE% )
   (  segid "    " and resid 180  and name HD1%)
      1.700     0.400     0.500 peak  4905 spectrum    1 weight  0.10000E+01 volume  0.33384E-01 ppm1      1.950 ppm2      0.735 CV     1
 ASSI { 4907}
   (  segid "    " and resid 1    and name HE% )
   (( segid "    " and resid 1    and name HG2 ))
      3.200     1.300     1.300 peak  4907 spectrum    1 weight  0.10000E+01 volume  0.84120E-02 ppm1      1.893 ppm2      2.472 CV     1
 ASSI { 4908}
   (  segid "    " and resid 1    and name HE% )
   (( segid "    " and resid 1    and name HA  ))
      2.400     0.700     0.700 peak  4908 spectrum    1 weight  0.10000E+01 volume  0.80463E-02 ppm1      1.901 ppm2      4.383 CV     1
 ASSI { 4909}
   (  segid "    " and resid 1    and name HE% )
   (( segid "    " and resid 3    and name H   ))
      2.500     0.800     0.800 peak  4909 spectrum    1 weight  0.10000E+01 volume  0.75251E-02 ppm1      1.900 ppm2      7.838 CV     1
 ASSI { 4910}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 99   and name HG2%)
      3.100     1.200     1.200 peak  4910 spectrum    1 weight  0.10000E+01 volume  0.20514E-02 ppm1      4.639 ppm2      0.908 CV     1
 ASSI { 4912}
   (( segid "    " and resid 87   and name HG3 ))
   (( segid "    " and resid 88   and name H   ))
      5.500     3.700     0.500 peak  4912 spectrum    1 weight  0.10000E+01 volume  0.61269E-03 ppm1      1.859 ppm2      9.008 CV     1
 ASSI { 4913}
   (( segid "    " and resid 87   and name HD3 ))
   (( segid "    " and resid 86   and name HA  ))
      2.600     0.900     0.900 peak  4913 spectrum    1 weight  0.10000E+01 volume  0.18449E-02 ppm1      3.520 ppm2      4.800 CV     1
 ASSI { 4914}
   (( segid "    " and resid 87   and name HG3 ))
   (( segid "    " and resid 86   and name HA  ))
      4.700     2.800     1.300 peak  4914 spectrum    1 weight  0.10000E+01 volume  0.93429E-03 ppm1      1.863 ppm2      4.800 CV     1
 ASSI { 4915}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 87   and name HA  ))
      3.400     1.400     1.400 peak  4915 spectrum    1 weight  0.10000E+01 volume  0.14658E-02 ppm1      1.683 ppm2      4.631 CV     1
 ASSI { 4917}
   (( segid "    " and resid 87   and name HD3 ))
   (( segid "    " and resid 87   and name HG3 ))
      2.600     0.900     0.900 peak  4917 spectrum    1 weight  0.10000E+01 volume  0.24643E-02 ppm1      3.518 ppm2      1.877 CV     1
 OR { 4917}
   (( segid "    " and resid 87   and name HD3 ))
   (( segid "    " and resid 87   and name HB3 ))
 ASSI { 4919}
   (( segid "    " and resid 87   and name HD3 ))
   (( segid "    " and resid 87   and name HB2 ))
      4.400     2.400     1.600 peak  4919 spectrum    1 weight  0.10000E+01 volume  0.89705E-03 ppm1      3.517 ppm2      1.663 CV     1
 ASSI { 4921}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HB3 ))
      2.500     0.800     0.800 peak  4921 spectrum    1 weight  0.10000E+01 volume  0.30736E-02 ppm1      4.633 ppm2      1.902 CV     1
 ASSI { 4923}
   (( segid "    " and resid 91   and name HA  ))
   (  segid "    " and resid 97   and name HG1%)
      4.300     2.300     1.700 peak  4923 spectrum    1 weight  0.10000E+01 volume  0.15639E-02 ppm1      4.817 ppm2      0.816 CV     1
 ASSI { 4925}
   (( segid "    " and resid 91   and name HB3 ))
   (( segid "    " and resid 91   and name HB2 ))
      2.300     0.700     0.700 peak  4925 spectrum    1 weight  0.10000E+01 volume  0.17433E-02 ppm1      1.710 ppm2      1.370 CV     1
 OR { 4925}
   (( segid "    " and resid 91   and name HB3 ))
   (( segid "    " and resid 91   and name HG3 ))
 ASSI { 4926}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HG3 ))
      2.600     0.900     0.900 peak  4926 spectrum    1 weight  0.10000E+01 volume  0.16993E-02 ppm1      4.815 ppm2      1.363 CV     1
 OR { 4926}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI { 4927}
   (( segid "    " and resid 91   and name HB3 ))
   (( segid "    " and resid 91   and name HA  ))
      3.600     1.600     1.600 peak  4927 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      1.693 ppm2      4.811 CV     1
 ASSI { 4928}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
      3.200     1.300     1.300 peak  4928 spectrum    1 weight  0.10000E+01 volume  0.62285E-03 ppm1      1.368 ppm2      4.803 CV     1
 ASSI { 4929}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 92   and name H   ))
      2.500     0.800     0.800 peak  4929 spectrum    1 weight  0.10000E+01 volume  0.16519E-02 ppm1      4.816 ppm2      8.936 CV     1
 ASSI { 4930}
   (( segid "    " and resid 91   and name HB3 ))
   (( segid "    " and resid 91   and name H   ))
      3.300     1.300     1.300 peak  4930 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      1.721 ppm2      9.214 CV     1
 ASSI { 4932}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name H   ))
      3.100     1.200     1.200 peak  4932 spectrum    1 weight  0.10000E+01 volume  0.80905E-03 ppm1      4.815 ppm2      9.207 CV     1
 ASSI { 4933}
   (( segid "    " and resid 91   and name HG3 ))
   (( segid "    " and resid 91   and name HD3 ))
      3.300     1.400     1.400 peak  4933 spectrum    1 weight  0.10000E+01 volume  0.69395E-03 ppm1      1.378 ppm2      3.183 CV     1
 ASSI { 4934}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 91   and name HD3 ))
      4.600     2.700     1.400 peak  4934 spectrum    1 weight  0.10000E+01 volume  0.57210E-03 ppm1      1.394 ppm2      3.166 CV     1
 ASSI { 4935}
   (( segid "    " and resid 194  and name HB2 ))
   (( segid "    " and resid 173  and name HH2 ))
      4.500     2.500     1.500 peak  4935 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      1.510 ppm2      6.836 CV     1
 ASSI { 4936}
   (( segid "    " and resid 194  and name HB2 ))
   (( segid "    " and resid 173  and name HZ3 ))
      3.500     1.500     1.500 peak  4936 spectrum    1 weight  0.10000E+01 volume  0.65332E-03 ppm1      1.499 ppm2      6.691 CV     1
 ASSI { 4938}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 83   and name H   ))
      4.300     2.400     1.700 peak  4938 spectrum    1 weight  0.10000E+01 volume  0.84965E-03 ppm1      1.698 ppm2      8.414 CV     1
 ASSI { 4939}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 173  and name HH2 ))
      3.700     1.700     1.700 peak  4939 spectrum    1 weight  0.10000E+01 volume  0.89705E-03 ppm1      1.720 ppm2      6.846 CV     1
 ASSI { 4943}
   (( segid "    " and resid 194  and name HB2 ))
   (  segid "    " and resid 93   and name HD1%)
      4.600     2.600     1.400 peak  4943 spectrum    1 weight  0.10000E+01 volume  0.64316E-03 ppm1      1.498 ppm2      0.955 CV     1
 ASSI { 4945}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name H   ))
      3.000     1.100     1.100 peak  4945 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      4.864 ppm2      8.327 CV     1
 ASSI { 4946}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 102  and name H   ))
      2.200     0.600     0.600 peak  4946 spectrum    1 weight  0.10000E+01 volume  0.36491E-02 ppm1      4.868 ppm2      8.819 CV     1
 ASSI { 4948}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 86   and name H   ))
      3.900     1.900     1.900 peak  4948 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      4.876 ppm2      9.314 CV     1
 ASSI { 4949}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HB2 ))
      3.000     1.100     1.100 peak  4949 spectrum    1 weight  0.10000E+01 volume  0.23425E-02 ppm1      4.873 ppm2      1.891 CV     1
 ASSI { 4950}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HG2 ))
      3.300     1.300     1.300 peak  4950 spectrum    1 weight  0.10000E+01 volume  0.11712E-02 ppm1      4.875 ppm2      2.430 CV     1
 ASSI { 4954}
   (( segid "    " and resid 101  and name HB3 ))
   (( segid "    " and resid 101  and name HB2 ))
      2.200     0.600     0.600 peak  4954 spectrum    1 weight  0.10000E+01 volume  0.17400E-02 ppm1      1.568 ppm2      1.888 CV     1
 ASSI { 4955}
   (( segid "    " and resid 101  and name HB3 ))
   (( segid "    " and resid 101  and name HG3 ))
      3.200     1.300     1.300 peak  4955 spectrum    1 weight  0.10000E+01 volume  0.10088E-02 ppm1      1.552 ppm2      2.472 CV     1
 OR { 4955}
   (( segid "    " and resid 101  and name HB3 ))
   (( segid "    " and resid 101  and name HG2 ))
 ASSI { 4956}
   (( segid "    " and resid 101  and name HB3 ))
   (( segid "    " and resid 101  and name HG2 ))
      3.700     1.800     1.800 peak  4956 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      1.583 ppm2      2.430 CV     1
 ASSI { 4957}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HG3 ))
      3.000     1.100     1.100 peak  4957 spectrum    1 weight  0.10000E+01 volume  0.15775E-02 ppm1      1.898 ppm2      2.496 CV     1
 ASSI { 4958}
   (( segid "    " and resid 101  and name HB3 ))
   (  segid "    " and resid 101  and name HE% )
      3.000     1.100     1.100 peak  4958 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      1.573 ppm2      1.741 CV     1
 ASSI { 4961}
   (( segid "    " and resid 124  and name HB3 ))
   (( segid "    " and resid 124  and name HB2 ))
      2.200     0.600     0.600 peak  4961 spectrum    1 weight  0.10000E+01 volume  0.21800E-02 ppm1      3.061 ppm2      2.925 CV     1
 ASSI { 4962}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HB3 ))
      2.700     0.900     0.900 peak  4962 spectrum    1 weight  0.10000E+01 volume  0.28198E-02 ppm1      4.383 ppm2      3.045 CV     1
 ASSI { 4963}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HB2 ))
      2.500     0.800     0.800 peak  4963 spectrum    1 weight  0.10000E+01 volume  0.27453E-02 ppm1      4.378 ppm2      2.923 CV     1
 ASSI { 4965}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 126  and name HA  ))
      3.300     1.400     1.400 peak  4965 spectrum    1 weight  0.10000E+01 volume  0.93090E-03 ppm1      1.841 ppm2      4.171 CV     1
 ASSI { 4966}
   (( segid "    " and resid 194  and name HB3 ))
   (  segid "    " and resid 93   and name HD1%)
      4.200     2.200     1.800 peak  4966 spectrum    1 weight  0.10000E+01 volume  0.78197E-03 ppm1      1.727 ppm2      0.947 CV     1
 ASSI { 4967}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 99   and name H   ))
      4.200     2.200     1.800 peak  4967 spectrum    1 weight  0.10000E+01 volume  0.16553E-02 ppm1      1.515 ppm2      8.414 CV     1
 ASSI { 4969}
   (( segid "    " and resid -2   and name HA  ))
   (  segid "    " and resid -1   and name HD% )
      4.200     2.200     1.800 peak  4969 spectrum    1 weight  0.10000E+01 volume  0.80567E-03 ppm1      4.249 ppm2      7.221 CV     1
 ASSI { 4970}
   (( segid "    " and resid -2   and name HA  ))
   (( segid "    " and resid -3   and name HA  ))
      3.800     1.800     1.800 peak  4970 spectrum    1 weight  0.10000E+01 volume  0.13168E-02 ppm1      4.250 ppm2      4.810 CV     1
 ASSI { 4971}
   (( segid "    " and resid -2   and name HA  ))
   (( segid "    " and resid -2   and name HD3 ))
      3.300     1.400     1.400 peak  4971 spectrum    1 weight  0.10000E+01 volume  0.22782E-02 ppm1      4.252 ppm2      3.788 CV     1
 ASSI { 4972}
   (( segid "    " and resid -2   and name HA  ))
   (( segid "    " and resid -2   and name HD2 ))
      3.500     1.600     1.600 peak  4972 spectrum    1 weight  0.10000E+01 volume  0.22138E-02 ppm1      4.251 ppm2      3.676 CV     1
 ASSI { 4974}
   (( segid "    " and resid -2   and name HA  ))
   (( segid "    " and resid -2   and name HG3 ))
      3.400     1.500     1.500 peak  4974 spectrum    1 weight  0.10000E+01 volume  0.28265E-02 ppm1      4.254 ppm2      1.846 CV     1
 ASSI { 4976}
   (( segid "    " and resid -2   and name HA  ))
   (( segid "    " and resid -2   and name HB2 ))
      2.600     0.800     0.800 peak  4976 spectrum    1 weight  0.10000E+01 volume  0.94173E-02 ppm1      4.255 ppm2      1.600 CV     1
 ASSI { 4977}
   (( segid "    " and resid -2   and name HG3 ))
   (( segid "    " and resid -2   and name HD3 ))
      2.100     0.600     0.600 peak  4977 spectrum    1 weight  0.10000E+01 volume  0.89604E-02 ppm1      1.847 ppm2      3.793 CV     1
 ASSI { 4978}
   (( segid "    " and resid -2   and name HG3 ))
   (( segid "    " and resid -2   and name HD2 ))
      3.000     1.100     1.100 peak  4978 spectrum    1 weight  0.10000E+01 volume  0.50302E-02 ppm1      1.848 ppm2      3.675 CV     1
 ASSI { 4980}
   (( segid "    " and resid -2   and name HG3 ))
   (( segid "    " and resid -2   and name HB3 ))
      2.300     0.600     0.600 peak  4980 spectrum    1 weight  0.10000E+01 volume  0.69971E-02 ppm1      1.851 ppm2      2.089 CV     1
 ASSI { 4981}
   (( segid "    " and resid -2   and name HG3 ))
   (( segid "    " and resid -2   and name HG2 ))
      1.500     0.300     0.700 peak  4981 spectrum    1 weight  0.10000E+01 volume  0.29420E-01 ppm1      1.851 ppm2      1.706 CV     1
 ASSI { 4982}
   (( segid "    " and resid -2   and name HG3 ))
   (( segid "    " and resid -2   and name HB2 ))
      2.900     1.100     1.100 peak  4982 spectrum    1 weight  0.10000E+01 volume  0.49118E-02 ppm1      1.848 ppm2      1.605 CV     1
 ASSI { 4983}
   (( segid "    " and resid -2   and name HG2 ))
   (( segid "    " and resid -2   and name HD3 ))
      3.000     1.100     1.100 peak  4983 spectrum    1 weight  0.10000E+01 volume  0.38623E-02 ppm1      1.701 ppm2      3.793 CV     1
 ASSI { 4984}
   (( segid "    " and resid -2   and name HG2 ))
   (( segid "    " and resid -2   and name HD2 ))
      2.300     0.700     0.700 peak  4984 spectrum    1 weight  0.10000E+01 volume  0.64384E-02 ppm1      1.704 ppm2      3.676 CV     1
 ASSI { 4985}
   (( segid "    " and resid -2   and name HG2 ))
   (( segid "    " and resid -2   and name HA  ))
      4.300     2.300     1.700 peak  4985 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      1.704 ppm2      4.255 CV     1
 ASSI { 4987}
   (( segid "    " and resid 106  and name HD2 ))
   (( segid "    " and resid 106  and name HA  ))
      4.200     2.200     1.800 peak  4987 spectrum    1 weight  0.10000E+01 volume  0.20886E-02 ppm1      1.458 ppm2      4.500 CV     1
 ASSI { 4988}
   (( segid "    " and resid 106  and name HD2 ))
   (( segid "    " and resid 106  and name HE3 ))
      2.900     1.000     1.000 peak  4988 spectrum    1 weight  0.10000E+01 volume  0.24982E-02 ppm1      1.457 ppm2      2.845 CV     1
 ASSI { 4989}
   (( segid "    " and resid 106  and name HD2 ))
   (( segid "    " and resid 106  and name HE2 ))
      2.600     0.800     0.800 peak  4989 spectrum    1 weight  0.10000E+01 volume  0.25693E-02 ppm1      1.460 ppm2      2.746 CV     1
 ASSI { 4990}
   (( segid "    " and resid 106  and name HD2 ))
   (( segid "    " and resid 110  and name HB3 ))
      4.000     2.000     2.000 peak  4990 spectrum    1 weight  0.10000E+01 volume  0.12186E-02 ppm1      1.464 ppm2      2.592 CV     1
 ASSI { 4993}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB3 ))
      2.900     1.000     1.000 peak  4993 spectrum    1 weight  0.10000E+01 volume  0.18415E-02 ppm1      4.495 ppm2      1.948 CV     1
 ASSI { 4994}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
      3.000     1.100     1.100 peak  4994 spectrum    1 weight  0.10000E+01 volume  0.18313E-02 ppm1      4.501 ppm2      1.850 CV     1
 ASSI { 4995}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HD3 ))
      4.400     2.400     1.600 peak  4995 spectrum    1 weight  0.10000E+01 volume  0.14251E-02 ppm1      4.498 ppm2      1.540 CV     1
 ASSI { 4997}
   (( segid "    " and resid 106  and name HD3 ))
   (( segid "    " and resid 106  and name H   ))
      5.000     3.100     1.000 peak  4997 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      1.545 ppm2      7.238 CV     1
 ASSI { 4998}
   (( segid "    " and resid 106  and name HE3 ))
   (( segid "    " and resid 106  and name H   ))
      4.900     3.000     1.100 peak  4998 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      2.842 ppm2      7.250 CV     1
 ASSI { 4999}
   (( segid "    " and resid 106  and name HG2 ))
   (( segid "    " and resid 106  and name HA  ))
      4.200     2.200     1.800 peak  4999 spectrum    1 weight  0.10000E+01 volume  0.13405E-02 ppm1      1.320 ppm2      4.505 CV     1
 ASSI { 5001}
   (( segid "    " and resid 106  and name HD3 ))
   (( segid "    " and resid 107  and name H   ))
      3.800     1.800     1.800 peak  5001 spectrum    1 weight  0.10000E+01 volume  0.11272E-02 ppm1      1.542 ppm2      8.518 CV     1
 ASSI { 5004}
   (( segid "    " and resid 106  and name HE3 ))
   (( segid "    " and resid 106  and name HA  ))
      4.500     2.600     1.500 peak  5004 spectrum    1 weight  0.10000E+01 volume  0.16587E-02 ppm1      2.843 ppm2      4.499 CV     1
 ASSI { 5006}
   (( segid "    " and resid 106  and name HD3 ))
   (( segid "    " and resid 110  and name HB3 ))
      2.500     2.500     3.500 peak  5006 spectrum    1 weight  0.10000E+01 volume  0.19431E-02 ppm1      1.549 ppm2      2.599 CV     1
 ASSI { 5008}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HG3 ))
      3.500     1.500     1.500 peak  5008 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      4.499 ppm2      1.181 CV     1
 ASSI { 5009}
   (( segid "    " and resid 106  and name HB3 ))
   (( segid "    " and resid 106  and name HG2 ))
      2.900     1.100     1.100 peak  5009 spectrum    1 weight  0.10000E+01 volume  0.78874E-03 ppm1      1.947 ppm2      1.325 CV     1
 ASSI { 5010}
   (( segid "    " and resid 106  and name HD3 ))
   (( segid "    " and resid 106  and name HD2 ))
      1.600     0.300     0.600 peak  5010 spectrum    1 weight  0.10000E+01 volume  0.11831E-01 ppm1      1.547 ppm2      1.460 CV     1
 ASSI { 5012}
   (( segid "    " and resid 106  and name HD3 ))
   (( segid "    " and resid 106  and name HG3 ))
      2.700     0.900     0.900 peak  5012 spectrum    1 weight  0.10000E+01 volume  0.28671E-02 ppm1      1.550 ppm2      1.151 CV     1
 ASSI { 5014}
   (( segid "    " and resid 106  and name HE3 ))
   (( segid "    " and resid 106  and name HG3 ))
      3.200     1.300     1.300 peak  5014 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      2.843 ppm2      1.145 CV     1
 ASSI { 5015}
   (( segid "    " and resid 106  and name HE2 ))
   (( segid "    " and resid 106  and name HG3 ))
      3.200     1.300     1.300 peak  5015 spectrum    1 weight  0.10000E+01 volume  0.33682E-02 ppm1      2.750 ppm2      1.143 CV     1
 ASSI { 5016}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 86   and name H   ))
      4.500     2.500     1.500 peak  5016 spectrum    1 weight  0.10000E+01 volume  0.67025E-03 ppm1      4.168 ppm2      9.321 CV     1
 ASSI { 5017}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 104  and name H   ))
      2.600     0.800     0.800 peak  5017 spectrum    1 weight  0.10000E+01 volume  0.19261E-02 ppm1      4.176 ppm2      8.384 CV     1
 ASSI { 5018}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 85   and name HA  ))
      2.700     0.900     0.900 peak  5018 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      4.187 ppm2      4.690 CV     1
 ASSI { 5020}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
      3.200     1.300     1.300 peak  5020 spectrum    1 weight  0.10000E+01 volume  0.13710E-02 ppm1      4.175 ppm2      2.253 CV     1
 ASSI { 5021}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 102  and name HG1%)
      4.600     2.600     1.400 peak  5021 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      4.173 ppm2      0.732 CV     1
 ASSI { 5022}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 108  and name HA  ))
      4.000     2.000     2.000 peak  5022 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      0.601 ppm2      3.479 CV     1
 ASSI { 5023}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 179  and name HA  ))
      4.200     2.200     1.800 peak  5023 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      0.599 ppm2      4.579 CV     1
 ASSI { 5024}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name H   ))
      2.900     1.100     1.100 peak  5024 spectrum    1 weight  0.10000E+01 volume  0.11780E-02 ppm1      4.437 ppm2      8.403 CV     1
 ASSI { 5026}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 191  and name HA  ))
      2.800     1.000     1.000 peak  5026 spectrum    1 weight  0.10000E+01 volume  0.11916E-02 ppm1      4.439 ppm2      4.889 CV     1
 ASSI { 5027}
   (( segid "    " and resid 131  and name HA  ))
   (  segid "    " and resid 130  and name HG2%)
      3.700     1.700     1.700 peak  5027 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      4.432 ppm2      0.476 CV     1
 ASSI { 5028}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 46   and name HB2 ))
      3.700     1.700     1.700 peak  5028 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      1.448 ppm2      2.331 CV     1
 OR { 5028}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI { 5030}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 83   and name H   ))
      4.200     2.200     1.800 peak  5030 spectrum    1 weight  0.10000E+01 volume  0.15605E-02 ppm1      1.452 ppm2      8.427 CV     1
 ASSI { 5031}
   (( segid "    " and resid -2   and name HD2 ))
   (( segid "    " and resid -1   and name H   ))
      2.200     2.200     3.800 peak  5031 spectrum    1 weight  0.10000E+01 volume  0.21529E-02 ppm1      3.676 ppm2      8.158 CV     1
 ASSI { 5032}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 131  and name HB2 ))
      2.600     0.800     0.800 peak  5032 spectrum    1 weight  0.10000E+01 volume  0.41197E-02 ppm1      0.827 ppm2      1.991 CV     1
 ASSI { 5033}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 189  and name HB2 ))
      2.500     0.800     0.800 peak  5033 spectrum    1 weight  0.10000E+01 volume  0.35170E-02 ppm1      0.832 ppm2      1.809 CV     1
 ASSI { 5034}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 135  and name HG2 ))
      3.700     1.700     1.700 peak  5034 spectrum    1 weight  0.10000E+01 volume  0.35679E-02 ppm1      0.826 ppm2      2.138 CV     1
 OR { 5034}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 135  and name HG3 ))
 ASSI { 5035}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 131  and name HE  ))
      3.400     1.500     1.500 peak  5035 spectrum    1 weight  0.10000E+01 volume  0.10020E-02 ppm1      0.828 ppm2      9.035 CV     1
 ASSI { 5037}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 129  and name HB3 ))
      2.100     0.600     0.600 peak  5037 spectrum    1 weight  0.10000E+01 volume  0.41096E-02 ppm1      0.666 ppm2      1.472 CV     1
 ASSI { 5038}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 108  and name HB  ))
      2.700     2.700     3.300 peak  5038 spectrum    1 weight  0.10000E+01 volume  0.68718E-03 ppm1      0.602 ppm2      2.317 CV     1
 ASSI { 5039}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 183  and name HG2 ))
      4.700     2.800     1.300 peak  5039 spectrum    1 weight  0.10000E+01 volume  0.97153E-03 ppm1      0.594 ppm2      2.222 CV     1
 ASSI { 5040}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 183  and name HB3 ))
      3.700     1.700     1.700 peak  5040 spectrum    1 weight  0.10000E+01 volume  0.11645E-02 ppm1      0.598 ppm2      2.049 CV     1
 ASSI { 5041}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 183  and name HG3 ))
      4.500     2.500     1.500 peak  5041 spectrum    1 weight  0.10000E+01 volume  0.64316E-03 ppm1      0.596 ppm2      2.579 CV     1
 ASSI { 5042}
   (  segid "    " and resid 180  and name HD1%)
   (( segid "    " and resid 181  and name HB2 ))
      2.600     2.600     3.400 peak  5042 spectrum    1 weight  0.10000E+01 volume  0.86658E-03 ppm1      0.739 ppm2      2.102 CV     1
 ASSI { 5043}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 61   and name HA  ))
      4.300     2.300     1.700 peak  5043 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      0.828 ppm2      4.867 CV     1
 ASSI { 5044}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 103  and name HB2 ))
      4.100     2.100     1.900 peak  5044 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      1.140 ppm2      2.253 CV     1
 ASSI { 5045}
   (( segid "    " and resid 132  and name HA  ))
   (  segid "    " and resid 130  and name HG2%)
      3.800     1.800     1.800 peak  5045 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      4.115 ppm2      0.477 CV     1
 ASSI { 5050}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 25   and name HG1%)
      3.200     1.300     1.300 peak  5050 spectrum    1 weight  0.10000E+01 volume  0.14251E-02 ppm1      4.244 ppm2      0.740 CV     1
 ASSI { 5051}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 86   and name HG3 ))
      3.000     1.100     1.100 peak  5051 spectrum    1 weight  0.10000E+01 volume  0.77520E-03 ppm1      2.629 ppm2      1.489 CV     1
 OR { 5051}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 86   and name HG2 ))
 ASSI { 5052}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HB3 ))
      2.500     0.800     0.800 peak  5052 spectrum    1 weight  0.10000E+01 volume  0.10663E-02 ppm1      2.621 ppm2      2.482 CV     1
 ASSI { 5054}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HA  ))
      3.200     1.300     1.300 peak  5054 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      2.624 ppm2      4.250 CV     1
 ASSI { 5055}
   (( segid "    " and resid 104  and name HB3 ))
   (( segid "    " and resid 104  and name HA  ))
      4.100     2.100     1.900 peak  5055 spectrum    1 weight  0.10000E+01 volume  0.59915E-03 ppm1      2.506 ppm2      4.245 CV     1
 ASSI { 5056}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name H   ))
      3.300     1.400     1.400 peak  5056 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      2.619 ppm2      8.389 CV     1
 ASSI { 5058}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 61   and name HD1 ))
      4.300     2.300     1.700 peak  5058 spectrum    1 weight  0.10000E+01 volume  0.61947E-03 ppm1      1.037 ppm2      7.289 CV     1
 OR { 5058}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 61   and name HD1 ))
 ASSI { 5060}
   (( segid "    " and resid 91   and name HG3 ))
   (( segid "    " and resid 91   and name HD2 ))
      3.800     1.800     1.800 peak  5060 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      1.373 ppm2      2.989 CV     1
 ASSI { 5061}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HD21))
      4.400     2.400     1.600 peak  5061 spectrum    1 weight  0.10000E+01 volume  0.82595E-03 ppm1      4.636 ppm2      7.495 CV     1
 ASSI { 5062}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 93   and name H   ))
      3.700     1.700     1.700 peak  5062 spectrum    1 weight  0.10000E+01 volume  0.32599E-02 ppm1      1.908 ppm2      8.495 CV     1
 ASSI { 5063}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 94   and name H   ))
      4.100     2.100     1.900 peak  5063 spectrum    1 weight  0.10000E+01 volume  0.25591E-02 ppm1      1.910 ppm2      7.681 CV     1
 ASSI { 5064}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 92   and name H   ))
      2.500     0.800     0.800 peak  5064 spectrum    1 weight  0.10000E+01 volume  0.27554E-02 ppm1      1.908 ppm2      8.934 CV     1
 ASSI { 5065}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name H   ))
      2.900     1.100     1.100 peak  5065 spectrum    1 weight  0.10000E+01 volume  0.27115E-02 ppm1      1.909 ppm2      9.142 CV     1
 ASSI { 5066}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 90   and name H   ))
      3.400     1.400     1.400 peak  5066 spectrum    1 weight  0.10000E+01 volume  0.20006E-02 ppm1      1.909 ppm2      8.810 CV     1
 ASSI { 5067}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 92   and name HA  ))
      2.600     0.800     0.800 peak  5067 spectrum    1 weight  0.10000E+01 volume  0.58021E-02 ppm1      1.909 ppm2      4.576 CV     1
 ASSI { 5069}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 90   and name HA  ))
      4.100     2.100     1.900 peak  5069 spectrum    1 weight  0.10000E+01 volume  0.93768E-03 ppm1      1.909 ppm2      5.035 CV     1
 ASSI { 5070}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 96   and name HB  ))
      3.400     1.400     1.400 peak  5070 spectrum    1 weight  0.10000E+01 volume  0.20683E-02 ppm1      1.909 ppm2      4.084 CV     1
 ASSI { 5071}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name HE3 ))
      3.900     1.900     1.900 peak  5071 spectrum    1 weight  0.10000E+01 volume  0.41502E-02 ppm1      1.909 ppm2      2.879 CV     1
 OR { 5071}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name HE2 ))
 ASSI { 5072}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 92   and name HG3 ))
      2.500     0.800     0.800 peak  5072 spectrum    1 weight  0.10000E+01 volume  0.77993E-02 ppm1      1.907 ppm2      2.580 CV     1
 ASSI { 5073}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 92   and name HG2 ))
      2.400     0.700     0.700 peak  5073 spectrum    1 weight  0.10000E+01 volume  0.82190E-02 ppm1      1.906 ppm2      2.461 CV     1
 OR { 5073}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 5074}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 92   and name HB3 ))
      3.100     1.200     1.200 peak  5074 spectrum    1 weight  0.10000E+01 volume  0.63471E-02 ppm1      1.908 ppm2      2.252 CV     1
 ASSI { 5075}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 90   and name HB  ))
      2.000     0.500     0.500 peak  5075 spectrum    1 weight  0.10000E+01 volume  0.10470E-01 ppm1      1.910 ppm2      1.645 CV     1
 ASSI { 5076}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name HD3 ))
      2.900     1.000     1.000 peak  5076 spectrum    1 weight  0.10000E+01 volume  0.79551E-02 ppm1      1.908 ppm2      1.580 CV     1
 OR { 5076}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name HD2 ))
 ASSI { 5077}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name HB3 ))
      2.900     1.100     1.100 peak  5077 spectrum    1 weight  0.10000E+01 volume  0.81851E-02 ppm1      1.906 ppm2      1.510 CV     1
 ASSI { 5078}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name HG2 ))
      2.000     0.500     0.500 peak  5078 spectrum    1 weight  0.10000E+01 volume  0.95360E-02 ppm1      1.906 ppm2      1.314 CV     1
 OR { 5078}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name HG3 ))
 ASSI { 5079}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 98   and name HG2 ))
      1.900     0.400     0.400 peak  5079 spectrum    1 weight  0.10000E+01 volume  0.89198E-02 ppm1      1.907 ppm2      1.254 CV     1
 ASSI { 5080}
   (  segid "    " and resid 92   and name HE% )
   (  segid "    " and resid 96   and name HG2%)
      2.900     1.000     1.000 peak  5080 spectrum    1 weight  0.10000E+01 volume  0.59543E-02 ppm1      1.906 ppm2      1.068 CV     1
 ASSI { 5082}
   (  segid "    " and resid 92   and name HE% )
   (  segid "    " and resid 90   and name HG2%)
      1.800     0.400     0.400 peak  5082 spectrum    1 weight  0.10000E+01 volume  0.39796E-01 ppm1      1.908 ppm2      0.630 CV     1
 ASSI { 5083}
   (  segid "    " and resid 92   and name HE% )
   (  segid "    " and resid 121  and name HD1%)
      3.100     3.100     2.900 peak  5083 spectrum    1 weight  0.10000E+01 volume  0.62084E-02 ppm1      1.909 ppm2      0.286 CV     1
 ASSI { 5084}
   (  segid "    " and resid 28   and name HB% )
   (  segid "    " and resid 19   and name HD% )
      2.800     1.000     1.000 peak  5084 spectrum    1 weight  0.10000E+01 volume  0.31855E-02 ppm1      1.013 ppm2      7.068 CV     1
 ASSI { 5085}
   (  segid "    " and resid 134  and name HE% )
   (( segid "    " and resid 133  and name HB2 ))
      3.500     1.600     1.600 peak  5085 spectrum    1 weight  0.10000E+01 volume  0.75861E-02 ppm1      1.993 ppm2      1.594 CV     1
 ASSI { 5086}
   (  segid "    " and resid 134  and name HE% )
   (( segid "    " and resid 134  and name HG2 ))
      3.000     1.200     1.200 peak  5086 spectrum    1 weight  0.10000E+01 volume  0.11245E-01 ppm1      1.999 ppm2      2.403 CV     1
 ASSI { 5087}
   (  segid "    " and resid 134  and name HE% )
   (( segid "    " and resid 134  and name HG3 ))
      2.100     0.600     0.600 peak  5087 spectrum    1 weight  0.10000E+01 volume  0.13757E-01 ppm1      1.995 ppm2      2.561 CV     1
 ASSI { 5088}
   (  segid "    " and resid 134  and name HE% )
   (( segid "    " and resid 135  and name HA  ))
      3.000     1.100     1.100 peak  5088 spectrum    1 weight  0.10000E+01 volume  0.27283E-02 ppm1      1.999 ppm2      4.129 CV     1
 ASSI { 5089}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 35   and name H   ))
      3.900     1.900     1.900 peak  5089 spectrum    1 weight  0.10000E+01 volume  0.30906E-02 ppm1      1.683 ppm2      7.521 CV     1
 ASSI { 5090}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 51   and name HA  ))
      4.400     2.400     1.600 peak  5090 spectrum    1 weight  0.10000E+01 volume  0.12796E-02 ppm1      1.470 ppm2      4.423 CV     1
 ASSI { 5092}
   (( segid "    " and resid 196  and name HA  ))
   (( segid "    " and resid 127  and name HA  ))
      4.700     2.800     1.300 peak  5092 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      3.765 ppm2      4.725 CV     1
 ASSI { 5093}
   (( segid "    " and resid 19   and name HB2 ))
   (  segid "    " and resid 79   and name HE% )
      4.200     2.200     1.800 peak  5093 spectrum    1 weight  0.10000E+01 volume  0.62285E-03 ppm1      2.290 ppm2      1.468 CV     1
 ASSI { 5101}
   (( segid "    " and resid -1   and name HB2 ))
   (  segid "    " and resid -1   and name HD% )
      2.500     0.800     0.800 peak  5101 spectrum    1 weight  0.10000E+01 volume  0.71560E-02 ppm1      3.106 ppm2      7.215 CV     1
 ASSI { 5102}
   (( segid "    " and resid -1   and name HB3 ))
   (  segid "    " and resid -1   and name HD% )
      2.500     0.800     0.800 peak  5102 spectrum    1 weight  0.10000E+01 volume  0.69227E-02 ppm1      2.986 ppm2      7.216 CV     1
 ASSI { 5103}
   (( segid "    " and resid 70   and name HB3 ))
   (( segid "    " and resid 67   and name H   ))
      2.100     0.600     0.600 peak  5103 spectrum    1 weight  0.10000E+01 volume  0.56158E-02 ppm1      3.107 ppm2      8.158 CV     1
 ASSI { 5109}
   (( segid "    " and resid 33   and name HD2 ))
   (( segid "    " and resid 33   and name HG2 ))
      3.400     1.400     1.400 peak  5109 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      3.033 ppm2      1.151 CV     1
 OR { 5109}
   (( segid "    " and resid 33   and name HD3 ))
   (( segid "    " and resid 33   and name HG3 ))
 OR { 5109}
   (( segid "    " and resid 33   and name HD3 ))
   (( segid "    " and resid 33   and name HG2 ))
 OR { 5109}
   (( segid "    " and resid 33   and name HD2 ))
   (( segid "    " and resid 33   and name HG3 ))
 ASSI { 5112}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 33   and name HA  ))
      3.600     1.600     1.600 peak  5112 spectrum    1 weight  0.10000E+01 volume  0.73119E-03 ppm1      1.172 ppm2      3.557 CV     1
 OR { 5112}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 33   and name HA  ))
 ASSI { 5113}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 33   and name HB2 ))
      3.000     1.200     1.200 peak  5113 spectrum    1 weight  0.10000E+01 volume  0.16012E-02 ppm1      1.159 ppm2      1.708 CV     1
 OR { 5113}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 33   and name HB3 ))
 OR { 5113}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 33   and name HB2 ))
 OR { 5113}
   (( segid "    " and resid 33   and name HG3 ))
   (( segid "    " and resid 33   and name HB3 ))
 ASSI { 5115}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
      4.600     2.700     1.400 peak  5115 spectrum    1 weight  0.10000E+01 volume  0.62962E-03 ppm1      1.982 ppm2      4.481 CV     1
 ASSI { 5116}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
      3.000     1.100     1.100 peak  5116 spectrum    1 weight  0.10000E+01 volume  0.23290E-02 ppm1      1.981 ppm2      4.703 CV     1
 ASSI { 5117}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HD3 ))
      3.900     1.900     1.900 peak  5117 spectrum    1 weight  0.10000E+01 volume  0.19431E-02 ppm1      1.983 ppm2      3.667 CV     1
 OR { 5117}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HD2 ))
 ASSI { 5118}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 44   and name HD2 ))
      4.100     2.100     1.900 peak  5118 spectrum    1 weight  0.10000E+01 volume  0.12627E-02 ppm1      1.981 ppm2      3.780 CV     1
 ASSI { 5119}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HB3 ))
      1.900     0.500     0.500 peak  5119 spectrum    1 weight  0.10000E+01 volume  0.59915E-02 ppm1      1.980 ppm2      2.326 CV     1
 ASSI { 5121}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 43   and name HA  ))
      2.500     0.800     0.800 peak  5121 spectrum    1 weight  0.10000E+01 volume  0.32160E-02 ppm1      2.325 ppm2      4.706 CV     1
 ASSI { 5122}
   (( segid "    " and resid 58   and name HE2 ))
   (( segid "    " and resid 58   and name HG3 ))
      2.500     0.800     0.800 peak  5122 spectrum    1 weight  0.10000E+01 volume  0.76639E-02 ppm1      2.924 ppm2      1.193 CV     1
 OR { 5122}
   (( segid "    " and resid 58   and name HE3 ))
   (( segid "    " and resid 58   and name HG3 ))
 ASSI { 5125}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 61   and name HH2 ))
      4.600     2.600     1.400 peak  5125 spectrum    1 weight  0.10000E+01 volume  0.84965E-03 ppm1      1.464 ppm2      6.485 CV     1
 ASSI { 5126}
   (( segid "    " and resid 87   and name HD2 ))
   (( segid "    " and resid 87   and name HA  ))
      4.100     2.100     1.900 peak  5126 spectrum    1 weight  0.10000E+01 volume  0.72103E-03 ppm1      3.641 ppm2      4.651 CV     1
 ASSI { 5127}
   (( segid "    " and resid 88   and name HG  ))
   (( segid "    " and resid 88   and name HA  ))
      3.400     1.400     1.400 peak  5127 spectrum    1 weight  0.10000E+01 volume  0.68379E-03 ppm1      1.298 ppm2      4.628 CV     1
 ASSI { 5128}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 90   and name H   ))
      4.200     2.200     1.800 peak  5128 spectrum    1 weight  0.10000E+01 volume  0.64994E-03 ppm1      1.816 ppm2      8.810 CV     1
 OR { 5128}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 90   and name H   ))
 ASSI { 5129}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name H   ))
      3.300     1.300     1.300 peak  5129 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      1.811 ppm2      8.484 CV     1
 OR { 5129}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name H   ))
 ASSI { 5133}
   (( segid "    " and resid 89   and name HD3 ))
   (( segid "    " and resid 89   and name HA  ))
      3.200     1.300     1.300 peak  5133 spectrum    1 weight  0.10000E+01 volume  0.15233E-02 ppm1      1.506 ppm2      4.623 CV     1
 ASSI { 5136}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 98   and name H   ))
      3.000     1.100     1.100 peak  5136 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      1.282 ppm2      9.146 CV     1
 ASSI { 5139}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name H   ))
      3.100     1.200     1.200 peak  5139 spectrum    1 weight  0.10000E+01 volume  0.16147E-02 ppm1      1.516 ppm2      9.138 CV     1
 ASSI { 5140}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 98   and name H   ))
      3.600     1.700     1.700 peak  5140 spectrum    1 weight  0.10000E+01 volume  0.14082E-02 ppm1      1.642 ppm2      9.140 CV     1
 ASSI { 5142}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name H   ))
      2.800     1.000     1.000 peak  5142 spectrum    1 weight  0.10000E+01 volume  0.23086E-02 ppm1      4.606 ppm2      9.136 CV     1
 ASSI { 5145}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 99   and name HA  ))
      3.900     1.900     1.900 peak  5145 spectrum    1 weight  0.10000E+01 volume  0.96476E-03 ppm1      1.636 ppm2      4.901 CV     1
 ASSI { 5146}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 97   and name HA  ))
      3.800     1.800     1.800 peak  5146 spectrum    1 weight  0.10000E+01 volume  0.90721E-03 ppm1      1.500 ppm2      4.863 CV     1
 ASSI { 5147}
   (( segid "    " and resid 98   and name HG3 ))
   (( segid "    " and resid 99   and name H   ))
      3.300     1.400     1.400 peak  5147 spectrum    1 weight  0.10000E+01 volume  0.18110E-02 ppm1      1.319 ppm2      8.420 CV     1
 ASSI { 5148}
   (( segid "    " and resid 112  and name HG  ))
   (( segid "    " and resid 112  and name H   ))
      4.200     2.200     1.800 peak  5148 spectrum    1 weight  0.10000E+01 volume  0.18313E-02 ppm1      1.499 ppm2      8.745 CV     1
 ASSI { 5149}
   (( segid "    " and resid 112  and name HG  ))
   (( segid "    " and resid 113  and name H   ))
      4.400     2.500     1.600 peak  5149 spectrum    1 weight  0.10000E+01 volume  0.70749E-03 ppm1      1.506 ppm2      7.631 CV     1
 ASSI { 5150}
   (( segid "    " and resid 112  and name HG  ))
   (( segid "    " and resid 112  and name HA  ))
      3.000     1.100     1.100 peak  5150 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      1.498 ppm2      3.834 CV     1
 ASSI { 5151}
   (( segid "    " and resid 112  and name HG  ))
   (( segid "    " and resid 112  and name HB3 ))
      2.500     0.800     0.800 peak  5151 spectrum    1 weight  0.10000E+01 volume  0.23154E-02 ppm1      1.505 ppm2      1.777 CV     1
 ASSI { 5152}
   (( segid "    " and resid 112  and name HG  ))
   (  segid "    " and resid 112  and name HD1%)
      2.300     0.700     0.700 peak  5152 spectrum    1 weight  0.10000E+01 volume  0.58155E-02 ppm1      1.501 ppm2      0.742 CV     1
 ASSI { 5153}
   (( segid "    " and resid 112  and name HG  ))
   (  segid "    " and resid 112  and name HD2%)
      2.300     0.700     0.700 peak  5153 spectrum    1 weight  0.10000E+01 volume  0.56532E-02 ppm1      1.501 ppm2      0.681 CV     1
 ASSI { 5154}
   (( segid "    " and resid 112  and name HG  ))
   (  segid "    " and resid 108  and name HG1%)
      5.000     3.100     1.000 peak  5154 spectrum    1 weight  0.10000E+01 volume  0.93768E-03 ppm1      1.489 ppm2      0.496 CV     1
 ASSI { 5156}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 127  and name HE% )
      4.100     2.100     1.900 peak  5156 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      4.385 ppm2      6.642 CV     1
 ASSI { 5157}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 127  and name HD% )
      2.800     1.000     1.000 peak  5157 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      4.380 ppm2      6.864 CV     1
 ASSI { 5160}
   (( segid "    " and resid 126  and name HG3 ))
   (  segid "    " and resid 199  and name HD% )
      4.900     3.000     1.100 peak  5160 spectrum    1 weight  0.10000E+01 volume  0.64994E-03 ppm1      2.128 ppm2      6.972 CV     1
 ASSI { 5162}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 131  and name HD2 ))
      3.900     1.900     1.900 peak  5162 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      1.549 ppm2      2.952 CV     1
 ASSI { 5163}
   (( segid "    " and resid 100  and name HG13))
   (( segid "    " and resid 101  and name HB2 ))
      5.100     3.200     0.900 peak  5163 spectrum    1 weight  0.10000E+01 volume  0.76504E-03 ppm1      1.069 ppm2      1.908 CV     1
 ASSI { 5166}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HG3 ))
      3.900     1.900     1.900 peak  5166 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      4.871 ppm2      2.520 CV     1
 ASSI { 5170}
   (  segid "    " and resid 101  and name HE% )
   (  segid "    " and resid 88   and name HD1%)
      3.900     1.900     1.900 peak  5170 spectrum    1 weight  0.10000E+01 volume  0.20920E-02 ppm1      1.752 ppm2      0.690 CV     1
 ASSI { 5171}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 85   and name HE21))
      2.600     2.600     3.400 peak  5171 spectrum    1 weight  0.10000E+01 volume  0.75150E-03 ppm1      0.736 ppm2      6.445 CV     1
 ASSI { 5179}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 10   and name HG2%)
      4.100     2.100     1.900 peak  5179 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      3.925 ppm2      0.899 CV     1
 ASSI { 5180}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 46   and name H   ))
      3.700     1.700     1.700 peak  5180 spectrum    1 weight  0.10000E+01 volume  0.70749E-03 ppm1      1.997 ppm2      7.852 CV     1
 ASSI { 5181}
   (( segid "    " and resid 63   and name HG2 ))
   (  segid "    " and resid 62   and name HD2%)
      5.300     3.500     0.700 peak  5181 spectrum    1 weight  0.10000E+01 volume  0.74134E-03 ppm1      2.398 ppm2     -0.161 CV     1
 ASSI { 5185}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 50   and name HD% )
      3.400     1.400     1.400 peak  5185 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      4.878 ppm2      5.504 CV     1
 ASSI { 5187}
   (( segid "    " and resid 181  and name HD3 ))
   (  segid "    " and resid 50   and name HE% )
      3.600     1.600     1.600 peak  5187 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      3.201 ppm2      6.511 CV     1
 ASSI { 5188}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 50   and name HE% )
      4.300     2.300     1.700 peak  5188 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      4.892 ppm2      6.498 CV     1
 ASSI { 5189}
   (( segid "    " and resid 197  and name HB3 ))
   (  segid "    " and resid 197  and name HE% )
      4.500     2.500     1.500 peak  5189 spectrum    1 weight  0.10000E+01 volume  0.11103E-02 ppm1      2.688 ppm2      7.105 CV     1
 ASSI { 5192}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 47   and name HD% )
      4.900     3.000     1.100 peak  5192 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      0.685 ppm2      6.720 CV     1
 ASSI { 5193}
   (( segid "    " and resid 24   and name HG2 ))
   (( segid "    " and resid 27   and name H   ))
      4.600     2.600     1.400 peak  5193 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      2.608 ppm2      6.713 CV     1
 ASSI { 5194}
   (( segid "    " and resid 197  and name HB3 ))
   (  segid "    " and resid 199  and name HE% )
      4.300     2.300     1.700 peak  5194 spectrum    1 weight  0.10000E+01 volume  0.82257E-03 ppm1      2.677 ppm2      6.610 CV     1
 ASSI { 5197}
   (( segid "    " and resid 194  and name HD2 ))
   (( segid "    " and resid 194  and name HE  ))
      3.200     1.300     1.300 peak  5197 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      3.014 ppm2      7.331 CV     1
 ASSI { 5199}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 102  and name HG1%)
      2.700     0.900     0.900 peak  5199 spectrum    1 weight  0.10000E+01 volume  0.22172E-02 ppm1      4.011 ppm2      0.737 CV     1
 ASSI { 5200}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 108  and name HA  ))
      4.400     2.400     1.600 peak  5200 spectrum    1 weight  0.10000E+01 volume  0.95122E-03 ppm1      2.580 ppm2      3.450 CV     1
 ASSI { 5201}
   (  segid "    " and resid 112  and name HD1%)
   (  segid "    " and resid 127  and name HE% )
      4.500     2.600     1.500 peak  5201 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1      0.747 ppm2      6.647 CV     1
 ASSI { 5202}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 127  and name H   ))
      3.500     1.500     1.500 peak  5202 spectrum    1 weight  0.10000E+01 volume  0.14488E-02 ppm1      0.684 ppm2      7.831 CV     1
 ASSI { 5203}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 32   and name HA  ))
      2.400     2.400     3.600 peak  5203 spectrum    1 weight  0.10000E+01 volume  0.12491E-02 ppm1      1.111 ppm2      3.235 CV     1
 ASSI { 5204}
   (  segid "    " and resid 39   and name HB% )
   (( segid "    " and resid 81   and name HB2 ))
      3.600     1.600     1.600 peak  5204 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      1.108 ppm2      2.431 CV     1
 ASSI { 5205}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 54   and name HA  ))
      3.700     1.700     1.700 peak  5205 spectrum    1 weight  0.10000E+01 volume  0.95460E-03 ppm1      4.935 ppm2      4.149 CV     1
 ASSI { 5206}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 173  and name HB3 ))
      4.600     2.600     1.400 peak  5206 spectrum    1 weight  0.10000E+01 volume  0.94106E-03 ppm1      0.229 ppm2      3.552 CV     1
 ASSI { 5207}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 129  and name H   ))
      4.100     2.100     1.900 peak  5207 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      0.232 ppm2      8.881 CV     1
 ASSI { 5208}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name HE3 ))
      4.700     2.800     1.300 peak  5208 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.519 ppm2      2.875 CV     1
 ASSI { 5209}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HE3 ))
      4.600     2.600     1.400 peak  5209 spectrum    1 weight  0.10000E+01 volume  0.11611E-02 ppm1      4.603 ppm2      2.883 CV     1
 ASSI { 5210}
   (( segid "    " and resid 98   and name HB2 ))
   (  segid "    " and resid 92   and name HE% )
      4.900     3.100     1.100 peak  5210 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      1.641 ppm2      1.904 CV     1
 ASSI { 5212}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
      2.400     0.700     0.700 peak  5212 spectrum    1 weight  0.10000E+01 volume  0.44143E-02 ppm1      4.605 ppm2      1.632 CV     1
 ASSI { 5213}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB3 ))
      2.700     0.900     0.900 peak  5213 spectrum    1 weight  0.10000E+01 volume  0.29790E-02 ppm1      4.604 ppm2      1.536 CV     1
 ASSI { 5214}
   (( segid "    " and resid 98   and name HB3 ))
   (  segid "    " and resid 96   and name HG2%)
      3.100     1.200     1.200 peak  5214 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      1.515 ppm2      1.072 CV     1
 ASSI { 5215}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 99   and name HG2%)
      3.600     1.600     1.600 peak  5215 spectrum    1 weight  0.10000E+01 volume  0.14691E-02 ppm1      4.612 ppm2      0.913 CV     1
 ASSI { 5216}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 99   and name HA  ))
      3.800     1.800     1.800 peak  5216 spectrum    1 weight  0.10000E+01 volume  0.13913E-02 ppm1      4.612 ppm2      4.942 CV     1
 ASSI { 5217}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 97   and name HA  ))
      3.900     1.900     1.900 peak  5217 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      4.613 ppm2      4.885 CV     1
 ASSI { 5218}
   (( segid "    " and resid 102  and name HB  ))
   (  segid "    " and resid 114  and name HG2%)
      5.100     3.200     0.900 peak  5218 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      1.968 ppm2      1.165 CV     1
 ASSI { 5219}
   (  segid "    " and resid 102  and name HG2%)
   (  segid "    " and resid 114  and name HG2%)
      3.300     1.400     1.400 peak  5219 spectrum    1 weight  0.10000E+01 volume  0.22477E-02 ppm1      0.729 ppm2      1.161 CV     1
 ASSI { 5220}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 40   and name HD2%)
      2.700     0.900     0.900 peak  5220 spectrum    1 weight  0.10000E+01 volume  0.29857E-02 ppm1      1.692 ppm2      0.735 CV     1
 ASSI { 5222}
   (( segid "    " and resid 187  and name HG2 ))
   (( segid "    " and resid 86   and name HE  ))
      4.000     2.000     2.000 peak  5222 spectrum    1 weight  0.10000E+01 volume  0.64655E-03 ppm1      2.052 ppm2      7.397 CV     1
 ASSI { 5223}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 19   and name HZ  ))
      5.000     3.100     1.000 peak  5223 spectrum    1 weight  0.10000E+01 volume  0.62962E-03 ppm1      2.047 ppm2      6.987 CV     1
 ASSI { 5227}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 36   and name HG13))
      1.900     0.500     0.500 peak  5227 spectrum    1 weight  0.10000E+01 volume  0.33682E-02 ppm1      0.903 ppm2      1.483 CV     1
 ASSI { 5232}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 106  and name HB3 ))
      3.200     1.300     1.300 peak  5232 spectrum    1 weight  0.10000E+01 volume  0.15978E-02 ppm1      1.139 ppm2      1.946 CV     1
 ASSI { 5236}
   (( segid "    " and resid 106  and name HG2 ))
   (( segid "    " and resid 103  and name HB2 ))
      2.700     0.900     0.900 peak  5236 spectrum    1 weight  0.10000E+01 volume  0.12085E-02 ppm1      1.316 ppm2      2.247 CV     1
 ASSI { 5237}
   (( segid "    " and resid 106  and name HG2 ))
   (( segid "    " and resid 106  and name HG3 ))
      1.900     0.400     0.400 peak  5237 spectrum    1 weight  0.10000E+01 volume  0.39843E-02 ppm1      1.324 ppm2      1.141 CV     1
 ASSI { 5239}
   (( segid "    " and resid 63   and name HB3 ))
   (  segid "    " and resid 25   and name HG2%)
      3.800     1.800     1.800 peak  5239 spectrum    1 weight  0.10000E+01 volume  0.21597E-02 ppm1      2.056 ppm2      0.996 CV     1
 ASSI { 5240}
   (( segid "    " and resid 63   and name HB2 ))
   (  segid "    " and resid 25   and name HG2%)
      3.800     1.900     1.900 peak  5240 spectrum    1 weight  0.10000E+01 volume  0.20006E-02 ppm1      1.925 ppm2      0.995 CV     1
 ASSI { 5241}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 66   and name HD3 ))
      4.700     2.700     1.300 peak  5241 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      2.054 ppm2      0.862 CV     1
 ASSI { 5242}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 66   and name HD3 ))
      4.300     2.300     1.700 peak  5242 spectrum    1 weight  0.10000E+01 volume  0.10934E-02 ppm1      1.938 ppm2      0.865 CV     1
 ASSI { 5243}
   (( segid "    " and resid 63   and name HB3 ))
   (  segid "    " and resid 25   and name HG1%)
      5.000     3.100     1.000 peak  5243 spectrum    1 weight  0.10000E+01 volume  0.63301E-03 ppm1      2.052 ppm2      0.747 CV     1
 ASSI { 5245}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 98   and name HE2 ))
      2.900     1.100     1.100 peak  5245 spectrum    1 weight  0.10000E+01 volume  0.88012E-03 ppm1      1.900 ppm2      2.904 CV     1
 OR { 5245}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 98   and name HE3 ))
 ASSI { 5246}
   (( segid "    " and resid 182  and name HG3 ))
   (( segid "    " and resid 183  and name HA  ))
      3.600     1.600     1.600 peak  5246 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      2.205 ppm2      4.489 CV     1
 ASSI { 5247}
   (( segid "    " and resid 187  and name HG2 ))
   (( segid "    " and resid 86   and name HD3 ))
      2.600     2.600     3.400 peak  5247 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      2.054 ppm2      2.908 CV     1
 ASSI { 5248}
   (( segid "    " and resid 98   and name HD2 ))
   (( segid "    " and resid 98   and name H   ))
      4.300     2.300     1.700 peak  5248 spectrum    1 weight  0.10000E+01 volume  0.12085E-02 ppm1      1.575 ppm2      9.146 CV     1
 OR { 5248}
   (( segid "    " and resid 98   and name HD3 ))
   (( segid "    " and resid 98   and name H   ))
 ASSI { 5252}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 23   and name H   ))
      3.700     1.700     1.700 peak  5252 spectrum    1 weight  0.10000E+01 volume  0.11306E-02 ppm1      0.322 ppm2      7.719 CV     1
 ASSI { 5253}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 36   and name HB  ))
      3.400     1.400     1.400 peak  5253 spectrum    1 weight  0.10000E+01 volume  0.12627E-02 ppm1      0.899 ppm2      1.872 CV     1
 ASSI { 5254}
   (( segid "    " and resid 36   and name HG12))
   (  segid "    " and resid 36   and name HD1%)
      2.400     0.700     0.700 peak  5254 spectrum    1 weight  0.10000E+01 volume  0.36863E-02 ppm1      0.902 ppm2      0.668 CV     1
 ASSI { 5255}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 36   and name H   ))
      3.900     1.900     1.900 peak  5255 spectrum    1 weight  0.10000E+01 volume  0.12390E-02 ppm1      0.899 ppm2      7.971 CV     1
 ASSI { 5256}
   (( segid "    " and resid 194  and name HD2 ))
   (( segid "    " and resid 173  and name HH2 ))
      4.600     2.600     1.400 peak  5256 spectrum    1 weight  0.10000E+01 volume  0.10426E-02 ppm1      3.016 ppm2      6.834 CV     1
 ASSI { 5258}
   (( segid "    " and resid 194  and name HD2 ))
   (( segid "    " and resid 194  and name HA  ))
      2.200     0.600     0.600 peak  5258 spectrum    1 weight  0.10000E+01 volume  0.39910E-02 ppm1      3.012 ppm2      4.712 CV     1
 ASSI { 5260}
   (( segid "    " and resid 119  and name HG12))
   (( segid "    " and resid 116  and name HA  ))
      2.800     1.000     1.000 peak  5260 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      1.232 ppm2      3.748 CV     1
 ASSI { 5261}
   (( segid "    " and resid 119  and name HG12))
   (( segid "    " and resid 119  and name HA  ))
      4.100     2.100     1.900 peak  5261 spectrum    1 weight  0.10000E+01 volume  0.85981E-03 ppm1      1.250 ppm2      4.321 CV     1
 OR { 5261}
   (( segid "    " and resid 119  and name HG13))
   (( segid "    " and resid 119  and name HA  ))
 ASSI { 5263}
   (( segid "    " and resid 185  and name HA  ))
   (( segid "    " and resid 185  and name HB  ))
      3.200     1.200     1.200 peak  5263 spectrum    1 weight  0.10000E+01 volume  0.95799E-03 ppm1      3.843 ppm2      1.684 CV     1
 ASSI { 5264}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 119  and name HB  ))
      1.900     0.500     0.500 peak  5264 spectrum    1 weight  0.10000E+01 volume  0.18591E-01 ppm1      0.766 ppm2      1.953 CV     1
 ASSI { 5265}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 8    and name HB  ))
      2.100     0.600     0.600 peak  5265 spectrum    1 weight  0.10000E+01 volume  0.67973E-02 ppm1      0.741 ppm2      2.076 CV     1
 ASSI { 5266}
   (  segid "    " and resid -4   and name HD1%)
   (( segid "    " and resid -4   and name HB  ))
      2.500     0.800     0.800 peak  5266 spectrum    1 weight  0.10000E+01 volume  0.10914E-01 ppm1      0.788 ppm2      1.724 CV     1
 ASSI { 5267}
   (  segid "    " and resid -4   and name HD1%)
   (( segid "    " and resid -4   and name HA  ))
      3.100     1.200     1.200 peak  5267 spectrum    1 weight  0.10000E+01 volume  0.50844E-02 ppm1      0.786 ppm2      4.119 CV     1
 ASSI { 5268}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 116  and name HA  ))
      4.500     2.500     1.500 peak  5268 spectrum    1 weight  0.10000E+01 volume  0.19904E-02 ppm1      0.771 ppm2      3.755 CV     1
 ASSI { 5269}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 115  and name HB  ))
      2.200     2.200     3.800 peak  5269 spectrum    1 weight  0.10000E+01 volume  0.20581E-02 ppm1      0.592 ppm2      1.754 CV     1
 ASSI { 5270}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 179  and name HB  ))
      3.100     1.200     1.200 peak  5270 spectrum    1 weight  0.10000E+01 volume  0.31211E-02 ppm1      1.208 ppm2      4.701 CV     1
 ASSI { 5271}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 127  and name HB2 ))
      3.500     1.500     1.500 peak  5271 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      0.574 ppm2      2.789 CV     1
 OR { 5271}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 127  and name HB3 ))
 ASSI { 5272}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 19   and name HB3 ))
      2.900     1.100     1.100 peak  5272 spectrum    1 weight  0.10000E+01 volume  0.15910E-02 ppm1      0.327 ppm2      2.931 CV     1
 ASSI { 5273}
   (( segid "    " and resid 194  and name HG3 ))
   (( segid "    " and resid 173  and name HH2 ))
      3.100     1.200     1.200 peak  5273 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      1.436 ppm2      6.840 CV     1
 OR { 5273}
   (( segid "    " and resid 194  and name HG2 ))
   (( segid "    " and resid 173  and name HH2 ))
 ASSI { 5274}
   (( segid "    " and resid 194  and name HG2 ))
   (( segid "    " and resid 130  and name H   ))
      3.400     1.400     1.400 peak  5274 spectrum    1 weight  0.10000E+01 volume  0.18889E-02 ppm1      1.439 ppm2      8.790 CV     1
 ASSI { 5275}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 83   and name H   ))
      4.600     2.700     1.400 peak  5275 spectrum    1 weight  0.10000E+01 volume  0.11780E-02 ppm1      1.447 ppm2      8.400 CV     1
 ASSI { 5276}
   (( segid "    " and resid 8    and name HG13))
   (( segid "    " and resid 8    and name H   ))
      4.100     2.100     1.900 peak  5276 spectrum    1 weight  0.10000E+01 volume  0.12017E-02 ppm1      1.645 ppm2      9.037 CV     1
 ASSI { 5278}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 180  and name HA  ))
      3.900     1.900     1.900 peak  5278 spectrum    1 weight  0.10000E+01 volume  0.19160E-02 ppm1      0.679 ppm2      3.835 CV     1
 ASSI { 5280}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 53   and name HB2 ))
      3.700     1.700     1.700 peak  5280 spectrum    1 weight  0.10000E+01 volume  0.15402E-02 ppm1      1.703 ppm2      2.123 CV     1
 ASSI { 5282}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 61   and name HH2 ))
      4.400     2.400     1.600 peak  5282 spectrum    1 weight  0.10000E+01 volume  0.46715E-03 ppm1      1.461 ppm2      6.492 CV     1
 ASSI { 5285}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 9    and name H   ))
      4.200     2.200     1.800 peak  5285 spectrum    1 weight  0.10000E+01 volume  0.69733E-03 ppm1      1.989 ppm2      8.858 CV     1
 ASSI { 5287}
   (( segid "    " and resid 131  and name HD3 ))
   (  segid "    " and resid 108  and name HG2%)
      5.300     3.500     0.700 peak  5287 spectrum    1 weight  0.10000E+01 volume  0.61608E-03 ppm1      3.059 ppm2      0.933 CV     1
 ASSI { 5288}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 131  and name HD3 ))
      3.100     1.200     1.200 peak  5288 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      1.539 ppm2      3.077 CV     1
 ASSI { 5289}
   (( segid "    " and resid 131  and name HD2 ))
   (( segid "    " and resid 131  and name HA  ))
      4.700     2.800     1.300 peak  5289 spectrum    1 weight  0.10000E+01 volume  0.59238E-03 ppm1      2.950 ppm2      4.433 CV     1
 ASSI { 5292}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 91   and name HH22))
      3.400     1.400     1.400 peak  5292 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      0.930 ppm2      6.799 CV     1
 ASSI { 5293}
   (( segid "    " and resid 190  and name HB  ))
   (( segid "    " and resid 190  and name HA  ))
      3.500     1.500     1.500 peak  5293 spectrum    1 weight  0.10000E+01 volume  0.10798E-02 ppm1      3.895 ppm2      4.554 CV     1
 ASSI { 5296}
   (( segid "    " and resid 178  and name HD2 ))
   (( segid "    " and resid 182  and name HG2 ))
      3.000     1.100     1.100 peak  5296 spectrum    1 weight  0.10000E+01 volume  0.20040E-02 ppm1      3.045 ppm2      2.580 CV     1
 ASSI { 5297}
   (( segid "    " and resid 178  and name HD3 ))
   (( segid "    " and resid 182  and name HG2 ))
      3.100     1.200     1.200 peak  5297 spectrum    1 weight  0.10000E+01 volume  0.24237E-02 ppm1      3.085 ppm2      2.567 CV     1
 ASSI { 5298}
   (( segid "    " and resid 178  and name HD3 ))
   (( segid "    " and resid 182  and name HG3 ))
      3.700     1.700     1.700 peak  5298 spectrum    1 weight  0.10000E+01 volume  0.14522E-02 ppm1      3.084 ppm2      2.222 CV     1
 ASSI { 5299}
   (( segid "    " and resid 178  and name HD2 ))
   (( segid "    " and resid 182  and name HG3 ))
      3.100     1.200     1.200 peak  5299 spectrum    1 weight  0.10000E+01 volume  0.17196E-02 ppm1      3.047 ppm2      2.225 CV     1
 ASSI { 5300}
   (( segid "    " and resid 178  and name HD3 ))
   (( segid "    " and resid 178  and name HG2 ))
      2.700     0.900     0.900 peak  5300 spectrum    1 weight  0.10000E+01 volume  0.45970E-02 ppm1      3.087 ppm2      1.624 CV     1
 ASSI { 5301}
   (( segid "    " and resid 178  and name HD2 ))
   (( segid "    " and resid 178  and name HG2 ))
      2.500     0.800     0.800 peak  5301 spectrum    1 weight  0.10000E+01 volume  0.43905E-02 ppm1      3.046 ppm2      1.623 CV     1
 ASSI { 5302}
   (( segid "    " and resid 178  and name HD3 ))
   (( segid "    " and resid 178  and name HG3 ))
      2.400     0.700     0.700 peak  5302 spectrum    1 weight  0.10000E+01 volume  0.55178E-02 ppm1      3.086 ppm2      1.531 CV     1
 ASSI { 5303}
   (( segid "    " and resid 178  and name HD2 ))
   (( segid "    " and resid 178  and name HG3 ))
      2.500     0.800     0.800 peak  5303 spectrum    1 weight  0.10000E+01 volume  0.47221E-02 ppm1      3.045 ppm2      1.532 CV     1
 ASSI { 5304}
   (( segid "    " and resid 178  and name HD3 ))
   (  segid "    " and resid 179  and name HG2%)
      4.300     2.300     1.700 peak  5304 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      3.084 ppm2      1.184 CV     1
 ASSI { 5305}
   (( segid "    " and resid 178  and name HD2 ))
   (  segid "    " and resid 179  and name HG2%)
      4.400     2.400     1.600 peak  5305 spectrum    1 weight  0.10000E+01 volume  0.69056E-03 ppm1      3.047 ppm2      1.194 CV     1
 ASSI { 5308}
   (  segid "    " and resid 190  and name HG2%)
   (  segid "    " and resid 192  and name HD2%)
      2.300     0.700     0.700 peak  5308 spectrum    1 weight  0.10000E+01 volume  0.89434E-02 ppm1      0.926 ppm2      0.695 CV     1
 ASSI { 5309}
   (( segid "    " and resid 190  and name HA  ))
   (( segid "    " and resid 89   and name HG3 ))
      2.400     2.400     3.600 peak  5309 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      4.563 ppm2      1.354 CV     1
 ASSI { 5310}
   (( segid "    " and resid 190  and name HA  ))
   (( segid "    " and resid 191  and name HB2 ))
      4.400     2.400     1.600 peak  5310 spectrum    1 weight  0.10000E+01 volume  0.10528E-02 ppm1      4.560 ppm2      1.619 CV     1
 OR { 5310}
   (( segid "    " and resid 190  and name HA  ))
   (( segid "    " and resid 191  and name HG  ))
 ASSI { 5311}
   (( segid "    " and resid 190  and name HA  ))
   (( segid "    " and resid 89   and name HB2 ))
      3.300     1.300     1.300 peak  5311 spectrum    1 weight  0.10000E+01 volume  0.11272E-02 ppm1      4.550 ppm2      1.828 CV     1
 OR { 5311}
   (( segid "    " and resid 190  and name HA  ))
   (( segid "    " and resid 89   and name HB3 ))
 ASSI { 5312}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 132  and name HG3 ))
      4.200     2.200     1.800 peak  5312 spectrum    1 weight  0.10000E+01 volume  0.89028E-03 ppm1      0.923 ppm2      2.118 CV     1
 ASSI { 5313}
   (( segid "    " and resid 190  and name HA  ))
   (( segid "    " and resid 89   and name HE3 ))
      3.200     1.300     1.300 peak  5313 spectrum    1 weight  0.10000E+01 volume  0.61269E-03 ppm1      4.544 ppm2      2.801 CV     1
 ASSI { 5315}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 192  and name HA  ))
      3.200     1.300     1.300 peak  5315 spectrum    1 weight  0.10000E+01 volume  0.27658E-02 ppm1      0.927 ppm2      4.701 CV     1
 ASSI { 5316}
   (  segid "    " and resid 190  and name HG2%)
   (( segid "    " and resid 91   and name HA  ))
      3.800     1.800     1.800 peak  5316 spectrum    1 weight  0.10000E+01 volume  0.15639E-02 ppm1      0.927 ppm2      4.819 CV     1
 ASSI { 5318}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 189  and name HB2 ))
      4.000     2.000     2.000 peak  5318 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      1.492 ppm2      1.796 CV     1
 ASSI { 5319}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HB3 ))
      1.400     0.300     0.800 peak  5319 spectrum    1 weight  0.10000E+01 volume  0.19353E-01 ppm1      1.572 ppm2      1.495 CV     1
 OR { 5319}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HG  ))
 ASSI { 5320}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 46   and name HB2 ))
      5.000     3.100     1.000 peak  5320 spectrum    1 weight  0.10000E+01 volume  0.96137E-03 ppm1      1.893 ppm2      2.308 CV     1
 ASSI { 5321}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 83   and name HG2 ))
      3.200     1.300     1.300 peak  5321 spectrum    1 weight  0.10000E+01 volume  0.74134E-03 ppm1      1.553 ppm2      0.913 CV     1
 OR { 5321}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 83   and name HG3 ))
 ASSI { 5322}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 83   and name HG3 ))
      3.500     1.600     1.600 peak  5322 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      2.320 ppm2      0.921 CV     1
 OR { 5322}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 5324}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 83   and name HD2 ))
      4.200     2.300     1.800 peak  5324 spectrum    1 weight  0.10000E+01 volume  0.13202E-02 ppm1      1.890 ppm2      1.461 CV     1
 ASSI { 5327}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 57   and name HG2 ))
      2.900     1.000     1.000 peak  5327 spectrum    1 weight  0.10000E+01 volume  0.13811E-02 ppm1      2.023 ppm2      1.438 CV     1
 OR { 5327}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI { 5328}
   (( segid "    " and resid 185  and name HA  ))
   (( segid "    " and resid 186  and name HG3 ))
      5.100     3.200     0.900 peak  5328 spectrum    1 weight  0.10000E+01 volume  0.59915E-03 ppm1      3.841 ppm2      2.391 CV     1
 ASSI { 5329}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 182  and name HA  ))
      3.600     1.600     1.600 peak  5329 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      1.786 ppm2      4.389 CV     1
 OR { 5329}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 182  and name HA  ))
 ASSI { 5330}
   (( segid "    " and resid 182  and name HG2 ))
   (( segid "    " and resid 179  and name HB  ))
      2.800     2.800     3.200 peak  5330 spectrum    1 weight  0.10000E+01 volume  0.53147E-03 ppm1      2.568 ppm2      4.703 CV     1
 ASSI { 5331}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 57   and name HG2 ))
      4.800     2.900     1.200 peak  5331 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      4.388 ppm2      1.402 CV     1
 ASSI { 5332}
   (( segid "    " and resid 58   and name HG3 ))
   (( segid "    " and resid 55   and name HB3 ))
      4.700     2.700     1.300 peak  5332 spectrum    1 weight  0.10000E+01 volume  0.76166E-03 ppm1      1.190 ppm2      2.438 CV     1
 ASSI { 5333}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 92   and name HB2 ))
      4.200     2.200     1.800 peak  5333 spectrum    1 weight  0.10000E+01 volume  0.10088E-02 ppm1      1.280 ppm2      2.441 CV     1
 ASSI { 5334}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 55   and name HA  ))
      4.400     2.400     1.600 peak  5334 spectrum    1 weight  0.10000E+01 volume  0.99184E-03 ppm1      1.623 ppm2      4.930 CV     1
 ASSI { 5339}
   (( segid "    " and resid 187  and name HA  ))
   (( segid "    " and resid 86   and name HE  ))
      4.500     2.500     1.500 peak  5339 spectrum    1 weight  0.10000E+01 volume  0.76504E-03 ppm1      3.829 ppm2      7.381 CV     1
 ASSI { 5340}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name H   ))
      3.900     1.900     1.900 peak  5340 spectrum    1 weight  0.10000E+01 volume  0.16316E-02 ppm1      1.926 ppm2      8.483 CV     1
 ASSI { 5342}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 129  and name HA  ))
      4.200     2.200     1.800 peak  5342 spectrum    1 weight  0.10000E+01 volume  0.61947E-03 ppm1      4.407 ppm2      5.582 CV     1
 ASSI { 5343}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 173  and name HD1 ))
      4.900     2.900     1.100 peak  5343 spectrum    1 weight  0.10000E+01 volume  0.81918E-03 ppm1      0.228 ppm2      7.273 CV     1
 ASSI { 5344}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 46   and name HB2 ))
      4.200     2.200     1.800 peak  5344 spectrum    1 weight  0.10000E+01 volume  0.87335E-03 ppm1      2.574 ppm2      2.323 CV     1
 ASSI { 5345}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 62   and name HA  ))
      3.500     1.500     1.500 peak  5345 spectrum    1 weight  0.10000E+01 volume  0.53147E-03 ppm1      0.504 ppm2      3.901 CV     1
 ASSI { 5347}
   (( segid "    " and resid 178  and name HD2 ))
   (( segid "    " and resid 179  and name H   ))
      3.800     1.800     1.800 peak  5347 spectrum    1 weight  0.10000E+01 volume  0.95799E-03 ppm1      3.043 ppm2      9.386 CV     1
 ASSI { 5348}
   (( segid "    " and resid 178  and name HD3 ))
   (( segid "    " and resid 179  and name H   ))
      3.700     1.700     1.700 peak  5348 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      3.090 ppm2      9.373 CV     1
 ASSI { 5349}
   (( segid "    " and resid 178  and name HD3 ))
   (( segid "    " and resid 178  and name H   ))
      4.000     2.000     2.000 peak  5349 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      3.087 ppm2      7.009 CV     1
 ASSI { 5350}
   (( segid "    " and resid 178  and name HD2 ))
   (( segid "    " and resid 178  and name H   ))
      4.400     2.400     1.600 peak  5350 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      3.053 ppm2      7.013 CV     1
 ASSI { 5351}
   (( segid "    " and resid 80   and name HG2 ))
   (( segid "    " and resid 82   and name HB3 ))
      3.200     1.300     1.300 peak  5351 spectrum    1 weight  0.10000E+01 volume  0.75827E-03 ppm1      2.005 ppm2      1.707 CV     1
 ASSI { 5352}
   (( segid "    " and resid 82   and name HG3 ))
   (( segid "    " and resid 80   and name HB3 ))
      4.300     2.300     1.700 peak  5352 spectrum    1 weight  0.10000E+01 volume  0.95460E-03 ppm1      1.542 ppm2      1.963 CV     1
 ASSI { 5353}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 30   and name H   ))
      5.100     3.300     0.900 peak  5353 spectrum    1 weight  0.10000E+01 volume  0.50777E-03 ppm1      3.886 ppm2      7.163 CV     1
 ASSI { 5354}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 30   and name H   ))
      5.900     4.300     0.100 peak  5354 spectrum    1 weight  0.10000E+01 volume  0.58561E-03 ppm1      2.725 ppm2      7.157 CV     1
 ASSI { 5357}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HB2 ))
      2.700     0.900     0.900 peak  5357 spectrum    1 weight  0.10000E+01 volume  0.80701E-02 ppm1      4.262 ppm2      1.687 CV     1
 ASSI { 5359}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HB3 ))
      2.200     0.600     0.600 peak  5359 spectrum    1 weight  0.10000E+01 volume  0.10240E-01 ppm1      4.262 ppm2      1.806 CV     1
 ASSI { 5360}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 196  and name HB2 ))
      3.500     1.600     1.600 peak  5360 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      3.671 ppm2      0.887 CV     1
 OR { 5360}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 196  and name HD2 ))
 ASSI { 5361}
   (( segid "    " and resid 196  and name HD3 ))
   (( segid "    " and resid 128  and name HB2 ))
      4.300     2.300     1.700 peak  5361 spectrum    1 weight  0.10000E+01 volume  0.86658E-03 ppm1      0.543 ppm2      3.670 CV     1
 ASSI { 5362}
   (( segid "    " and resid 196  and name HD2 ))
   (( segid "    " and resid 196  and name HG3 ))
      3.000     1.100     1.100 peak  5362 spectrum    1 weight  0.10000E+01 volume  0.11983E-02 ppm1      0.887 ppm2      0.173 CV     1
 ASSI { 5363}
   (( segid "    " and resid 181  and name HD2 ))
   (( segid "    " and resid 181  and name HB2 ))
      4.000     2.000     2.000 peak  5363 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      3.407 ppm2      2.063 CV     1
 ASSI { 5364}
   (( segid "    " and resid 181  and name HD2 ))
   (( segid "    " and resid 181  and name HB3 ))
      3.400     1.500     1.500 peak  5364 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      3.419 ppm2      1.807 CV     1
 ASSI { 5365}
   (( segid "    " and resid 181  and name HD2 ))
   (( segid "    " and resid 181  and name HG2 ))
      3.200     1.300     1.300 peak  5365 spectrum    1 weight  0.10000E+01 volume  0.96137E-03 ppm1      3.414 ppm2      1.541 CV     1
 ASSI { 5366}
   (( segid "    " and resid 181  and name HD2 ))
   (  segid "    " and resid 50   and name HE% )
      4.400     2.400     1.600 peak  5366 spectrum    1 weight  0.10000E+01 volume  0.56871E-03 ppm1      3.411 ppm2      6.498 CV     1
 ASSI { 5368}
   (( segid "    " and resid 181  and name HD2 ))
   (( segid "    " and resid 61   and name HD1 ))
      4.800     2.900     1.200 peak  5368 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      3.402 ppm2      7.334 CV     1
 ASSI { 5369}
   (( segid "    " and resid 181  and name HD3 ))
   (( segid "    " and resid 181  and name HD2 ))
      2.300     0.700     0.700 peak  5369 spectrum    1 weight  0.10000E+01 volume  0.16045E-02 ppm1      3.205 ppm2      3.406 CV     1
 ASSI { 5373}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 182  and name HB2 ))
      2.300     0.700     0.700 peak  5373 spectrum    1 weight  0.10000E+01 volume  0.78127E-02 ppm1      1.205 ppm2      1.899 CV     1
 ASSI { 5375}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 191  and name HB2 ))
      1.700     0.300     0.500 peak  5375 spectrum    1 weight  0.10000E+01 volume  0.18506E-01 ppm1      0.636 ppm2      1.581 CV     1
 ASSI { 5377}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 3    and name H   ))
      2.200     0.600     0.600 peak  5377 spectrum    1 weight  0.10000E+01 volume  0.17819E-01 ppm1      1.105 ppm2      7.853 CV     1
 ASSI { 5378}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HG3 ))
      4.200     2.200     1.800 peak  5378 spectrum    1 weight  0.10000E+01 volume  0.15639E-02 ppm1      4.852 ppm2      2.351 CV     1
 OR { 5378}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HG2 ))
 ASSI { 5380}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 126  and name HA  ))
      3.700     1.700     1.700 peak  5380 spectrum    1 weight  0.10000E+01 volume  0.12762E-02 ppm1      2.130 ppm2      4.190 CV     1
 ASSI { 5381}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 126  and name HA  ))
      3.500     1.500     1.500 peak  5381 spectrum    1 weight  0.10000E+01 volume  0.17332E-02 ppm1      1.806 ppm2      4.190 CV     1
 ASSI { 5383}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 126  and name HG2 ))
      2.200     0.600     0.600 peak  5383 spectrum    1 weight  0.10000E+01 volume  0.40248E-02 ppm1      2.126 ppm2      1.814 CV     1
 OR { 5383}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 126  and name HB2 ))
 ASSI { 5384}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 126  and name HG3 ))
      2.200     0.600     0.600 peak  5384 spectrum    1 weight  0.10000E+01 volume  0.40993E-02 ppm1      1.805 ppm2      2.118 CV     1
 OR { 5384}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 126  and name HB3 ))
 ASSI { 5385}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 123  and name HB3 ))
      3.500     1.500     1.500 peak  5385 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      1.806 ppm2      2.685 CV     1
 ASSI { 5387}
   (( segid "    " and resid 178  and name HD3 ))
   (( segid "    " and resid 178  and name HA  ))
      3.400     1.500     1.500 peak  5387 spectrum    1 weight  0.10000E+01 volume  0.14861E-02 ppm1      3.091 ppm2      4.885 CV     1
 ASSI { 5388}
   (( segid "    " and resid 178  and name HD2 ))
   (( segid "    " and resid 178  and name HA  ))
      4.100     2.100     1.900 peak  5388 spectrum    1 weight  0.10000E+01 volume  0.14793E-02 ppm1      3.046 ppm2      4.877 CV     1
 ASSI { 5389}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 36   and name H   ))
      3.900     1.900     1.900 peak  5389 spectrum    1 weight  0.10000E+01 volume  0.19600E-02 ppm1      2.987 ppm2      7.984 CV     1
 ASSI { 5392}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 123  and name HB3 ))
      3.800     1.800     1.800 peak  5392 spectrum    1 weight  0.10000E+01 volume  0.95122E-03 ppm1      2.132 ppm2      2.701 CV     1
 ASSI { 5393}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 126  and name HA  ))
      3.000     1.100     1.100 peak  5393 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      2.093 ppm2      4.192 CV     1
 ASSI { 5395}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 19   and name HE% )
      2.700     0.900     0.900 peak  5395 spectrum    1 weight  0.10000E+01 volume  0.88521E-02 ppm1      2.051 ppm2      7.125 CV     1
 ASSI { 5396}
   (  segid "    " and resid 111  and name HE% )
   (  segid "    " and resid 180  and name HD2%)
      2.100     0.600     0.600 peak  5396 spectrum    1 weight  0.10000E+01 volume  0.10524E-01 ppm1      1.952 ppm2      0.636 CV     1
 ASSI { 5397}
   (( segid "    " and resid 87   and name HD2 ))
   (( segid "    " and resid 87   and name HG3 ))
      3.100     1.200     1.200 peak  5397 spectrum    1 weight  0.10000E+01 volume  0.28164E-02 ppm1      3.640 ppm2      1.871 CV     1
 OR { 5397}
   (( segid "    " and resid 87   and name HD2 ))
   (( segid "    " and resid 87   and name HB3 ))
 ASSI { 5398}
   (( segid "    " and resid 181  and name HD2 ))
   (( segid "    " and resid 181  and name HG3 ))
      3.500     1.600     1.600 peak  5398 spectrum    1 weight  0.10000E+01 volume  0.11239E-02 ppm1      3.414 ppm2      1.607 CV     1
 ASSI { 5399}
   (( segid "    " and resid 181  and name HD2 ))
   (( segid "    " and resid 50   and name HZ  ))
      2.700     2.700     3.300 peak  5399 spectrum    1 weight  0.10000E+01 volume  0.62624E-03 ppm1      3.397 ppm2      6.743 CV     1
 ASSI { 5400}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 111  and name HB3 ))
      3.500     1.500     1.500 peak  5400 spectrum    1 weight  0.10000E+01 volume  0.18550E-02 ppm1      0.640 ppm2      2.009 CV     1
 ASSI { 5401}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 115  and name HG12))
      1.700     0.400     0.500 peak  5401 spectrum    1 weight  0.10000E+01 volume  0.32139E-01 ppm1      0.641 ppm2      0.732 CV     1
 OR { 5401}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 115  and name HG13))
 OR { 5401}
   (  segid "    " and resid 115  and name HD1%)
   (  segid "    " and resid 115  and name HG2%)
 ASSI { 5402}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 19   and name HB3 ))
      3.000     1.100     1.100 peak  5402 spectrum    1 weight  0.10000E+01 volume  0.10528E-02 ppm1      1.365 ppm2      2.933 CV     1
 ASSI { 5403}
   (  segid "    " and resid 23   and name HG2%)
   (  segid "    " and resid 19   and name HE% )
      4.300     2.400     1.700 peak  5403 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      1.370 ppm2      7.121 CV     1
 ASSI { 5405}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 193  and name HB2 ))
      2.500     0.800     0.800 peak  5405 spectrum    1 weight  0.10000E+01 volume  0.39977E-02 ppm1      0.573 ppm2      1.008 CV     1
 ASSI { 5406}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 19   and name HD% )
      2.100     2.100     3.900 peak  5406 spectrum    1 weight  0.10000E+01 volume  0.32733E-02 ppm1      1.474 ppm2      7.054 CV     1
 ASSI { 5407}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 113  and name HB3 ))
      2.300     2.300     3.700 peak  5407 spectrum    1 weight  0.10000E+01 volume  0.16012E-02 ppm1      1.430 ppm2      1.767 CV     1
 ASSI { 5408}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 48   and name HA3 ))
      2.900     1.000     1.000 peak  5408 spectrum    1 weight  0.10000E+01 volume  0.14387E-02 ppm1      2.334 ppm2      4.470 CV     1
 ASSI { 5409}
   (( segid "    " and resid 74   and name HD2 ))
   (  segid "    " and resid 4    and name HD1%)
      4.300     2.300     1.700 peak  5409 spectrum    1 weight  0.10000E+01 volume  0.14116E-02 ppm1      3.183 ppm2      0.713 CV     1
 ASSI { 5412}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name H   ))
      2.200     0.600     0.600 peak  5412 spectrum    1 weight  0.10000E+01 volume  0.25727E-02 ppm1      2.543 ppm2      8.185 CV     1
 ASSI { 5413}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 184  and name H   ))
      4.700     2.700     1.300 peak  5413 spectrum    1 weight  0.10000E+01 volume  0.61608E-03 ppm1      4.149 ppm2      7.711 CV     1
 ASSI { 5414}
   (( segid "    " and resid 87   and name HG2 ))
   (  segid "    " and resid 99   and name HG2%)
      4.400     2.400     1.600 peak  5414 spectrum    1 weight  0.10000E+01 volume  0.14421E-02 ppm1      2.086 ppm2      0.903 CV     1
 ASSI { 5416}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 43   and name HD2 ))
      3.400     1.500     1.500 peak  5416 spectrum    1 weight  0.10000E+01 volume  0.18280E-02 ppm1      2.324 ppm2      3.667 CV     1
 OR { 5416}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 43   and name HD3 ))
 ASSI { 5419}
   (( segid "    " and resid 171  and name HA  ))
   (  segid "    " and resid 130  and name HG1%)
      4.800     2.800     1.200 peak  5419 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      4.147 ppm2      0.224 CV     1
 ASSI { 5420}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 171  and name HG  ))
      3.200     1.300     1.300 peak  5420 spectrum    1 weight  0.10000E+01 volume  0.33715E-02 ppm1      4.142 ppm2      1.429 CV     1
 ASSI { 5427}
   (( segid "    " and resid 194  and name HD2 ))
   (  segid "    " and resid 130  and name HG2%)
      2.400     2.400     3.600 peak  5427 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      3.015 ppm2      0.477 CV     1
 ASSI { 5428}
   (( segid "    " and resid 91   and name HD2 ))
   (  segid "    " and resid 190  and name HG2%)
      3.600     1.600     1.600 peak  5428 spectrum    1 weight  0.10000E+01 volume  0.18652E-02 ppm1      2.977 ppm2      0.952 CV     1
 ASSI { 5429}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 92   and name HG3 ))
      4.500     2.500     1.500 peak  5429 spectrum    1 weight  0.10000E+01 volume  0.11916E-02 ppm1      1.074 ppm2      2.566 CV     1
 ASSI { 5430}
   (  segid "    " and resid 129  and name HD2%)
   (  segid "    " and resid 130  and name HG2%)
      3.500     1.500     1.500 peak  5430 spectrum    1 weight  0.10000E+01 volume  0.55517E-02 ppm1      0.637 ppm2      0.499 CV     1
 ASSI { 5431}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 89   and name HD3 ))
      3.000     1.100     1.100 peak  5431 spectrum    1 weight  0.10000E+01 volume  0.24508E-02 ppm1      0.908 ppm2      1.476 CV     1
 OR { 5431}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 89   and name HD2 ))
 ASSI { 5432}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 99   and name H   ))
      3.700     1.700     1.700 peak  5432 spectrum    1 weight  0.10000E+01 volume  0.32023E-02 ppm1      0.903 ppm2      8.422 CV     1
 ASSI { 5433}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 100  and name H   ))
      2.800     1.000     1.000 peak  5433 spectrum    1 weight  0.10000E+01 volume  0.58427E-02 ppm1      0.905 ppm2      9.169 CV     1
 ASSI { 5434}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 89   and name HA  ))
      3.400     3.400     2.600 peak  5434 spectrum    1 weight  0.10000E+01 volume  0.26471E-02 ppm1      0.820 ppm2      4.704 CV     1
 ASSI { 5435}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name H   ))
      4.300     2.300     1.700 peak  5435 spectrum    1 weight  0.10000E+01 volume  0.12931E-02 ppm1      0.820 ppm2      9.203 CV     1
 ASSI { 5436}
   (( segid "    " and resid 95   and name HA3 ))
   (( segid "    " and resid 91   and name HG3 ))
      5.200     3.400     0.800 peak  5436 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      3.506 ppm2      1.352 CV     1
 ASSI { 5437}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 93   and name H   ))
      4.300     2.300     1.700 peak  5437 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      0.640 ppm2      8.490 CV     1
 ASSI { 5438}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 98   and name H   ))
      4.000     2.000     2.000 peak  5438 spectrum    1 weight  0.10000E+01 volume  0.15673E-02 ppm1      0.639 ppm2      9.138 CV     1
 ASSI { 5440}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 81   and name HE% )
      4.400     2.400     1.600 peak  5440 spectrum    1 weight  0.10000E+01 volume  0.63639E-03 ppm1      0.841 ppm2      6.306 CV     1
 ASSI { 5442}
   (  segid "    " and resid 93   and name HD1%)
   (  segid "    " and resid 127  and name HE% )
      2.800     1.000     1.000 peak  5442 spectrum    1 weight  0.10000E+01 volume  0.30128E-02 ppm1      0.951 ppm2      6.637 CV     1
 ASSI { 5443}
   (  segid "    " and resid 93   and name HD1%)
   (  segid "    " and resid 127  and name HD% )
      3.300     1.400     1.400 peak  5443 spectrum    1 weight  0.10000E+01 volume  0.17366E-02 ppm1      0.952 ppm2      6.864 CV     1
 ASSI { 5444}
   (  segid "    " and resid 93   and name HD2%)
   (  segid "    " and resid 127  and name HD% )
      3.500     1.600     1.600 peak  5444 spectrum    1 weight  0.10000E+01 volume  0.23323E-02 ppm1      0.959 ppm2      6.860 CV     1
 ASSI { 5445}
   (( segid "    " and resid 18   and name HG2 ))
   (  segid "    " and resid 6    and name HD2%)
      3.800     1.800     1.800 peak  5445 spectrum    1 weight  0.10000E+01 volume  0.10697E-02 ppm1      2.026 ppm2      0.880 CV     1
 ASSI { 5446}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 6    and name HB2 ))
      4.600     2.600     1.400 peak  5446 spectrum    1 weight  0.10000E+01 volume  0.12762E-02 ppm1      2.023 ppm2      1.335 CV     1
 OR { 5446}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI { 5447}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 6    and name HB3 ))
      2.600     0.800     0.800 peak  5447 spectrum    1 weight  0.10000E+01 volume  0.43567E-02 ppm1      0.710 ppm2      1.638 CV     1
 ASSI { 5448}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 65   and name HA2 ))
      2.500     0.800     0.800 peak  5448 spectrum    1 weight  0.10000E+01 volume  0.70310E-02 ppm1      2.027 ppm2      3.579 CV     1
 ASSI { 5451}
   (( segid "    " and resid -2   and name HB2 ))
   (( segid "    " and resid -2   and name HD3 ))
      4.200     2.300     1.800 peak  5451 spectrum    1 weight  0.10000E+01 volume  0.14319E-02 ppm1      1.600 ppm2      3.790 CV     1
 ASSI { 5452}
   (( segid "    " and resid -2   and name HB3 ))
   (( segid "    " and resid -2   and name HD2 ))
      4.300     2.300     1.700 peak  5452 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      2.095 ppm2      3.675 CV     1
 ASSI { 5453}
   (( segid "    " and resid -2   and name HB2 ))
   (( segid "    " and resid -2   and name HD2 ))
      3.600     1.600     1.600 peak  5453 spectrum    1 weight  0.10000E+01 volume  0.21089E-02 ppm1      1.603 ppm2      3.674 CV     1
 ASSI { 5454}
   (( segid "    " and resid 87   and name HD3 ))
   (( segid "    " and resid 87   and name HD2 ))
      2.100     0.500     0.500 peak  5454 spectrum    1 weight  0.10000E+01 volume  0.25625E-02 ppm1      3.514 ppm2      3.636 CV     1
 ASSI { 5456}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 57   and name HG3 ))
      2.600     0.900     0.900 peak  5456 spectrum    1 weight  0.10000E+01 volume  0.63843E-02 ppm1      2.952 ppm2      1.458 CV     1
 OR { 5456}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI { 5457}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 131  and name HD2 ))
      2.300     2.300     3.700 peak  5457 spectrum    1 weight  0.10000E+01 volume  0.18415E-02 ppm1      0.754 ppm2      2.959 CV     1
 ASSI { 5458}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 131  and name HD3 ))
      2.500     2.500     3.500 peak  5458 spectrum    1 weight  0.10000E+01 volume  0.10561E-02 ppm1      0.754 ppm2      3.060 CV     1
 ASSI { 5459}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 131  and name HB2 ))
      2.000     2.000     4.000 peak  5459 spectrum    1 weight  0.10000E+01 volume  0.40282E-02 ppm1      0.748 ppm2      1.991 CV     1
 ASSI { 5460}
   (( segid "    " and resid 91   and name HG2 ))
   (( segid "    " and resid 91   and name HH22))
      5.400     3.600     0.600 peak  5460 spectrum    1 weight  0.10000E+01 volume  0.88012E-03 ppm1      1.629 ppm2      6.815 CV     1
 ASSI { 5461}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 4    and name HA  ))
      2.200     2.200     3.800 peak  5461 spectrum    1 weight  0.10000E+01 volume  0.17728E-01 ppm1      0.714 ppm2      4.713 CV     1
 ASSI { 5462}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 61   and name HB2 ))
      3.700     1.700     1.700 peak  5462 spectrum    1 weight  0.10000E+01 volume  0.69056E-03 ppm1      3.712 ppm2      3.013 CV     1
 ASSI { 5463}
   (( segid "    " and resid 200  and name HB3 ))
   (( segid "    " and resid 201  and name H   ))
      3.300     1.400     1.400 peak  5463 spectrum    1 weight  0.10000E+01 volume  0.48645E-02 ppm1      3.709 ppm2      8.165 CV     1
 ASSI { 5464}
   (( segid "    " and resid 95   and name HA2 ))
   (( segid "    " and resid 91   and name HG2 ))
      3.100     1.200     1.200 peak  5464 spectrum    1 weight  0.10000E+01 volume  0.71087E-03 ppm1      4.334 ppm2      1.661 CV     1
 ASSI { 5465}
   (( segid "    " and resid 95   and name HA2 ))
   (( segid "    " and resid 91   and name HG3 ))
      4.300     2.300     1.700 peak  5465 spectrum    1 weight  0.10000E+01 volume  0.57548E-03 ppm1      4.326 ppm2      1.357 CV     1
 ASSI { 5466}
   (( segid "    " and resid 189  and name HG2 ))
   (( segid "    " and resid 190  and name H   ))
      2.500     2.500     3.500 peak  5466 spectrum    1 weight  0.10000E+01 volume  0.92075E-03 ppm1      1.854 ppm2      8.617 CV     1
 ASSI { 5467}
   (( segid "    " and resid 189  and name HB3 ))
   (( segid "    " and resid 189  and name HA  ))
      2.900     1.100     1.100 peak  5467 spectrum    1 weight  0.10000E+01 volume  0.11983E-02 ppm1      1.855 ppm2      3.985 CV     1
 ASSI { 5468}
   (  segid "    " and resid 68   and name HD1%)
   (( segid "    " and resid 68   and name HB3 ))
      2.700     0.900     0.900 peak  5468 spectrum    1 weight  0.10000E+01 volume  0.27691E-02 ppm1      0.328 ppm2      1.074 CV     1
 ASSI { 5470}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 114  and name HG2%)
      2.400     0.700     0.700 peak  5470 spectrum    1 weight  0.10000E+01 volume  0.50201E-02 ppm1      4.244 ppm2      1.162 CV     1
 ASSI { 5471}
   (( segid "    " and resid -1   and name HB2 ))
   (( segid "    " and resid -1   and name HB3 ))
      1.400     0.200     0.800 peak  5471 spectrum    1 weight  0.10000E+01 volume  0.63924E-01 ppm1      3.107 ppm2      2.986 CV     1
 ASSI { 5473}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 92   and name HB3 ))
      5.000     3.100     1.000 peak  5473 spectrum    1 weight  0.10000E+01 volume  0.97153E-03 ppm1      1.074 ppm2      2.268 CV     1
 ASSI { 5474}
   (( segid "    " and resid 24   and name HB3 ))
   (  segid "    " and resid 26   and name HD% )
      3.800     1.800     1.800 peak  5474 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      1.739 ppm2      7.077 CV     1
 OR { 5474}
   (( segid "    " and resid 24   and name HB2 ))
   (  segid "    " and resid 26   and name HD% )
 ASSI { 5477}
   (( segid "    " and resid 195  and name HB2 ))
   (  segid "    " and resid 127  and name HE% )
      3.300     1.300     1.300 peak  5477 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      1.192 ppm2      6.640 CV     1
 ASSI { 5478}
   (( segid "    " and resid 195  and name HD2 ))
   (  segid "    " and resid 127  and name HE% )
      3.500     1.500     1.500 peak  5478 spectrum    1 weight  0.10000E+01 volume  0.11679E-02 ppm1      2.702 ppm2      6.639 CV     1
 OR { 5478}
   (( segid "    " and resid 195  and name HD3 ))
   (  segid "    " and resid 127  and name HE% )
 ASSI { 5483}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 7    and name H   ))
      2.300     2.300     3.700 peak  5483 spectrum    1 weight  0.10000E+01 volume  0.15470E-02 ppm1      0.708 ppm2      8.666 CV     1
 ASSI { 5489}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 98   and name HD2 ))
      3.500     1.500     1.500 peak  5489 spectrum    1 weight  0.10000E+01 volume  0.23594E-02 ppm1      1.071 ppm2      1.568 CV     1
 OR { 5489}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 98   and name HD3 ))
 ASSI { 5491}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 172  and name H   ))
      3.100     1.200     1.200 peak  5491 spectrum    1 weight  0.10000E+01 volume  0.47526E-02 ppm1      0.485 ppm2      8.350 CV     1
 ASSI { 5492}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 128  and name HB2 ))
      3.700     1.700     1.700 peak  5492 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      0.226 ppm2      3.659 CV     1
 ASSI { 5493}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 132  and name HG3 ))
      3.200     1.300     1.300 peak  5493 spectrum    1 weight  0.10000E+01 volume  0.19668E-02 ppm1      0.483 ppm2      2.136 CV     1
 ASSI { 5496}
   (  segid "    " and resid 121  and name HG2%)
   (  segid "    " and resid 93   and name HD2%)
      4.300     2.300     1.700 peak  5496 spectrum    1 weight  0.10000E+01 volume  0.14861E-02 ppm1      0.489 ppm2      0.957 CV     1
 OR { 5496}
   (  segid "    " and resid 121  and name HG2%)
   (  segid "    " and resid 93   and name HD1%)
 ASSI { 5497}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 98   and name HB3 ))
      3.700     1.700     1.700 peak  5497 spectrum    1 weight  0.10000E+01 volume  0.15571E-02 ppm1      0.590 ppm2      1.522 CV     1
 ASSI { 5501}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 115  and name H   ))
      4.200     2.200     1.800 peak  5501 spectrum    1 weight  0.10000E+01 volume  0.14488E-02 ppm1      0.745 ppm2      8.536 CV     1
 ASSI { 5505}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 127  and name HB2 ))
      3.000     1.100     1.100 peak  5505 spectrum    1 weight  0.10000E+01 volume  0.41908E-02 ppm1      0.748 ppm2      2.803 CV     1
 OR { 5505}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 127  and name HB3 ))
 ASSI { 5507}
   (  segid "    " and resid 109  and name HG2%)
   (  segid "    " and resid 108  and name HG1%)
      4.300     2.300     1.700 peak  5507 spectrum    1 weight  0.10000E+01 volume  0.19701E-02 ppm1      1.205 ppm2      0.502 CV     1
 ASSI { 5508}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 110  and name HB3 ))
      4.400     2.400     1.600 peak  5508 spectrum    1 weight  0.10000E+01 volume  0.11645E-02 ppm1      1.207 ppm2      2.604 CV     1
 ASSI { 5513}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 111  and name HA  ))
      4.900     3.000     1.100 peak  5513 spectrum    1 weight  0.10000E+01 volume  0.99861E-03 ppm1      0.633 ppm2      4.022 CV     1
 ASSI { 5515}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 118  and name H   ))
      5.100     3.300     0.900 peak  5515 spectrum    1 weight  0.10000E+01 volume  0.11848E-02 ppm1      0.686 ppm2      7.669 CV     1
 ASSI { 5520}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 194  and name H   ))
      4.800     2.900     1.200 peak  5520 spectrum    1 weight  0.10000E+01 volume  0.78197E-03 ppm1      0.643 ppm2      8.637 CV     1
 ASSI { 5521}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 79   and name HG3 ))
      4.300     2.300     1.700 peak  5521 spectrum    1 weight  0.10000E+01 volume  0.14725E-02 ppm1      1.009 ppm2      2.142 CV     1
 OR { 5521}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 5524}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 44   and name HD2 ))
      3.600     1.600     1.600 peak  5524 spectrum    1 weight  0.10000E+01 volume  0.15741E-02 ppm1      0.843 ppm2      3.753 CV     1
 OR { 5524}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 44   and name HD3 ))
 ASSI { 5531}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 20   and name HA  ))
      4.800     2.900     1.200 peak  5531 spectrum    1 weight  0.10000E+01 volume  0.91736E-03 ppm1      1.983 ppm2      4.679 CV     1
 ASSI { 5532}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 6    and name H   ))
      4.100     2.100     1.900 peak  5532 spectrum    1 weight  0.10000E+01 volume  0.10934E-02 ppm1      1.687 ppm2      8.897 CV     1
 ASSI { 5536}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 6    and name H   ))
      3.000     3.000     3.000 peak  5536 spectrum    1 weight  0.10000E+01 volume  0.29619E-02 ppm1      0.931 ppm2      8.892 CV     1
 ASSI { 5538}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 32   and name HA  ))
      4.800     2.900     1.200 peak  5538 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      0.687 ppm2      3.203 CV     1
 ASSI { 5546}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 76   and name H   ))
      4.200     2.200     1.800 peak  5546 spectrum    1 weight  0.10000E+01 volume  0.16113E-02 ppm1      0.714 ppm2      9.287 CV     1
 ASSI { 5547}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 91   and name H   ))
      3.700     1.700     1.700 peak  5547 spectrum    1 weight  0.10000E+01 volume  0.25050E-02 ppm1      0.716 ppm2      9.213 CV     1
 ASSI { 5550}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 75   and name HD22))
      3.600     1.600     1.600 peak  5550 spectrum    1 weight  0.10000E+01 volume  0.25253E-02 ppm1      0.711 ppm2      7.075 CV     1
 ASSI { 5552}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 74   and name HD2 ))
      3.900     1.900     1.900 peak  5552 spectrum    1 weight  0.10000E+01 volume  0.27926E-02 ppm1      0.718 ppm2      3.170 CV     1
 ASSI { 5554}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 90   and name HB  ))
      3.600     1.700     1.700 peak  5554 spectrum    1 weight  0.10000E+01 volume  0.15842E-02 ppm1      0.573 ppm2      1.643 CV     1
 ASSI { 5564}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 82   and name H   ))
      4.100     2.100     1.900 peak  5564 spectrum    1 weight  0.10000E+01 volume  0.13676E-02 ppm1      1.469 ppm2      8.671 CV     1
 ASSI { 5566}
   (( segid "    " and resid 24   and name HG2 ))
   (  segid "    " and resid 67   and name HB% )
      5.200     3.400     0.800 peak  5566 spectrum    1 weight  0.10000E+01 volume  0.78197E-03 ppm1      2.611 ppm2      1.369 CV     1
 ASSI { 5572}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 183  and name HA  ))
      3.500     1.500     1.500 peak  5572 spectrum    1 weight  0.10000E+01 volume  0.11239E-02 ppm1      2.920 ppm2      4.522 CV     1
 OR { 5572}
   (( segid "    " and resid 138  and name HE3 ))
   (( segid "    " and resid 183  and name HA  ))
 ASSI { 5574}
   (( segid "    " and resid 98   and name HE3 ))
   (  segid "    " and resid 99   and name HG2%)
      3.500     1.500     1.500 peak  5574 spectrum    1 weight  0.10000E+01 volume  0.26505E-02 ppm1      2.911 ppm2      0.909 CV     1
 OR { 5574}
   (( segid "    " and resid 98   and name HE2 ))
   (  segid "    " and resid 99   and name HG2%)
 ASSI { 5575}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 68   and name HB2 ))
      3.800     1.900     1.900 peak  5575 spectrum    1 weight  0.10000E+01 volume  0.14522E-02 ppm1      2.250 ppm2      1.917 CV     1
 OR { 5575}
   (( segid "    " and resid 66   and name HE3 ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI { 5578}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 172  and name HB2 ))
      4.100     2.100     1.900 peak  5578 spectrum    1 weight  0.10000E+01 volume  0.17061E-02 ppm1      0.791 ppm2      2.851 CV     1
 ASSI { 5579}
   (( segid "    " and resid 74   and name HD3 ))
   (  segid "    " and resid 4    and name HD2%)
      4.100     2.100     1.900 peak  5579 spectrum    1 weight  0.10000E+01 volume  0.13845E-02 ppm1      3.117 ppm2      0.713 CV     1
 OR { 5579}
   (( segid "    " and resid 74   and name HD3 ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 5584}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 101  and name HG3 ))
      4.000     2.000     2.000 peak  5584 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      2.067 ppm2      2.539 CV     1
 ASSI { 5585}
   (( segid "    " and resid 118  and name HD3 ))
   (  segid "    " and resid 115  and name HG2%)
      3.100     3.100     2.900 peak  5585 spectrum    1 weight  0.10000E+01 volume  0.35408E-02 ppm1      3.157 ppm2      0.761 CV     1
 ASSI { 5586}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 85   and name HG3 ))
      2.800     1.000     1.000 peak  5586 spectrum    1 weight  0.10000E+01 volume  0.85407E-02 ppm1      1.748 ppm2      2.072 CV     1
 ASSI { 5589}
   (  segid "    " and resid 171  and name HD1%)
   (  segid "    " and resid 130  and name HG1%)
      2.500     2.500     3.500 peak  5589 spectrum    1 weight  0.10000E+01 volume  0.12867E-01 ppm1      0.694 ppm2      0.222 CV     1
 ASSI { 5592}
   (  segid "    " and resid 31   and name HE% )
   (( segid "    " and resid 32   and name HB  ))
      3.300     1.400     1.400 peak  5592 spectrum    1 weight  0.10000E+01 volume  0.43735E-02 ppm1      2.046 ppm2      1.555 CV     1
 ASSI { 5593}
   (( segid "    " and resid 98   and name HE2 ))
   (( segid "    " and resid 118  and name HA  ))
      3.800     1.800     1.800 peak  5593 spectrum    1 weight  0.10000E+01 volume  0.28231E-02 ppm1      2.905 ppm2      4.137 CV     1
 OR { 5593}
   (( segid "    " and resid 98   and name HE3 ))
   (( segid "    " and resid 118  and name HA  ))
 ASSI { 5599}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 138  and name HB2 ))
      4.800     2.900     1.200 peak  5599 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      4.451 ppm2      1.685 CV     1
 ASSI { 5600}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 59   and name HA3 ))
      3.500     1.500     1.500 peak  5600 spectrum    1 weight  0.10000E+01 volume  0.11679E-02 ppm1      4.348 ppm2      3.707 CV     1
 ASSI { 5601}
   (( segid "    " and resid 57   and name HE2 ))
   (( segid "    " and resid 182  and name H   ))
      3.800     1.800     1.800 peak  5601 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      2.956 ppm2      8.026 CV     1
 OR { 5601}
   (( segid "    " and resid 57   and name HE3 ))
   (( segid "    " and resid 182  and name H   ))
 ASSI { 5602}
   (( segid "    " and resid 57   and name HD3 ))
   (( segid "    " and resid 181  and name HD2 ))
      4.200     2.200     1.800 peak  5602 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.635 ppm2      3.374 CV     1
 OR { 5602}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 181  and name HD2 ))
 ASSI { 5606}
   (( segid "    " and resid 174  and name HB2 ))
   (( segid "    " and resid 175  and name H   ))
      4.300     2.300     1.700 peak  5606 spectrum    1 weight  0.10000E+01 volume  0.83611E-03 ppm1      1.291 ppm2      9.132 CV     1
 ASSI { 5608}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 185  and name H   ))
      4.600     2.600     1.400 peak  5608 spectrum    1 weight  0.10000E+01 volume  0.14928E-02 ppm1      0.680 ppm2      7.339 CV     1
 ASSI { 5609}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 183  and name H   ))
      4.600     2.600     1.400 peak  5609 spectrum    1 weight  0.10000E+01 volume  0.94783E-03 ppm1      0.676 ppm2      7.168 CV     1
 ASSI { 5612}
   (  segid "    " and resid 171  and name HD1%)
   (( segid "    " and resid 173  and name HZ2 ))
      3.100     1.200     1.200 peak  5612 spectrum    1 weight  0.10000E+01 volume  0.55889E-02 ppm1      0.695 ppm2      7.339 CV     1
 ASSI { 5614}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 132  and name HG2 ))
      2.800     1.000     1.000 peak  5614 spectrum    1 weight  0.10000E+01 volume  0.27487E-02 ppm1      0.617 ppm2      2.000 CV     1
 ASSI { 5615}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 130  and name HB  ))
      4.300     2.300     1.700 peak  5615 spectrum    1 weight  0.10000E+01 volume  0.15436E-02 ppm1      0.616 ppm2      1.610 CV     1
 ASSI { 5616}
   (  segid "    " and resid 171  and name HD2%)
   (  segid "    " and resid 130  and name HG1%)
      3.300     3.300     2.700 peak  5616 spectrum    1 weight  0.10000E+01 volume  0.58765E-02 ppm1      0.614 ppm2      0.220 CV     1
 ASSI { 5617}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 173  and name HZ2 ))
      4.400     2.500     1.600 peak  5617 spectrum    1 weight  0.10000E+01 volume  0.14590E-02 ppm1      0.617 ppm2      7.343 CV     1
 ASSI { 5618}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 169  and name HB2 ))
      4.100     2.100     1.900 peak  5618 spectrum    1 weight  0.10000E+01 volume  0.27283E-02 ppm1      2.138 ppm2      2.640 CV     1
 OR { 5618}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 169  and name HB2 ))
 OR { 5618}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 169  and name HB3 ))
 OR { 5618}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 169  and name HB3 ))
 ASSI { 5620}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 171  and name HB3 ))
      4.900     3.100     1.100 peak  5620 spectrum    1 weight  0.10000E+01 volume  0.84965E-03 ppm1      4.216 ppm2      0.856 CV     1
 ASSI { 5622}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 172  and name HD22))
      3.600     1.600     1.600 peak  5622 spectrum    1 weight  0.10000E+01 volume  0.12829E-02 ppm1      2.909 ppm2      6.988 CV     1
 OR { 5622}
   (( segid "    " and resid 138  and name HE3 ))
   (( segid "    " and resid 172  and name HD22))
 ASSI { 5623}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HE3 ))
      4.500     2.500     1.500 peak  5623 spectrum    1 weight  0.10000E+01 volume  0.11983E-02 ppm1      4.197 ppm2      2.905 CV     1
 OR { 5623}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HE2 ))
 ASSI { 5625}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 81   and name HD% )
      4.300     2.300     1.700 peak  5625 spectrum    1 weight  0.10000E+01 volume  0.12457E-02 ppm1      0.827 ppm2      6.862 CV     1
 ASSI { 5627}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 127  and name H   ))
      4.200     2.200     1.800 peak  5627 spectrum    1 weight  0.10000E+01 volume  0.89705E-03 ppm1      2.399 ppm2      7.835 CV     1
 ASSI { 5628}
   (( segid "    " and resid -1   and name HA  ))
   (  segid "    " and resid 2    and name HG2%)
      3.000     1.100     1.100 peak  5628 spectrum    1 weight  0.10000E+01 volume  0.33410E-02 ppm1      4.531 ppm2      0.857 CV     1
 ASSI { 5629}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 180  and name H   ))
      4.700     2.800     1.300 peak  5629 spectrum    1 weight  0.10000E+01 volume  0.21597E-02 ppm1      1.949 ppm2      8.966 CV     1
 ASSI { 5630}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 176  and name HE1 ))
      3.800     1.800     1.800 peak  5630 spectrum    1 weight  0.10000E+01 volume  0.25185E-02 ppm1      1.951 ppm2      8.057 CV     1
 ASSI { 5631}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 183  and name HE22))
      3.500     1.500     1.500 peak  5631 spectrum    1 weight  0.10000E+01 volume  0.41365E-02 ppm1      1.950 ppm2      7.249 CV     1
 ASSI { 5632}
   (  segid "    " and resid 1    and name HE% )
   (( segid "    " and resid 75   and name HD22))
      2.600     2.600     3.400 peak  5632 spectrum    1 weight  0.10000E+01 volume  0.34359E-02 ppm1      1.900 ppm2      7.075 CV     1
 ASSI { 5634}
   (  segid "    " and resid 92   and name HE% )
   (  segid "    " and resid 93   and name HD2%)
      3.600     1.600     1.600 peak  5634 spectrum    1 weight  0.10000E+01 volume  0.42585E-02 ppm1      1.910 ppm2      0.956 CV     1
 OR { 5634}
   (  segid "    " and resid 92   and name HE% )
   (  segid "    " and resid 93   and name HD1%)
 ASSI { 5635}
   (( segid "    " and resid 58   and name HE3 ))
   (( segid "    " and resid 55   and name H   ))
      3.500     1.500     1.500 peak  5635 spectrum    1 weight  0.10000E+01 volume  0.14759E-02 ppm1      2.911 ppm2      9.270 CV     1
 ASSI { 5642}
   (( segid "    " and resid 194  and name HD3 ))
   (( segid "    " and resid 173  and name HZ3 ))
      4.800     2.900     1.200 peak  5642 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      3.014 ppm2      6.704 CV     1
 OR { 5642}
   (( segid "    " and resid 194  and name HD2 ))
   (( segid "    " and resid 173  and name HZ3 ))
 ASSI { 5645}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 128  and name H   ))
      4.000     2.000     2.000 peak  5645 spectrum    1 weight  0.10000E+01 volume  0.88689E-03 ppm1      0.577 ppm2      8.850 CV     1
 ASSI { 5648}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 102  and name HG1%)
      4.600     2.600     1.400 peak  5648 spectrum    1 weight  0.10000E+01 volume  0.11543E-02 ppm1      1.886 ppm2      0.735 CV     1
 OR { 5648}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 102  and name HG2%)
 ASSI { 5649}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 101  and name HA  ))
      4.500     2.600     1.500 peak  5649 spectrum    1 weight  0.10000E+01 volume  0.77858E-03 ppm1      1.883 ppm2      4.879 CV     1
 ASSI { 5651}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 183  and name HB3 ))
      2.700     0.900     0.900 peak  5651 spectrum    1 weight  0.10000E+01 volume  0.29045E-02 ppm1      2.902 ppm2      2.061 CV     1
 OR { 5651}
   (( segid "    " and resid 138  and name HE3 ))
   (( segid "    " and resid 183  and name HB3 ))
 ASSI { 5652}
   (( segid "    " and resid 186  and name HG2 ))
   (( segid "    " and resid 188  and name HD2 ))
      4.800     2.900     1.200 peak  5652 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      2.214 ppm2      7.017 CV     1
 ASSI { 5653}
   (( segid "    " and resid 131  and name HD3 ))
   (( segid "    " and resid 172  and name HD21))
      3.300     1.400     1.400 peak  5653 spectrum    1 weight  0.10000E+01 volume  0.22240E-02 ppm1      3.086 ppm2      7.417 CV     1
 ASSI { 5655}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 71   and name HA  ))
      4.100     2.100     1.900 peak  5655 spectrum    1 weight  0.10000E+01 volume  0.15131E-02 ppm1     -0.164 ppm2      3.986 CV     1
 ASSI { 5656}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 83   and name HG2 ))
      2.400     0.700     0.700 peak  5656 spectrum    1 weight  0.10000E+01 volume  0.76401E-02 ppm1      1.748 ppm2      0.904 CV     1
 ASSI { 5659}
   (( segid "    " and resid 195  and name HB3 ))
   (  segid "    " and resid 127  and name HE% )
      4.300     2.300     1.700 peak  5659 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      1.502 ppm2      6.644 CV     1
 ASSI { 5662}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 136  and name HG2 ))
      3.600     1.600     1.600 peak  5662 spectrum    1 weight  0.10000E+01 volume  0.16249E-02 ppm1      1.350 ppm2      2.132 CV     1
 OR { 5662}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 136  and name HG2 ))
 ASSI { 5663}
   (( segid "    " and resid 189  and name HG3 ))
   (( segid "    " and resid 189  and name HG2 ))
      2.000     0.500     0.500 peak  5663 spectrum    1 weight  0.10000E+01 volume  0.63133E-02 ppm1      1.997 ppm2      1.849 CV     1
 OR { 5663}
   (( segid "    " and resid 189  and name HG3 ))
   (( segid "    " and resid 189  and name HB3 ))
 ASSI {    1}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 61   and name HB3 ))
      5.200     3.400     0.800 peak     1 spectrum    1 weight  0.10000E+01 volume  0.33157E-03 ppm1     10.992 ppm2      3.170 CV     1
 ASSI {    2}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 104  and name HB2 ))
      4.500     2.500     1.500 peak     2 spectrum    1 weight  0.10000E+01 volume  0.80606E-03 ppm1     10.988 ppm2      2.627 CV     1
 ASSI {    3}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 104  and name HB3 ))
      3.000     1.100     1.100 peak     3 spectrum    1 weight  0.10000E+01 volume  0.12024E-02 ppm1     10.991 ppm2      2.459 CV     1
 ASSI {    4}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 61   and name HB2 ))
      5.200     3.400     0.800 peak     4 spectrum    1 weight  0.10000E+01 volume  0.30108E-03 ppm1     10.994 ppm2      3.002 CV     1
 ASSI {    5}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 84   and name HA  ))
      4.500     2.500     1.500 peak     5 spectrum    1 weight  0.10000E+01 volume  0.56023E-03 ppm1     10.990 ppm2      3.709 CV     1
 ASSI {    6}
   (( segid "    " and resid 61   and name HE1 ))
   (  segid "    " and resid 50   and name HD% )
      3.800     1.800     1.800 peak     6 spectrum    1 weight  0.10000E+01 volume  0.52023E-03 ppm1     10.987 ppm2      5.502 CV     1
 ASSI {    7}
   (( segid "    " and resid 61   and name HE1 ))
   (  segid "    " and resid 50   and name HE% )
      3.500     1.500     1.500 peak     7 spectrum    1 weight  0.10000E+01 volume  0.11776E-02 ppm1     10.991 ppm2      6.500 CV     1
 ASSI {    8}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 61   and name HZ2 ))
      3.100     1.200     1.200 peak     8 spectrum    1 weight  0.10000E+01 volume  0.17302E-02 ppm1     10.989 ppm2      7.160 CV     1
 ASSI {    9}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 61   and name HD1 ))
      2.700     0.900     0.900 peak     9 spectrum    1 weight  0.10000E+01 volume  0.30374E-02 ppm1     10.990 ppm2      7.333 CV     1
 ASSI {   10}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 181  and name HE  ))
      3.900     1.900     1.900 peak    10 spectrum    1 weight  0.10000E+01 volume  0.51831E-03 ppm1     10.990 ppm2      7.994 CV     1
 ASSI {   11}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 104  and name H   ))
      5.500     3.800     0.500 peak    11 spectrum    1 weight  0.10000E+01 volume  0.38491E-03 ppm1     10.989 ppm2      8.402 CV     1
 ASSI {   12}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 105  and name H   ))
      5.600     3.900     0.400 peak    12 spectrum    1 weight  0.10000E+01 volume  0.18865E-03 ppm1     10.979 ppm2      8.595 CV     1
 ASSI {   13}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 105  and name HA  ))
      4.200     2.200     1.800 peak    13 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1     10.991 ppm2      4.152 CV     1
 ASSI {   14}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 104  and name HA  ))
      5.300     3.600     0.700 peak    14 spectrum    1 weight  0.10000E+01 volume  0.42686E-03 ppm1     10.993 ppm2      4.250 CV     1
 ASSI {   15}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 50   and name HZ  ))
      5.000     3.100     1.000 peak    15 spectrum    1 weight  0.10000E+01 volume  0.33157E-03 ppm1     10.989 ppm2      6.737 CV     1
 ASSI {   16}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 82   and name HE  ))
      5.300     3.600     0.700 peak    16 spectrum    1 weight  0.10000E+01 volume  0.32775E-03 ppm1     10.985 ppm2      6.681 CV     1
 ASSI {   17}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 86   and name HG2 ))
      5.400     3.700     0.600 peak    17 spectrum    1 weight  0.10000E+01 volume  0.32395E-03 ppm1     10.992 ppm2      1.441 CV     1
 ASSI {   19}
   (( segid "    " and resid 91   and name HH21))
   (  segid "    " and resid 192  and name HD2%)
      5.100     3.200     0.900 peak    19 spectrum    1 weight  0.10000E+01 volume  0.42303E-03 ppm1      6.797 ppm2      0.710 CV     1
 ASSI {   20}
   (( segid "    " and resid 91   and name HH21))
   (  segid "    " and resid 97   and name HG1%)
      5.000     3.100     1.000 peak    20 spectrum    1 weight  0.10000E+01 volume  0.52594E-03 ppm1      6.800 ppm2      0.819 CV     1
 ASSI {   21}
   (( segid "    " and resid 91   and name HH21))
   (( segid "    " and resid 91   and name HB2 ))
      6.000     4.700     0.000 peak    21 spectrum    1 weight  0.10000E+01 volume  0.33728E-03 ppm1      6.802 ppm2      1.374 CV     1
 ASSI {   22}
   (( segid "    " and resid 91   and name HH21))
   (( segid "    " and resid 91   and name HD2 ))
      5.700     4.100     0.300 peak    22 spectrum    1 weight  0.10000E+01 volume  0.38491E-03 ppm1      6.800 ppm2      2.997 CV     1
 ASSI {   23}
   (( segid "    " and resid 91   and name HH21))
   (( segid "    " and resid 91   and name HD3 ))
      5.600     3.900     0.400 peak    23 spectrum    1 weight  0.10000E+01 volume  0.41541E-03 ppm1      6.798 ppm2      3.168 CV     1
 ASSI {   24}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 181  and name HB2 ))
      4.400     2.400     1.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.26869E-03 ppm1     10.991 ppm2      2.076 CV     1
 ASSI {   25}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 173  and name HA  ))
      4.400     2.500     1.600 peak    25 spectrum    1 weight  0.10000E+01 volume  0.52974E-03 ppm1     10.155 ppm2      4.646 CV     1
 ASSI {   26}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 173  and name HB3 ))
      4.400     2.500     1.600 peak    26 spectrum    1 weight  0.10000E+01 volume  0.66505E-03 ppm1     10.154 ppm2      3.531 CV     1
 ASSI {   27}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 173  and name HB2 ))
      3.900     1.900     1.900 peak    27 spectrum    1 weight  0.10000E+01 volume  0.12062E-02 ppm1     10.155 ppm2      3.003 CV     1
 ASSI {   28}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 171  and name HB2 ))
      3.100     1.200     1.200 peak    28 spectrum    1 weight  0.10000E+01 volume  0.17093E-02 ppm1     10.155 ppm2      1.363 CV     1
 ASSI {   31}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 171  and name HB3 ))
      3.000     1.100     1.100 peak    31 spectrum    1 weight  0.10000E+01 volume  0.12920E-02 ppm1     10.156 ppm2      0.873 CV     1
 ASSI {   32}
   (( segid "    " and resid 173  and name HE1 ))
   (  segid "    " and resid 130  and name HG2%)
      4.400     2.400     1.600 peak    32 spectrum    1 weight  0.10000E+01 volume  0.24772E-03 ppm1     10.153 ppm2      0.473 CV     1
 ASSI {   33}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 173  and name HH2 ))
      4.300     2.300     1.700 peak    33 spectrum    1 weight  0.10000E+01 volume  0.92610E-03 ppm1     10.155 ppm2      6.844 CV     1
 ASSI {   34}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 173  and name HZ2 ))
      2.400     0.700     0.700 peak    34 spectrum    1 weight  0.10000E+01 volume  0.63474E-02 ppm1     10.155 ppm2      7.340 CV     1
 ASSI {   35}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 173  and name HD1 ))
      2.000     0.500     0.500 peak    35 spectrum    1 weight  0.10000E+01 volume  0.15668E-01 ppm1     10.155 ppm2      7.261 CV     1
 ASSI {   37}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 171  and name H   ))
      2.700     2.700     3.300 peak    37 spectrum    1 weight  0.10000E+01 volume  0.58502E-03 ppm1     10.156 ppm2      8.187 CV     1
 ASSI {   38}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 172  and name H   ))
      3.000     3.000     3.000 peak    38 spectrum    1 weight  0.10000E+01 volume  0.37731E-03 ppm1     10.155 ppm2      8.336 CV     1
 ASSI {   39}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 186  and name H   ))
      4.800     2.900     1.200 peak    39 spectrum    1 weight  0.10000E+01 volume  0.30299E-03 ppm1      9.028 ppm2      8.809 CV     1
 ASSI {   40}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 132  and name H   ))
      5.800     4.300     0.200 peak    40 spectrum    1 weight  0.10000E+01 volume  0.28774E-03 ppm1      9.032 ppm2      8.660 CV     1
 ASSI {   41}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 131  and name H   ))
      5.600     3.900     0.400 peak    41 spectrum    1 weight  0.10000E+01 volume  0.36395E-03 ppm1      9.035 ppm2      8.422 CV     1
 ASSI {   42}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 131  and name HA  ))
      4.500     2.500     1.500 peak    42 spectrum    1 weight  0.10000E+01 volume  0.61549E-03 ppm1      9.029 ppm2      4.437 CV     1
 ASSI {   43}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 131  and name HD3 ))
      2.700     0.900     0.900 peak    43 spectrum    1 weight  0.10000E+01 volume  0.13625E-02 ppm1      9.031 ppm2      3.065 CV     1
 ASSI {   44}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 131  and name HD2 ))
      2.800     1.000     1.000 peak    44 spectrum    1 weight  0.10000E+01 volume  0.14749E-02 ppm1      9.030 ppm2      2.960 CV     1
 ASSI {   45}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 191  and name HG  ))
      3.500     1.500     1.500 peak    45 spectrum    1 weight  0.10000E+01 volume  0.14940E-02 ppm1      9.028 ppm2      1.643 CV     1
 ASSI {   46}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 131  and name HB3 ))
      2.500     0.800     0.800 peak    46 spectrum    1 weight  0.10000E+01 volume  0.11376E-02 ppm1      9.030 ppm2      1.535 CV     1
 ASSI {   47}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 131  and name HB2 ))
      3.500     1.500     1.500 peak    47 spectrum    1 weight  0.10000E+01 volume  0.13625E-02 ppm1      9.031 ppm2      1.993 CV     1
 ASSI {   48}
   (( segid "    " and resid 131  and name HE  ))
   (  segid "    " and resid 191  and name HD2%)
      3.200     1.300     1.300 peak    48 spectrum    1 weight  0.10000E+01 volume  0.19704E-02 ppm1      9.030 ppm2      0.768 CV     1
 ASSI {   49}
   (( segid "    " and resid 131  and name HE  ))
   (  segid "    " and resid 185  and name HG1%)
      3.000     1.100     1.100 peak    49 spectrum    1 weight  0.10000E+01 volume  0.20142E-02 ppm1      9.031 ppm2      0.693 CV     1
 ASSI {   50}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 181  and name HG3 ))
      3.400     1.500     1.500 peak    50 spectrum    1 weight  0.10000E+01 volume  0.96993E-03 ppm1      7.990 ppm2      1.592 CV     1
 ASSI {   51}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 181  and name HB3 ))
      3.800     1.800     1.800 peak    51 spectrum    1 weight  0.10000E+01 volume  0.92801E-03 ppm1      7.993 ppm2      1.798 CV     1
 ASSI {   52}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 181  and name HG2 ))
      4.000     2.000     2.000 peak    52 spectrum    1 weight  0.10000E+01 volume  0.92610E-03 ppm1      7.989 ppm2      1.557 CV     1
 ASSI {   53}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 181  and name HB2 ))
      3.200     1.300     1.300 peak    53 spectrum    1 weight  0.10000E+01 volume  0.95088E-03 ppm1      7.990 ppm2      2.081 CV     1
 ASSI {   54}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 181  and name HD3 ))
      2.900     1.000     1.000 peak    54 spectrum    1 weight  0.10000E+01 volume  0.16769E-02 ppm1      7.990 ppm2      3.193 CV     1
 ASSI {   55}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 181  and name HD2 ))
      3.100     1.200     1.200 peak    55 spectrum    1 weight  0.10000E+01 volume  0.15264E-02 ppm1      7.989 ppm2      3.398 CV     1
 ASSI {   56}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 181  and name HA  ))
      4.700     2.700     1.300 peak    56 spectrum    1 weight  0.10000E+01 volume  0.73173E-03 ppm1      7.990 ppm2      3.976 CV     1
 ASSI {   57}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 105  and name HA  ))
      4.700     2.800     1.300 peak    57 spectrum    1 weight  0.10000E+01 volume  0.34111E-03 ppm1      7.987 ppm2      4.136 CV     1
 ASSI {   58}
   (( segid "    " and resid 181  and name HE  ))
   (  segid "    " and resid 50   and name HD% )
      3.200     1.300     1.300 peak    58 spectrum    1 weight  0.10000E+01 volume  0.22676E-03 ppm1      7.989 ppm2      5.504 CV     1
 ASSI {   60}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 50   and name HZ  ))
      2.400     2.400     3.600 peak    60 spectrum    1 weight  0.10000E+01 volume  0.13568E-02 ppm1      7.989 ppm2      6.726 CV     1
 ASSI {   61}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 61   and name HD1 ))
      3.600     1.600     1.600 peak    61 spectrum    1 weight  0.10000E+01 volume  0.59835E-03 ppm1      7.988 ppm2      7.334 CV     1
 ASSI {   62}
   (( segid "    " and resid 181  and name HE  ))
   (( segid "    " and resid 181  and name H   ))
      3.000     3.000     3.000 peak    62 spectrum    1 weight  0.10000E+01 volume  0.31824E-03 ppm1      7.989 ppm2      8.731 CV     1
 ASSI {   63}
   (( segid "    " and resid 202  and name HE21))
   (( segid "    " and resid 202  and name HE22))
      1.300     0.200     0.900 peak    63 spectrum    1 weight  0.10000E+01 volume  0.13384E+00 ppm1      6.685 ppm2      7.436 CV     1
 ASSI {   65}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name HG2 ))
      2.500     0.800     0.800 peak    65 spectrum    1 weight  0.10000E+01 volume  0.14444E-02 ppm1      8.138 ppm2      0.990 CV     1
 ASSI {   68}
   (( segid "    " and resid 67   and name H   ))
   (  segid "    " and resid 67   and name HB% )
      2.500     0.800     0.800 peak    68 spectrum    1 weight  0.10000E+01 volume  0.48764E-02 ppm1      8.138 ppm2      1.390 CV     1
 ASSI {   69}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name HB2 ))
      2.200     0.600     0.600 peak    69 spectrum    1 weight  0.10000E+01 volume  0.79063E-02 ppm1      8.145 ppm2      2.038 CV     1
 ASSI {   70}
   (( segid "    " and resid 1    and name H   ))
   (( segid "    " and resid 1    and name HB3 ))
      2.100     0.600     0.600 peak    70 spectrum    1 weight  0.10000E+01 volume  0.10766E-01 ppm1      8.146 ppm2      1.960 CV     1
 ASSI {   71}
   (( segid "    " and resid 1    and name H   ))
   (( segid "    " and resid 1    and name HG3 ))
      3.900     1.900     1.900 peak    71 spectrum    1 weight  0.10000E+01 volume  0.27955E-02 ppm1      8.146 ppm2      2.528 CV     1
 ASSI {   74}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 70   and name HB2 ))
      3.800     1.800     1.800 peak    74 spectrum    1 weight  0.10000E+01 volume  0.72602E-03 ppm1      8.139 ppm2      2.832 CV     1
 ASSI {   78}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
      2.800     1.000     1.000 peak    78 spectrum    1 weight  0.10000E+01 volume  0.14006E-02 ppm1      8.139 ppm2      4.853 CV     1
 ASSI {   79}
   (( segid "    " and resid 1    and name H   ))
   (( segid "    " and resid 2    and name H   ))
      2.600     0.900     0.900 peak    79 spectrum    1 weight  0.10000E+01 volume  0.46973E-02 ppm1      8.146 ppm2      7.972 CV     1
 ASSI {   80}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 199  and name H   ))
      2.400     0.700     0.700 peak    80 spectrum    1 weight  0.10000E+01 volume  0.44629E-02 ppm1      8.239 ppm2      7.845 CV     1
 ASSI {   81}
   (( segid "    " and resid 200  and name H   ))
   (  segid "    " and resid 199  and name HD% )
      3.400     1.500     1.500 peak    81 spectrum    1 weight  0.10000E+01 volume  0.16826E-02 ppm1      8.238 ppm2      6.970 CV     1
 ASSI {   82}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 199  and name HA  ))
      2.700     0.900     0.900 peak    82 spectrum    1 weight  0.10000E+01 volume  0.58062E-02 ppm1      8.239 ppm2      4.470 CV     1
 ASSI {   83}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 200  and name HA  ))
      2.400     0.700     0.700 peak    83 spectrum    1 weight  0.10000E+01 volume  0.53279E-02 ppm1      8.239 ppm2      4.347 CV     1
 ASSI {   84}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 200  and name HB2 ))
      3.200     1.300     1.300 peak    84 spectrum    1 weight  0.10000E+01 volume  0.27459E-02 ppm1      8.239 ppm2      3.814 CV     1
 ASSI {   85}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 200  and name HB3 ))
      3.200     1.300     1.300 peak    85 spectrum    1 weight  0.10000E+01 volume  0.36150E-02 ppm1      8.239 ppm2      3.708 CV     1
 ASSI {   86}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 199  and name HB2 ))
      3.300     1.400     1.400 peak    86 spectrum    1 weight  0.10000E+01 volume  0.25687E-02 ppm1      8.239 ppm2      2.961 CV     1
 ASSI {   87}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 199  and name HB3 ))
      3.400     1.500     1.500 peak    87 spectrum    1 weight  0.10000E+01 volume  0.25153E-02 ppm1      8.239 ppm2      2.785 CV     1
 ASSI {   88}
   (( segid "    " and resid 199  and name H   ))
   (  segid "    " and resid 199  and name HD% )
      2.300     0.700     0.700 peak    88 spectrum    1 weight  0.10000E+01 volume  0.42132E-02 ppm1      7.845 ppm2      6.968 CV     1
 ASSI {   90}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 198  and name H   ))
      2.600     0.800     0.800 peak    90 spectrum    1 weight  0.10000E+01 volume  0.25763E-02 ppm1      7.845 ppm2      8.152 CV     1
 ASSI {   91}
   (( segid "    " and resid 198  and name H   ))
   (  segid "    " and resid 198  and name HE% )
      4.800     2.900     1.200 peak    91 spectrum    1 weight  0.10000E+01 volume  0.63073E-03 ppm1      8.151 ppm2      7.111 CV     1
 ASSI {   92}
   (( segid "    " and resid 198  and name H   ))
   (  segid "    " and resid 198  and name HD% )
      3.100     1.200     1.200 peak    92 spectrum    1 weight  0.10000E+01 volume  0.30356E-02 ppm1      8.147 ppm2      6.978 CV     1
 ASSI {   94}
   (( segid "    " and resid 198  and name H   ))
   (( segid "    " and resid 197  and name H   ))
      4.400     2.400     1.600 peak    94 spectrum    1 weight  0.10000E+01 volume  0.92230E-03 ppm1      8.148 ppm2      7.550 CV     1
 ASSI {   95}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 195  and name HE  ))
      4.300     2.300     1.700 peak    95 spectrum    1 weight  0.10000E+01 volume  0.40590E-03 ppm1      7.843 ppm2      6.726 CV     1
 ASSI {   97}
   (( segid "    " and resid 200  and name H   ))
   (  segid "    " and resid 199  and name HE% )
      4.600     2.700     1.400 peak    97 spectrum    1 weight  0.10000E+01 volume  0.37349E-03 ppm1      8.239 ppm2      6.610 CV     1
 ASSI {  100}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 200  and name HB3 ))
      5.100     3.200     0.900 peak   100 spectrum    1 weight  0.10000E+01 volume  0.44590E-03 ppm1      7.841 ppm2      3.702 CV     1
 ASSI {  104}
   (( segid "    " and resid 198  and name H   ))
   (( segid "    " and resid 197  and name HB2 ))
      3.900     1.900     1.900 peak   104 spectrum    1 weight  0.10000E+01 volume  0.14902E-02 ppm1      8.148 ppm2      2.439 CV     1
 ASSI {  105}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 199  and name HB2 ))
      3.300     1.400     1.400 peak   105 spectrum    1 weight  0.10000E+01 volume  0.54137E-02 ppm1      7.845 ppm2      2.958 CV     1
 ASSI {  106}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 199  and name HB3 ))
      2.400     0.700     0.700 peak   106 spectrum    1 weight  0.10000E+01 volume  0.51317E-02 ppm1      7.845 ppm2      2.785 CV     1
 ASSI {  107}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 197  and name HB3 ))
      2.700     0.900     0.900 peak   107 spectrum    1 weight  0.10000E+01 volume  0.28927E-02 ppm1      7.844 ppm2      2.687 CV     1
 ASSI {  108}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 197  and name HB2 ))
      4.000     2.000     2.000 peak   108 spectrum    1 weight  0.10000E+01 volume  0.89560E-03 ppm1      7.846 ppm2      2.435 CV     1
 ASSI {  109}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 126  and name HB3 ))
      4.800     2.900     1.200 peak   109 spectrum    1 weight  0.10000E+01 volume  0.54119E-03 ppm1      7.846 ppm2      2.114 CV     1
 ASSI {  110}
   (( segid "    " and resid 199  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
      4.700     2.700     1.300 peak   110 spectrum    1 weight  0.10000E+01 volume  0.64598E-03 ppm1      7.844 ppm2      1.818 CV     1
 ASSI {  111}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 134  and name HB2 ))
      3.400     1.400     1.400 peak   111 spectrum    1 weight  0.10000E+01 volume  0.32966E-02 ppm1      8.189 ppm2      2.044 CV     1
 ASSI {  112}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 134  and name HB3 ))
      2.900     1.000     1.000 peak   112 spectrum    1 weight  0.10000E+01 volume  0.55832E-02 ppm1      8.188 ppm2      1.912 CV     1
 ASSI {  113}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 133  and name HB3 ))
      2.400     0.700     0.700 peak   113 spectrum    1 weight  0.10000E+01 volume  0.35540E-02 ppm1      8.189 ppm2      1.492 CV     1
 ASSI {  114}
   (( segid "    " and resid 134  and name H   ))
   (  segid "    " and resid 133  and name HD1%)
      3.800     1.800     1.800 peak   114 spectrum    1 weight  0.10000E+01 volume  0.25668E-02 ppm1      8.187 ppm2      0.798 CV     1
 ASSI {  115}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 196  and name H   ))
      2.900     1.100     1.100 peak   115 spectrum    1 weight  0.10000E+01 volume  0.18713E-02 ppm1      7.550 ppm2      8.344 CV     1
 ASSI {  117}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 199  and name H   ))
      5.400     3.700     0.600 peak   117 spectrum    1 weight  0.10000E+01 volume  0.34491E-03 ppm1      7.547 ppm2      7.829 CV     1
 ASSI {  119}
   (( segid "    " and resid 197  and name H   ))
   (  segid "    " and resid 197  and name HE% )
      4.900     3.000     1.100 peak   119 spectrum    1 weight  0.10000E+01 volume  0.48591E-03 ppm1      7.549 ppm2      7.124 CV     1
 ASSI {  120}
   (( segid "    " and resid 197  and name H   ))
   (  segid "    " and resid 197  and name HD% )
      3.400     1.500     1.500 peak   120 spectrum    1 weight  0.10000E+01 volume  0.17150E-02 ppm1      7.550 ppm2      7.005 CV     1
 ASSI {  121}
   (( segid "    " and resid 197  and name H   ))
   (  segid "    " and resid 127  and name HD% )
      2.700     2.700     3.300 peak   121 spectrum    1 weight  0.10000E+01 volume  0.60598E-03 ppm1      7.547 ppm2      6.848 CV     1
 ASSI {  122}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 195  and name HE  ))
      4.200     2.200     1.800 peak   122 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      7.552 ppm2      6.715 CV     1
 ASSI {  123}
   (( segid "    " and resid 196  and name H   ))
   (  segid "    " and resid 127  and name HD% )
      5.200     3.300     0.800 peak   123 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      8.343 ppm2      6.860 CV     1
 ASSI {  125}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 126  and name HA  ))
      3.300     1.300     1.300 peak   125 spectrum    1 weight  0.10000E+01 volume  0.85751E-03 ppm1      7.548 ppm2      4.190 CV     1
 ASSI {  129}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 195  and name HA  ))
      4.100     2.100     1.900 peak   129 spectrum    1 weight  0.10000E+01 volume  0.90514E-03 ppm1      7.548 ppm2      3.621 CV     1
 ASSI {  130}
   (( segid "    " and resid 196  and name H   ))
   (( segid "    " and resid 127  and name HB3 ))
      4.800     2.900     1.200 peak   130 spectrum    1 weight  0.10000E+01 volume  0.44590E-03 ppm1      8.343 ppm2      2.795 CV     1
 ASSI {  134}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 126  and name HB3 ))
      4.200     2.200     1.800 peak   134 spectrum    1 weight  0.10000E+01 volume  0.58310E-03 ppm1      7.548 ppm2      2.089 CV     1
 ASSI {  135}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
      3.700     1.800     1.800 peak   135 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1      7.550 ppm2      1.826 CV     1
 ASSI {  136}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 195  and name HB3 ))
      4.400     2.400     1.600 peak   136 spectrum    1 weight  0.10000E+01 volume  0.51449E-03 ppm1      7.552 ppm2      1.508 CV     1
 ASSI {  137}
   (( segid "    " and resid 196  and name H   ))
   (( segid "    " and resid 195  and name HB3 ))
      4.800     2.900     1.200 peak   137 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      8.345 ppm2      1.500 CV     1
 ASSI {  138}
   (( segid "    " and resid 196  and name H   ))
   (( segid "    " and resid 195  and name HB2 ))
      5.000     3.200     1.000 peak   138 spectrum    1 weight  0.10000E+01 volume  0.37731E-03 ppm1      8.344 ppm2      1.197 CV     1
 ASSI {  139}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 195  and name HB2 ))
      3.000     3.000     3.000 peak   139 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      7.551 ppm2      1.203 CV     1
 ASSI {  141}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 196  and name HB3 ))
      2.500     0.800     0.800 peak   141 spectrum    1 weight  0.10000E+01 volume  0.20790E-02 ppm1      7.550 ppm2      0.828 CV     1
 ASSI {  142}
   (( segid "    " and resid 196  and name H   ))
   (( segid "    " and resid 196  and name HB2 ))
      3.200     1.200     1.200 peak   142 spectrum    1 weight  0.10000E+01 volume  0.88038E-03 ppm1      8.343 ppm2      0.910 CV     1
 ASSI {  143}
   (( segid "    " and resid 196  and name H   ))
   (( segid "    " and resid 196  and name HB3 ))
      2.900     1.100     1.100 peak   143 spectrum    1 weight  0.10000E+01 volume  0.13015E-02 ppm1      8.343 ppm2      0.826 CV     1
 ASSI {  144}
   (( segid "    " and resid 196  and name H   ))
   (( segid "    " and resid 196  and name HG3 ))
      5.000     3.100     1.000 peak   144 spectrum    1 weight  0.10000E+01 volume  0.46877E-03 ppm1      8.344 ppm2      0.210 CV     1
 ASSI {  145}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 196  and name HG3 ))
      4.800     2.900     1.200 peak   145 spectrum    1 weight  0.10000E+01 volume  0.64027E-03 ppm1      7.547 ppm2      0.196 CV     1
 ASSI {  146}
   (( segid "    " and resid 197  and name H   ))
   (( segid "    " and resid 196  and name HG2 ))
      3.800     1.800     1.800 peak   146 spectrum    1 weight  0.10000E+01 volume  0.63265E-03 ppm1      7.547 ppm2      0.150 CV     1
 ASSI {  149}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 128  and name H   ))
      3.500     1.500     1.500 peak   149 spectrum    1 weight  0.10000E+01 volume  0.64027E-03 ppm1      8.643 ppm2      8.874 CV     1
 ASSI {  150}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 130  and name H   ))
      4.200     2.200     1.800 peak   150 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1      8.642 ppm2      8.787 CV     1
 ASSI {  151}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name HE3 ))
      3.800     1.800     1.800 peak   151 spectrum    1 weight  0.10000E+01 volume  0.65743E-03 ppm1      8.785 ppm2      7.526 CV     1
 ASSI {  152}
   (( segid "    " and resid 195  and name H   ))
   (( segid "    " and resid 194  and name HE  ))
      4.700     2.700     1.300 peak   152 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      8.783 ppm2      7.335 CV     1
 ASSI {  153}
   (( segid "    " and resid 195  and name H   ))
   (( segid "    " and resid 194  and name H   ))
      4.600     2.600     1.400 peak   153 spectrum    1 weight  0.10000E+01 volume  0.52594E-03 ppm1      8.777 ppm2      8.643 CV     1
 ASSI {  154}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name H   ))
      4.300     2.300     1.700 peak   154 spectrum    1 weight  0.10000E+01 volume  0.79272E-03 ppm1      8.784 ppm2      8.453 CV     1
 ASSI {  156}
   (( segid "    " and resid 195  and name H   ))
   (  segid "    " and resid 127  and name HD% )
      3.900     1.900     1.900 peak   156 spectrum    1 weight  0.10000E+01 volume  0.76605E-03 ppm1      8.783 ppm2      6.858 CV     1
 ASSI {  157}
   (( segid "    " and resid 195  and name H   ))
   (  segid "    " and resid 127  and name HE% )
      4.200     2.300     1.800 peak   157 spectrum    1 weight  0.10000E+01 volume  0.79463E-03 ppm1      8.780 ppm2      6.634 CV     1
 ASSI {  158}
   (( segid "    " and resid 194  and name H   ))
   (  segid "    " and resid 127  and name HE% )
      5.000     3.100     1.000 peak   158 spectrum    1 weight  0.10000E+01 volume  0.29916E-03 ppm1      8.645 ppm2      6.641 CV     1
 ASSI {  159}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 129  and name HA  ))
      3.700     1.700     1.700 peak   159 spectrum    1 weight  0.10000E+01 volume  0.50878E-03 ppm1      8.641 ppm2      5.568 CV     1
 ASSI {  160}
   (( segid "    " and resid 62   and name H   ))
   (  segid "    " and resid 50   and name HD% )
      4.800     2.900     1.200 peak   160 spectrum    1 weight  0.10000E+01 volume  0.56786E-03 ppm1      8.786 ppm2      5.504 CV     1
 ASSI {  161}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name HA  ))
      2.600     0.800     0.800 peak   161 spectrum    1 weight  0.10000E+01 volume  0.20733E-02 ppm1      8.785 ppm2      4.871 CV     1
 ASSI {  162}
   (( segid "    " and resid 195  and name H   ))
   (( segid "    " and resid 194  and name HA  ))
      2.400     0.700     0.700 peak   162 spectrum    1 weight  0.10000E+01 volume  0.39235E-02 ppm1      8.780 ppm2      4.736 CV     1
 ASSI {  164}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 194  and name HA  ))
      3.100     1.200     1.200 peak   164 spectrum    1 weight  0.10000E+01 volume  0.12120E-02 ppm1      8.645 ppm2      4.742 CV     1
 ASSI {  166}
   (( segid "    " and resid 195  and name H   ))
   (( segid "    " and resid 195  and name HA  ))
      3.300     1.300     1.300 peak   166 spectrum    1 weight  0.10000E+01 volume  0.79272E-03 ppm1      8.784 ppm2      3.616 CV     1
 ASSI {  167}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name HB3 ))
      3.900     1.900     1.900 peak   167 spectrum    1 weight  0.10000E+01 volume  0.63073E-03 ppm1      8.786 ppm2      3.164 CV     1
 ASSI {  171}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 193  and name HB2 ))
      4.600     2.700     1.400 peak   171 spectrum    1 weight  0.10000E+01 volume  0.51640E-03 ppm1      8.643 ppm2      1.003 CV     1
 ASSI {  172}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 194  and name HB2 ))
      2.900     1.000     1.000 peak   172 spectrum    1 weight  0.10000E+01 volume  0.13034E-02 ppm1      8.643 ppm2      1.501 CV     1
 ASSI {  174}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 193  and name HB3 ))
      4.500     2.500     1.500 peak   174 spectrum    1 weight  0.10000E+01 volume  0.56977E-03 ppm1      8.643 ppm2      1.835 CV     1
 ASSI {  175}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 194  and name HB3 ))
      4.100     2.100     1.900 peak   175 spectrum    1 weight  0.10000E+01 volume  0.89180E-03 ppm1      8.644 ppm2      1.716 CV     1
 ASSI {  177}
   (( segid "    " and resid 195  and name H   ))
   (( segid "    " and resid 195  and name HB3 ))
      2.600     0.800     0.800 peak   177 spectrum    1 weight  0.10000E+01 volume  0.31327E-02 ppm1      8.781 ppm2      1.500 CV     1
 ASSI {  178}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 62   and name HB3 ))
      3.300     1.400     1.400 peak   178 spectrum    1 weight  0.10000E+01 volume  0.19494E-02 ppm1      8.784 ppm2      1.420 CV     1
 ASSI {  186}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 130  and name H   ))
      3.500     1.500     1.500 peak   186 spectrum    1 weight  0.10000E+01 volume  0.62693E-03 ppm1      9.084 ppm2      8.789 CV     1
 ASSI {  187}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 132  and name H   ))
      4.400     2.400     1.600 peak   187 spectrum    1 weight  0.10000E+01 volume  0.39065E-03 ppm1      9.086 ppm2      8.660 CV     1
 ASSI {  188}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 193  and name H   ))
      4.800     2.900     1.200 peak   188 spectrum    1 weight  0.10000E+01 volume  0.33728E-03 ppm1      9.085 ppm2      7.889 CV     1
 ASSI {  190}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 129  and name HA  ))
      5.000     3.100     1.000 peak   190 spectrum    1 weight  0.10000E+01 volume  0.32012E-03 ppm1      9.082 ppm2      5.559 CV     1
 ASSI {  192}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 192  and name HA  ))
      3.700     1.700     1.700 peak   192 spectrum    1 weight  0.10000E+01 volume  0.33728E-03 ppm1      9.081 ppm2      4.712 CV     1
 ASSI {  193}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 131  and name HA  ))
      4.300     2.300     1.700 peak   193 spectrum    1 weight  0.10000E+01 volume  0.33919E-03 ppm1      9.083 ppm2      4.437 CV     1
 ASSI {  194}
   (( segid "    " and resid 187  and name H   ))
   (( segid "    " and resid 186  and name HA  ))
      2.800     1.000     1.000 peak   194 spectrum    1 weight  0.10000E+01 volume  0.41409E-02 ppm1      9.098 ppm2      4.311 CV     1
 ASSI {  196}
   (( segid "    " and resid 187  and name H   ))
   (( segid "    " and resid 186  and name HB3 ))
      2.600     0.800     0.800 peak   196 spectrum    1 weight  0.10000E+01 volume  0.13301E-02 ppm1      9.094 ppm2      1.684 CV     1
 ASSI {  199}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 192  and name HG  ))
      2.700     0.900     0.900 peak   199 spectrum    1 weight  0.10000E+01 volume  0.18389E-02 ppm1      9.083 ppm2      1.381 CV     1
 OR {  199}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 192  and name HB2 ))
 ASSI {  200}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 191  and name HB3 ))
      3.400     1.500     1.500 peak   200 spectrum    1 weight  0.10000E+01 volume  0.74889E-03 ppm1      9.079 ppm2      1.251 CV     1
 ASSI {  203}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 194  and name H   ))
      5.100     3.300     0.900 peak   203 spectrum    1 weight  0.10000E+01 volume  0.33728E-03 ppm1      7.879 ppm2      8.653 CV     1
 ASSI {  205}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 91   and name H   ))
      3.800     1.800     1.800 peak   205 spectrum    1 weight  0.10000E+01 volume  0.40207E-03 ppm1      7.882 ppm2      9.212 CV     1
 ASSI {  206}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 90   and name HA  ))
      5.300     3.500     0.700 peak   206 spectrum    1 weight  0.10000E+01 volume  0.28203E-03 ppm1      7.887 ppm2      5.044 CV     1
 ASSI {  207}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 193  and name HA  ))
      3.300     1.300     1.300 peak   207 spectrum    1 weight  0.10000E+01 volume  0.93563E-03 ppm1      7.885 ppm2      4.864 CV     1
 ASSI {  208}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 192  and name HA  ))
      3.000     1.100     1.100 peak   208 spectrum    1 weight  0.10000E+01 volume  0.84989E-03 ppm1      7.884 ppm2      4.723 CV     1
 ASSI {  209}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 193  and name HB3 ))
      3.000     1.100     1.100 peak   209 spectrum    1 weight  0.10000E+01 volume  0.13834E-02 ppm1      7.885 ppm2      1.844 CV     1
 ASSI {  210}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 91   and name HB3 ))
      3.700     1.700     1.700 peak   210 spectrum    1 weight  0.10000E+01 volume  0.63073E-03 ppm1      7.885 ppm2      1.709 CV     1
 ASSI {  213}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 193  and name HB2 ))
      3.000     1.200     1.200 peak   213 spectrum    1 weight  0.10000E+01 volume  0.11662E-02 ppm1      7.884 ppm2      1.013 CV     1
 ASSI {  214}
   (( segid "    " and resid 193  and name H   ))
   (  segid "    " and resid 192  and name HD2%)
      2.100     2.100     3.900 peak   214 spectrum    1 weight  0.10000E+01 volume  0.28335E-02 ppm1      7.885 ppm2      0.717 CV     1
 ASSI {  216}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 191  and name H   ))
      4.300     2.300     1.700 peak   216 spectrum    1 weight  0.10000E+01 volume  0.37731E-03 ppm1      9.084 ppm2      8.425 CV     1
 ASSI {  217}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 91   and name H   ))
      4.100     2.100     1.900 peak   217 spectrum    1 weight  0.10000E+01 volume  0.42686E-03 ppm1      8.422 ppm2      9.213 CV     1
 ASSI {  222}
   (( segid "    " and resid 187  and name H   ))
   (( segid "    " and resid 186  and name HB2 ))
      3.000     1.100     1.100 peak   222 spectrum    1 weight  0.10000E+01 volume  0.30947E-02 ppm1      9.097 ppm2      2.173 CV     1
 ASSI {  224}
   (( segid "    " and resid 187  and name H   ))
   (( segid "    " and resid 187  and name HB2 ))
      2.500     0.800     0.800 peak   224 spectrum    1 weight  0.10000E+01 volume  0.31498E-02 ppm1      9.097 ppm2      1.884 CV     1
 ASSI {  225}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 191  and name HB3 ))
      4.200     2.200     1.800 peak   225 spectrum    1 weight  0.10000E+01 volume  0.66885E-03 ppm1      8.421 ppm2      1.252 CV     1
 ASSI {  229}
   (( segid "    " and resid 192  and name H   ))
   (  segid "    " and resid 129  and name HD2%)
      3.800     1.800     1.800 peak   229 spectrum    1 weight  0.10000E+01 volume  0.53356E-03 ppm1      9.082 ppm2      0.643 CV     1
 ASSI {  230}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 189  and name H   ))
      4.300     2.300     1.700 peak   230 spectrum    1 weight  0.10000E+01 volume  0.89751E-03 ppm1      8.632 ppm2      7.021 CV     1
 ASSI {  231}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 109  and name H   ))
      3.000     1.100     1.100 peak   231 spectrum    1 weight  0.10000E+01 volume  0.18922E-02 ppm1      7.020 ppm2      8.776 CV     1
 ASSI {  233}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 107  and name H   ))
      3.900     1.900     1.900 peak   233 spectrum    1 weight  0.10000E+01 volume  0.76794E-03 ppm1      7.021 ppm2      8.508 CV     1
 ASSI {  234}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 111  and name H   ))
      2.800     1.000     1.000 peak   234 spectrum    1 weight  0.10000E+01 volume  0.20199E-02 ppm1      7.021 ppm2      8.418 CV     1
 ASSI {  235}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 188  and name H   ))
      3.100     1.200     1.200 peak   235 spectrum    1 weight  0.10000E+01 volume  0.80223E-03 ppm1      7.020 ppm2      7.784 CV     1
 ASSI {  236}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 191  and name H   ))
      5.200     3.400     0.800 peak   236 spectrum    1 weight  0.10000E+01 volume  0.37920E-03 ppm1      8.631 ppm2      8.437 CV     1
 ASSI {  237}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 187  and name H   ))
      5.200     3.400     0.800 peak   237 spectrum    1 weight  0.10000E+01 volume  0.40778E-03 ppm1      7.022 ppm2      9.096 CV     1
 ASSI {  239}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 109  and name HA  ))
      3.300     1.400     1.400 peak   239 spectrum    1 weight  0.10000E+01 volume  0.13853E-02 ppm1      7.019 ppm2      3.791 CV     1
 ASSI {  240}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 188  and name HA  ))
      3.300     1.400     1.400 peak   240 spectrum    1 weight  0.10000E+01 volume  0.15702E-02 ppm1      7.021 ppm2      4.529 CV     1
 ASSI {  241}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 110  and name HA  ))
      2.900     1.000     1.000 peak   241 spectrum    1 weight  0.10000E+01 volume  0.29575E-02 ppm1      7.021 ppm2      4.380 CV     1
 ASSI {  242}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 189  and name HA  ))
      2.400     0.700     0.700 peak   242 spectrum    1 weight  0.10000E+01 volume  0.56194E-02 ppm1      8.631 ppm2      4.014 CV     1
 ASSI {  243}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 190  and name HB  ))
      2.800     1.000     1.000 peak   243 spectrum    1 weight  0.10000E+01 volume  0.29707E-02 ppm1      8.631 ppm2      3.895 CV     1
 ASSI {  244}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 190  and name HA  ))
      3.200     1.300     1.300 peak   244 spectrum    1 weight  0.10000E+01 volume  0.11167E-02 ppm1      8.631 ppm2      4.546 CV     1
 ASSI {  245}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 108  and name HA  ))
      4.200     2.200     1.800 peak   245 spectrum    1 weight  0.10000E+01 volume  0.41732E-03 ppm1      7.023 ppm2      3.462 CV     1
 ASSI {  246}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 188  and name HB2 ))
      4.500     2.500     1.500 peak   246 spectrum    1 weight  0.10000E+01 volume  0.53547E-03 ppm1      7.021 ppm2      3.250 CV     1
 ASSI {  247}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 188  and name HB3 ))
      4.600     2.700     1.400 peak   247 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1      7.022 ppm2      3.048 CV     1
 ASSI {  248}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 110  and name HB2 ))
      2.600     0.900     0.900 peak   248 spectrum    1 weight  0.10000E+01 volume  0.26965E-02 ppm1      7.020 ppm2      2.674 CV     1
 ASSI {  249}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 110  and name HB3 ))
      2.900     1.000     1.000 peak   249 spectrum    1 weight  0.10000E+01 volume  0.29764E-02 ppm1      7.021 ppm2      2.595 CV     1
 ASSI {  250}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 108  and name HB  ))
      5.100     3.300     0.900 peak   250 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      7.021 ppm2      2.322 CV     1
 ASSI {  251}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 186  and name HG2 ))
      4.800     2.800     1.200 peak   251 spectrum    1 weight  0.10000E+01 volume  0.86322E-03 ppm1      7.022 ppm2      2.195 CV     1
 ASSI {  252}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 189  and name HG3 ))
      2.900     1.100     1.100 peak   252 spectrum    1 weight  0.10000E+01 volume  0.23839E-02 ppm1      7.021 ppm2      2.026 CV     1
 ASSI {  253}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 189  and name HG2 ))
      2.700     0.900     0.900 peak   253 spectrum    1 weight  0.10000E+01 volume  0.37310E-02 ppm1      7.022 ppm2      1.840 CV     1
 OR {  253}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 189  and name HB3 ))
 ASSI {  254}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 111  and name HB2 ))
      4.400     2.400     1.600 peak   254 spectrum    1 weight  0.10000E+01 volume  0.89751E-03 ppm1      7.023 ppm2      1.717 CV     1
 ASSI {  255}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 106  and name HD3 ))
      4.500     2.500     1.500 peak   255 spectrum    1 weight  0.10000E+01 volume  0.53927E-03 ppm1      7.020 ppm2      1.499 CV     1
 ASSI {  257}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 108  and name HG2%)
      5.500     3.700     0.500 peak   257 spectrum    1 weight  0.10000E+01 volume  0.37920E-03 ppm1      7.022 ppm2      0.933 CV     1
 ASSI {  258}
   (( segid "    " and resid 189  and name H   ))
   (  segid "    " and resid 191  and name HD1%)
      3.400     1.400     1.400 peak   258 spectrum    1 weight  0.10000E+01 volume  0.15511E-02 ppm1      7.021 ppm2      0.759 CV     1
 ASSI {  260}
   (( segid "    " and resid 190  and name H   ))
   (  segid "    " and resid 191  and name HD2%)
      4.000     2.000     2.000 peak   260 spectrum    1 weight  0.10000E+01 volume  0.89943E-03 ppm1      8.631 ppm2      0.755 CV     1
 ASSI {  262}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 189  and name HB3 ))
      3.300     1.300     1.300 peak   262 spectrum    1 weight  0.10000E+01 volume  0.19913E-02 ppm1      8.632 ppm2      1.837 CV     1
 ASSI {  263}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 89   and name HB3 ))
      3.700     1.700     1.700 peak   263 spectrum    1 weight  0.10000E+01 volume  0.60026E-03 ppm1      8.420 ppm2      1.812 CV     1
 ASSI {  264}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 191  and name HB2 ))
      2.900     1.100     1.100 peak   264 spectrum    1 weight  0.10000E+01 volume  0.15511E-02 ppm1      8.421 ppm2      1.634 CV     1
 OR {  264}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 191  and name HG  ))
 ASSI {  265}
   (( segid "    " and resid 186  and name H   ))
   (( segid "    " and resid 187  and name H   ))
      4.800     2.800     1.200 peak   265 spectrum    1 weight  0.10000E+01 volume  0.44781E-03 ppm1      8.814 ppm2      9.094 CV     1
 ASSI {  266}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 186  and name H   ))
      5.000     3.100     1.000 peak   266 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      7.338 ppm2      8.815 CV     1
 ASSI {  267}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 184  and name H   ))
      2.700     0.900     0.900 peak   267 spectrum    1 weight  0.10000E+01 volume  0.21952E-02 ppm1      7.338 ppm2      7.702 CV     1
 ASSI {  269}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 183  and name H   ))
      4.000     2.000     2.000 peak   269 spectrum    1 weight  0.10000E+01 volume  0.70506E-03 ppm1      7.339 ppm2      7.159 CV     1
 ASSI {  270}
   (( segid "    " and resid 186  and name H   ))
   (( segid "    " and resid 189  and name H   ))
      4.500     2.500     1.500 peak   270 spectrum    1 weight  0.10000E+01 volume  0.40398E-03 ppm1      8.814 ppm2      7.026 CV     1
 ASSI {  271}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 184  and name HA3 ))
      3.600     1.600     1.600 peak   271 spectrum    1 weight  0.10000E+01 volume  0.11300E-02 ppm1      7.337 ppm2      4.039 CV     1
 ASSI {  273}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 185  and name HA  ))
      2.900     1.000     1.000 peak   273 spectrum    1 weight  0.10000E+01 volume  0.21533E-02 ppm1      7.339 ppm2      3.841 CV     1
 ASSI {  274}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 184  and name HA2 ))
      3.200     1.300     1.300 peak   274 spectrum    1 weight  0.10000E+01 volume  0.11148E-02 ppm1      7.339 ppm2      3.657 CV     1
 ASSI {  275}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 183  and name HA  ))
      4.700     2.800     1.300 peak   275 spectrum    1 weight  0.10000E+01 volume  0.46306E-03 ppm1      7.338 ppm2      4.495 CV     1
 ASSI {  281}
   (( segid "    " and resid 186  and name H   ))
   (( segid "    " and resid 189  and name HG3 ))
      3.600     1.600     1.600 peak   281 spectrum    1 weight  0.10000E+01 volume  0.50307E-03 ppm1      8.815 ppm2      2.032 CV     1
 ASSI {  282}
   (( segid "    " and resid 186  and name H   ))
   (( segid "    " and resid 189  and name HG2 ))
      4.200     2.200     1.800 peak   282 spectrum    1 weight  0.10000E+01 volume  0.49353E-03 ppm1      8.813 ppm2      1.849 CV     1
 OR {  282}
   (( segid "    " and resid 186  and name H   ))
   (( segid "    " and resid 189  and name HB3 ))
 ASSI {  283}
   (( segid "    " and resid 186  and name H   ))
   (( segid "    " and resid 185  and name HB  ))
      2.800     1.000     1.000 peak   283 spectrum    1 weight  0.10000E+01 volume  0.16312E-02 ppm1      8.815 ppm2      1.699 CV     1
 ASSI {  284}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 185  and name HB  ))
      3.400     1.400     1.400 peak   284 spectrum    1 weight  0.10000E+01 volume  0.28487E-02 ppm1      7.339 ppm2      1.688 CV     1
 ASSI {  285}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 183  and name HB3 ))
      4.400     2.500     1.600 peak   285 spectrum    1 weight  0.10000E+01 volume  0.55261E-03 ppm1      7.338 ppm2      2.048 CV     1
 ASSI {  287}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 180  and name HB3 ))
      4.400     2.400     1.600 peak   287 spectrum    1 weight  0.10000E+01 volume  0.67077E-03 ppm1      7.337 ppm2      1.165 CV     1
 ASSI {  289}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 183  and name H   ))
      2.700     0.900     0.900 peak   289 spectrum    1 weight  0.10000E+01 volume  0.20294E-02 ppm1      7.701 ppm2      7.158 CV     1
 ASSI {  290}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 182  and name H   ))
      4.300     2.300     1.700 peak   290 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      7.702 ppm2      7.997 CV     1
 ASSI {  294}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 183  and name HE21))
      4.600     2.700     1.400 peak   294 spectrum    1 weight  0.10000E+01 volume  0.43448E-03 ppm1      7.158 ppm2      6.510 CV     1
 ASSI {  296}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 182  and name HA  ))
      3.600     1.600     1.600 peak   296 spectrum    1 weight  0.10000E+01 volume  0.10138E-02 ppm1      7.157 ppm2      4.384 CV     1
 ASSI {  299}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 184  and name HA3 ))
      3.100     1.200     1.200 peak   299 spectrum    1 weight  0.10000E+01 volume  0.31022E-02 ppm1      7.701 ppm2      4.044 CV     1
 ASSI {  302}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 181  and name HA  ))
      4.300     2.300     1.700 peak   302 spectrum    1 weight  0.10000E+01 volume  0.44970E-03 ppm1      7.157 ppm2      3.981 CV     1
 ASSI {  303}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 180  and name HA  ))
      3.500     1.600     1.600 peak   303 spectrum    1 weight  0.10000E+01 volume  0.59835E-03 ppm1      7.159 ppm2      3.841 CV     1
 ASSI {  304}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 184  and name HA2 ))
      5.100     3.200     0.900 peak   304 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      7.157 ppm2      3.660 CV     1
 ASSI {  305}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 184  and name HA2 ))
      2.600     0.800     0.800 peak   305 spectrum    1 weight  0.10000E+01 volume  0.30394E-02 ppm1      7.702 ppm2      3.656 CV     1
 ASSI {  307}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 57   and name HE2 ))
      3.000     3.000     3.000 peak   307 spectrum    1 weight  0.10000E+01 volume  0.31441E-03 ppm1      7.337 ppm2      2.938 CV     1
 ASSI {  308}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 183  and name HG3 ))
      5.500     3.800     0.500 peak   308 spectrum    1 weight  0.10000E+01 volume  0.26678E-03 ppm1      7.341 ppm2      2.544 CV     1
 ASSI {  309}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 183  and name HG3 ))
      4.700     2.700     1.300 peak   309 spectrum    1 weight  0.10000E+01 volume  0.59835E-03 ppm1      7.702 ppm2      2.556 CV     1
 ASSI {  310}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 183  and name HG3 ))
      2.600     0.900     0.900 peak   310 spectrum    1 weight  0.10000E+01 volume  0.15835E-02 ppm1      7.159 ppm2      2.544 CV     1
 ASSI {  311}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 183  and name HG2 ))
      3.600     1.600     1.600 peak   311 spectrum    1 weight  0.10000E+01 volume  0.19589E-02 ppm1      7.158 ppm2      2.215 CV     1
 ASSI {  312}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 183  and name HB3 ))
      3.700     1.800     1.800 peak   312 spectrum    1 weight  0.10000E+01 volume  0.18046E-02 ppm1      7.158 ppm2      2.056 CV     1
 ASSI {  313}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 182  and name HB2 ))
      4.300     2.300     1.700 peak   313 spectrum    1 weight  0.10000E+01 volume  0.88609E-03 ppm1      7.159 ppm2      1.947 CV     1
 ASSI {  314}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 182  and name HB3 ))
      4.700     2.800     1.300 peak   314 spectrum    1 weight  0.10000E+01 volume  0.32586E-03 ppm1      7.697 ppm2      2.302 CV     1
 ASSI {  315}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 183  and name HG2 ))
      4.600     2.600     1.400 peak   315 spectrum    1 weight  0.10000E+01 volume  0.67265E-03 ppm1      7.700 ppm2      2.219 CV     1
 ASSI {  316}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 183  and name HB3 ))
      4.400     2.500     1.600 peak   316 spectrum    1 weight  0.10000E+01 volume  0.60215E-03 ppm1      7.701 ppm2      2.060 CV     1
 ASSI {  317}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 182  and name HB2 ))
      2.900     2.900     3.100 peak   317 spectrum    1 weight  0.10000E+01 volume  0.38491E-03 ppm1      7.701 ppm2      1.939 CV     1
 ASSI {  319}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 57   and name HG3 ))
      4.900     3.000     1.100 peak   319 spectrum    1 weight  0.10000E+01 volume  0.77556E-03 ppm1      7.698 ppm2      1.453 CV     1
 ASSI {  320}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 57   and name HD3 ))
      4.800     2.800     1.200 peak   320 spectrum    1 weight  0.10000E+01 volume  0.50498E-03 ppm1      7.158 ppm2      1.666 CV     1
 OR {  320}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 57   and name HD2 ))
 ASSI {  323}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 182  and name H   ))
      3.100     1.200     1.200 peak   323 spectrum    1 weight  0.10000E+01 volume  0.92039E-03 ppm1      8.730 ppm2      7.995 CV     1
 ASSI {  325}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 183  and name H   ))
      2.700     0.900     0.900 peak   325 spectrum    1 weight  0.10000E+01 volume  0.15664E-02 ppm1      7.991 ppm2      7.158 CV     1
 ASSI {  327}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 183  and name HA  ))
      5.300     3.600     0.700 peak   327 spectrum    1 weight  0.10000E+01 volume  0.46306E-03 ppm1      7.993 ppm2      4.484 CV     1
 ASSI {  328}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 182  and name HA  ))
      3.000     1.200     1.200 peak   328 spectrum    1 weight  0.10000E+01 volume  0.19475E-02 ppm1      7.991 ppm2      4.381 CV     1
 ASSI {  329}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 179  and name HA  ))
      5.000     3.100     1.000 peak   329 spectrum    1 weight  0.10000E+01 volume  0.31061E-03 ppm1      7.993 ppm2      4.585 CV     1
 ASSI {  330}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 179  and name HB  ))
      4.700     2.800     1.300 peak   330 spectrum    1 weight  0.10000E+01 volume  0.60026E-03 ppm1      8.731 ppm2      4.715 CV     1
 ASSI {  331}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 179  and name HA  ))
      5.100     3.200     0.900 peak   331 spectrum    1 weight  0.10000E+01 volume  0.41161E-03 ppm1      8.734 ppm2      4.579 CV     1
 ASSI {  333}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 181  and name HA  ))
      3.500     1.500     1.500 peak   333 spectrum    1 weight  0.10000E+01 volume  0.92610E-03 ppm1      7.989 ppm2      3.979 CV     1
 ASSI {  334}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 180  and name HA  ))
      4.000     2.000     2.000 peak   334 spectrum    1 weight  0.10000E+01 volume  0.40778E-03 ppm1      7.990 ppm2      3.837 CV     1
 ASSI {  337}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 181  and name HD3 ))
      5.700     4.000     0.300 peak   337 spectrum    1 weight  0.10000E+01 volume  0.42494E-03 ppm1      8.729 ppm2      3.194 CV     1
 ASSI {  338}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 182  and name HG2 ))
      4.300     2.300     1.700 peak   338 spectrum    1 weight  0.10000E+01 volume  0.15473E-02 ppm1      7.990 ppm2      2.562 CV     1
 ASSI {  339}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 182  and name HB3 ))
      2.800     1.000     1.000 peak   339 spectrum    1 weight  0.10000E+01 volume  0.15587E-02 ppm1      7.990 ppm2      2.318 CV     1
 ASSI {  340}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 182  and name HG3 ))
      4.100     2.100     1.900 peak   340 spectrum    1 weight  0.10000E+01 volume  0.15569E-02 ppm1      7.990 ppm2      2.224 CV     1
 ASSI {  341}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 181  and name HB2 ))
      4.000     2.000     2.000 peak   341 spectrum    1 weight  0.10000E+01 volume  0.10271E-02 ppm1      7.994 ppm2      2.079 CV     1
 ASSI {  342}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 182  and name HB2 ))
      3.100     1.200     1.200 peak   342 spectrum    1 weight  0.10000E+01 volume  0.18274E-02 ppm1      7.991 ppm2      1.942 CV     1
 ASSI {  345}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 181  and name HG2 ))
      3.800     1.800     1.800 peak   345 spectrum    1 weight  0.10000E+01 volume  0.69935E-03 ppm1      7.993 ppm2      1.557 CV     1
 ASSI {  346}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name HG2 ))
      3.800     1.800     1.800 peak   346 spectrum    1 weight  0.10000E+01 volume  0.65552E-03 ppm1      8.755 ppm2      2.573 CV     1
 ASSI {  349}
   (( segid "    " and resid 181  and name H   ))
   (  segid "    " and resid 179  and name HG2%)
      3.600     1.600     1.600 peak   349 spectrum    1 weight  0.10000E+01 volume  0.13834E-02 ppm1      8.730 ppm2      1.174 CV     1
 ASSI {  350}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 181  and name HB2 ))
      3.000     1.100     1.100 peak   350 spectrum    1 weight  0.10000E+01 volume  0.13491E-02 ppm1      8.731 ppm2      2.080 CV     1
 ASSI {  351}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name HB3 ))
      2.800     1.000     1.000 peak   351 spectrum    1 weight  0.10000E+01 volume  0.11738E-02 ppm1      8.751 ppm2      2.021 CV     1
 ASSI {  352}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 180  and name HB2 ))
      3.000     1.100     1.100 peak   352 spectrum    1 weight  0.10000E+01 volume  0.11986E-02 ppm1      8.742 ppm2      1.933 CV     1
 ASSI {  353}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 112  and name HB3 ))
      3.000     1.100     1.100 peak   353 spectrum    1 weight  0.10000E+01 volume  0.32775E-02 ppm1      8.751 ppm2      1.775 CV     1
 ASSI {  357}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name HG3 ))
      5.000     3.100     1.000 peak   357 spectrum    1 weight  0.10000E+01 volume  0.44399E-03 ppm1      8.751 ppm2      2.236 CV     1
 ASSI {  359}
   (( segid "    " and resid 182  and name H   ))
   (  segid "    " and resid 185  and name HG1%)
      5.800     4.100     0.200 peak   359 spectrum    1 weight  0.10000E+01 volume  0.39636E-03 ppm1      7.983 ppm2      0.698 CV     1
 ASSI {  360}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name H   ))
      2.900     1.000     1.000 peak   360 spectrum    1 weight  0.10000E+01 volume  0.15035E-02 ppm1      8.751 ppm2      8.417 CV     1
 ASSI {  361}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 180  and name H   ))
      3.200     1.200     1.200 peak   361 spectrum    1 weight  0.10000E+01 volume  0.67077E-03 ppm1      8.729 ppm2      8.964 CV     1
 ASSI {  363}
   (( segid "    " and resid 180  and name H   ))
   (( segid "    " and resid 179  and name HB  ))
      4.200     2.200     1.800 peak   363 spectrum    1 weight  0.10000E+01 volume  0.66694E-03 ppm1      8.964 ppm2      4.725 CV     1
 ASSI {  366}
   (( segid "    " and resid 179  and name H   ))
   (( segid "    " and resid 179  and name HB  ))
      4.300     2.300     1.700 peak   366 spectrum    1 weight  0.10000E+01 volume  0.32586E-03 ppm1      9.361 ppm2      4.722 CV     1
 ASSI {  368}
   (( segid "    " and resid 180  and name H   ))
   (( segid "    " and resid 180  and name HA  ))
      3.400     1.400     1.400 peak   368 spectrum    1 weight  0.10000E+01 volume  0.75080E-03 ppm1      8.964 ppm2      3.832 CV     1
 ASSI {  370}
   (( segid "    " and resid 179  and name H   ))
   (( segid "    " and resid 182  and name HB3 ))
      4.600     2.600     1.400 peak   370 spectrum    1 weight  0.10000E+01 volume  0.39445E-03 ppm1      9.363 ppm2      2.323 CV     1
 ASSI {  372}
   (( segid "    " and resid 179  and name H   ))
   (( segid "    " and resid 178  and name HB3 ))
      4.000     2.000     2.000 peak   372 spectrum    1 weight  0.10000E+01 volume  0.61931E-03 ppm1      9.359 ppm2      2.001 CV     1
 ASSI {  373}
   (( segid "    " and resid 179  and name H   ))
   (( segid "    " and resid 178  and name HG2 ))
      4.300     2.300     1.700 peak   373 spectrum    1 weight  0.10000E+01 volume  0.38302E-03 ppm1      9.359 ppm2      1.626 CV     1
 ASSI {  374}
   (( segid "    " and resid 179  and name H   ))
   (( segid "    " and resid 178  and name HG3 ))
      3.400     1.400     1.400 peak   374 spectrum    1 weight  0.10000E+01 volume  0.56215E-03 ppm1      9.358 ppm2      1.517 CV     1
 ASSI {  375}
   (( segid "    " and resid 180  and name H   ))
   (( segid "    " and resid 180  and name HG  ))
      2.500     0.800     0.800 peak   375 spectrum    1 weight  0.10000E+01 volume  0.12138E-02 ppm1      8.963 ppm2      1.689 CV     1
 ASSI {  376}
   (( segid "    " and resid 180  and name H   ))
   (( segid "    " and resid 180  and name HB2 ))
      3.400     1.400     1.400 peak   376 spectrum    1 weight  0.10000E+01 volume  0.81177E-03 ppm1      8.963 ppm2      1.933 CV     1
 ASSI {  379}
   (( segid "    " and resid 180  and name H   ))
   (  segid "    " and resid 180  and name HD1%)
      4.400     2.400     1.600 peak   379 spectrum    1 weight  0.10000E+01 volume  0.11128E-02 ppm1      8.965 ppm2      0.742 CV     1
 ASSI {  382}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 177  and name H   ))
      2.600     0.900     0.900 peak   382 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      7.020 ppm2      8.775 CV     1
 ASSI {  384}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 176  and name H   ))
      5.000     3.200     1.000 peak   384 spectrum    1 weight  0.10000E+01 volume  0.34111E-03 ppm1      7.023 ppm2      9.305 CV     1
 ASSI {  385}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 176  and name H   ))
      3.400     1.400     1.400 peak   385 spectrum    1 weight  0.10000E+01 volume  0.10023E-02 ppm1      8.774 ppm2      9.295 CV     1
 ASSI {  386}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 108  and name H   ))
      4.300     2.300     1.700 peak   386 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      7.021 ppm2      7.902 CV     1
 ASSI {  388}
   (( segid "    " and resid 179  and name H   ))
   (( segid "    " and resid 182  and name H   ))
      5.700     4.100     0.300 peak   388 spectrum    1 weight  0.10000E+01 volume  0.25153E-03 ppm1      9.363 ppm2      7.986 CV     1
 ASSI {  389}
   (( segid "    " and resid 179  and name H   ))
   (( segid "    " and resid 178  and name H   ))
      4.700     2.700     1.300 peak   389 spectrum    1 weight  0.10000E+01 volume  0.31441E-03 ppm1      9.352 ppm2      7.025 CV     1
 ASSI {  390}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 183  and name HE21))
      4.400     2.500     1.600 peak   390 spectrum    1 weight  0.10000E+01 volume  0.26869E-03 ppm1      7.027 ppm2      6.515 CV     1
 ASSI {  391}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 177  and name HA3 ))
      3.800     1.800     1.800 peak   391 spectrum    1 weight  0.10000E+01 volume  0.10995E-02 ppm1      7.021 ppm2      4.383 CV     1
 ASSI {  392}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 176  and name HA  ))
      4.300     2.300     1.700 peak   392 spectrum    1 weight  0.10000E+01 volume  0.50878E-03 ppm1      7.021 ppm2      4.253 CV     1
 ASSI {  393}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 175  and name HA  ))
      2.900     2.900     3.100 peak   393 spectrum    1 weight  0.10000E+01 volume  0.41352E-03 ppm1      7.019 ppm2      4.623 CV     1
 ASSI {  395}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 175  and name HA  ))
      3.800     1.800     1.800 peak   395 spectrum    1 weight  0.10000E+01 volume  0.99089E-03 ppm1      8.776 ppm2      4.626 CV     1
 ASSI {  396}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 177  and name HA3 ))
      2.900     1.000     1.000 peak   396 spectrum    1 weight  0.10000E+01 volume  0.26143E-02 ppm1      8.775 ppm2      4.378 CV     1
 ASSI {  397}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 176  and name HA  ))
      3.200     1.300     1.300 peak   397 spectrum    1 weight  0.10000E+01 volume  0.62885E-03 ppm1      8.774 ppm2      4.254 CV     1
 ASSI {  398}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 177  and name HA2 ))
      3.000     1.100     1.100 peak   398 spectrum    1 weight  0.10000E+01 volume  0.30795E-02 ppm1      8.774 ppm2      3.704 CV     1
 ASSI {  399}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 176  and name HB3 ))
      4.100     2.100     1.900 peak   399 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      8.772 ppm2      3.514 CV     1
 ASSI {  401}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 176  and name HB2 ))
      3.800     1.800     1.800 peak   401 spectrum    1 weight  0.10000E+01 volume  0.71648E-03 ppm1      8.775 ppm2      3.024 CV     1
 ASSI {  403}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 175  and name HB2 ))
      2.600     2.600     3.400 peak   403 spectrum    1 weight  0.10000E+01 volume  0.78701E-03 ppm1      7.019 ppm2      2.593 CV     1
 OR {  403}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 175  and name HB3 ))
 ASSI {  404}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 175  and name HB2 ))
      4.100     2.100     1.900 peak   404 spectrum    1 weight  0.10000E+01 volume  0.39827E-03 ppm1      8.778 ppm2      2.601 CV     1
 OR {  404}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 175  and name HB3 ))
 ASSI {  405}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 108  and name HB  ))
      5.100     3.300     0.900 peak   405 spectrum    1 weight  0.10000E+01 volume  0.30108E-03 ppm1      8.775 ppm2      2.335 CV     1
 ASSI {  406}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 108  and name HB  ))
      5.400     3.600     0.600 peak   406 spectrum    1 weight  0.10000E+01 volume  0.36778E-03 ppm1      7.019 ppm2      2.325 CV     1
 ASSI {  407}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 178  and name HB3 ))
      3.300     1.400     1.400 peak   407 spectrum    1 weight  0.10000E+01 volume  0.81748E-03 ppm1      7.021 ppm2      2.002 CV     1
 ASSI {  408}
   (( segid "    " and resid 177  and name H   ))
   (( segid "    " and resid 178  and name HG3 ))
      5.900     4.300     0.100 peak   408 spectrum    1 weight  0.10000E+01 volume  0.33919E-03 ppm1      8.772 ppm2      1.508 CV     1
 ASSI {  409}
   (( segid "    " and resid 177  and name H   ))
   (  segid "    " and resid 107  and name HG2%)
      4.600     2.700     1.400 peak   409 spectrum    1 weight  0.10000E+01 volume  0.47831E-03 ppm1      8.776 ppm2      1.203 CV     1
 ASSI {  411}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 178  and name HG2 ))
      4.000     2.000     2.000 peak   411 spectrum    1 weight  0.10000E+01 volume  0.89560E-03 ppm1      7.018 ppm2      1.625 CV     1
 ASSI {  412}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 178  and name HG3 ))
      3.700     1.800     1.800 peak   412 spectrum    1 weight  0.10000E+01 volume  0.14825E-02 ppm1      7.021 ppm2      1.516 CV     1
 ASSI {  417}
   (( segid "    " and resid 175  and name H   ))
   (( segid "    " and resid 183  and name HE22))
      4.800     2.900     1.200 peak   417 spectrum    1 weight  0.10000E+01 volume  0.53356E-03 ppm1      9.118 ppm2      7.271 CV     1
 ASSI {  418}
   (( segid "    " and resid 175  and name H   ))
   (( segid "    " and resid 183  and name HE21))
      5.400     3.600     0.600 peak   418 spectrum    1 weight  0.10000E+01 volume  0.28394E-03 ppm1      9.120 ppm2      6.512 CV     1
 ASSI {  419}
   (( segid "    " and resid 176  and name H   ))
   (( segid "    " and resid 176  and name HA  ))
      3.700     1.700     1.700 peak   419 spectrum    1 weight  0.10000E+01 volume  0.38111E-03 ppm1      9.290 ppm2      4.252 CV     1
 ASSI {  425}
   (( segid "    " and resid 176  and name H   ))
   (( segid "    " and resid 175  and name HB2 ))
      4.700     2.800     1.300 peak   425 spectrum    1 weight  0.10000E+01 volume  0.37158E-03 ppm1      9.288 ppm2      2.589 CV     1
 OR {  425}
   (( segid "    " and resid 176  and name H   ))
   (( segid "    " and resid 175  and name HB3 ))
 ASSI {  427}
   (( segid "    " and resid 175  and name H   ))
   (( segid "    " and resid 174  and name HB3 ))
      3.900     1.900     1.900 peak   427 spectrum    1 weight  0.10000E+01 volume  0.89560E-03 ppm1      9.119 ppm2      1.631 CV     1
 ASSI {  430}
   (( segid "    " and resid 175  and name H   ))
   (  segid "    " and resid 174  and name HD2%)
      4.400     2.400     1.600 peak   430 spectrum    1 weight  0.10000E+01 volume  0.17264E-02 ppm1      9.120 ppm2      0.673 CV     1
 OR {  430}
   (( segid "    " and resid 175  and name H   ))
   (  segid "    " and resid 174  and name HD1%)
 ASSI {  431}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 130  and name H   ))
      4.700     2.800     1.300 peak   431 spectrum    1 weight  0.10000E+01 volume  0.25725E-03 ppm1      8.427 ppm2      8.798 CV     1
 ASSI {  432}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 175  and name H   ))
      5.100     3.200     0.900 peak   432 spectrum    1 weight  0.10000E+01 volume  0.36778E-03 ppm1      8.424 ppm2      9.120 CV     1
 ASSI {  434}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 172  and name H   ))
      3.500     1.500     1.500 peak   434 spectrum    1 weight  0.10000E+01 volume  0.16521E-02 ppm1      7.716 ppm2      8.337 CV     1
 ASSI {  435}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 173  and name H   ))
      4.300     2.300     1.700 peak   435 spectrum    1 weight  0.10000E+01 volume  0.46686E-03 ppm1      8.426 ppm2      7.715 CV     1
 ASSI {  436}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 173  and name HE3 ))
      2.800     2.800     3.200 peak   436 spectrum    1 weight  0.10000E+01 volume  0.53547E-03 ppm1      8.419 ppm2      7.559 CV     1
 ASSI {  437}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 173  and name HE3 ))
      5.900     4.400     0.100 peak   437 spectrum    1 weight  0.10000E+01 volume  0.62311E-03 ppm1      7.717 ppm2      7.562 CV     1
 ASSI {  438}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 173  and name HD1 ))
      3.000     3.000     3.000 peak   438 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      8.426 ppm2      7.261 CV     1
 ASSI {  441}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 173  and name HA  ))
      2.900     1.000     1.000 peak   441 spectrum    1 weight  0.10000E+01 volume  0.19170E-02 ppm1      7.717 ppm2      4.651 CV     1
 ASSI {  442}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 173  and name HA  ))
      2.500     0.800     0.800 peak   442 spectrum    1 weight  0.10000E+01 volume  0.20447E-02 ppm1      8.422 ppm2      4.649 CV     1
 ASSI {  443}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 130  and name HA  ))
      4.800     2.900     1.200 peak   443 spectrum    1 weight  0.10000E+01 volume  0.48211E-03 ppm1      7.720 ppm2      4.404 CV     1
 ASSI {  444}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 171  and name HA  ))
      4.500     2.500     1.500 peak   444 spectrum    1 weight  0.10000E+01 volume  0.98900E-03 ppm1      7.717 ppm2      4.170 CV     1
 ASSI {  445}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 130  and name HA  ))
      3.000     1.100     1.100 peak   445 spectrum    1 weight  0.10000E+01 volume  0.75269E-03 ppm1      8.420 ppm2      4.401 CV     1
 ASSI {  448}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 173  and name HB3 ))
      3.900     1.900     1.900 peak   448 spectrum    1 weight  0.10000E+01 volume  0.24963E-02 ppm1      7.716 ppm2      3.537 CV     1
 ASSI {  449}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 173  and name HB2 ))
      4.600     2.700     1.400 peak   449 spectrum    1 weight  0.10000E+01 volume  0.62693E-03 ppm1      8.423 ppm2      2.998 CV     1
 ASSI {  450}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 173  and name HB2 ))
      2.500     0.800     0.800 peak   450 spectrum    1 weight  0.10000E+01 volume  0.33558E-02 ppm1      7.717 ppm2      3.002 CV     1
 ASSI {  453}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 174  and name HB3 ))
      3.500     1.500     1.500 peak   453 spectrum    1 weight  0.10000E+01 volume  0.17017E-02 ppm1      8.423 ppm2      1.620 CV     1
 ASSI {  454}
   (( segid "    " and resid 174  and name H   ))
   (( segid "    " and resid 174  and name HB2 ))
      3.100     1.200     1.200 peak   454 spectrum    1 weight  0.10000E+01 volume  0.83844E-03 ppm1      8.424 ppm2      1.249 CV     1
 ASSI {  455}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 130  and name HB  ))
      5.000     3.100     1.000 peak   455 spectrum    1 weight  0.10000E+01 volume  0.50498E-03 ppm1      7.716 ppm2      1.631 CV     1
 ASSI {  456}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 171  and name HB2 ))
      4.300     2.300     1.700 peak   456 spectrum    1 weight  0.10000E+01 volume  0.54881E-03 ppm1      7.718 ppm2      1.363 CV     1
 ASSI {  457}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 171  and name HB3 ))
      5.200     3.400     0.800 peak   457 spectrum    1 weight  0.10000E+01 volume  0.48020E-03 ppm1      7.718 ppm2      0.888 CV     1
 ASSI {  461}
   (( segid "    " and resid 174  and name H   ))
   (  segid "    " and resid 174  and name HD2%)
      3.100     1.200     1.200 peak   461 spectrum    1 weight  0.10000E+01 volume  0.18846E-02 ppm1      8.423 ppm2      0.671 CV     1
 ASSI {  462}
   (( segid "    " and resid 174  and name H   ))
   (  segid "    " and resid 130  and name HG2%)
      4.900     3.100     1.100 peak   462 spectrum    1 weight  0.10000E+01 volume  0.62311E-03 ppm1      8.425 ppm2      0.485 CV     1
 ASSI {  464}
   (( segid "    " and resid 174  and name H   ))
   (  segid "    " and resid 130  and name HG1%)
      2.900     2.900     3.100 peak   464 spectrum    1 weight  0.10000E+01 volume  0.44970E-03 ppm1      8.418 ppm2      0.222 CV     1
 ASSI {  468}
   (( segid "    " and resid 172  and name H   ))
   (( segid "    " and resid 173  and name HD1 ))
      4.700     2.700     1.300 peak   468 spectrum    1 weight  0.10000E+01 volume  0.29154E-03 ppm1      8.334 ppm2      7.269 CV     1
 ASSI {  469}
   (( segid "    " and resid 172  and name H   ))
   (( segid "    " and resid 172  and name HD22))
      4.100     2.100     1.900 peak   469 spectrum    1 weight  0.10000E+01 volume  0.48211E-03 ppm1      8.335 ppm2      6.987 CV     1
 ASSI {  472}
   (( segid "    " and resid 201  and name H   ))
   (( segid "    " and resid 201  and name HA  ))
      2.400     0.700     0.700 peak   472 spectrum    1 weight  0.10000E+01 volume  0.79861E-02 ppm1      8.173 ppm2      4.579 CV     1
 ASSI {  476}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 132  and name HA  ))
      2.200     0.600     0.600 peak   476 spectrum    1 weight  0.10000E+01 volume  0.71116E-02 ppm1      8.207 ppm2      4.124 CV     1
 ASSI {  477}
   (( segid "    " and resid 201  and name H   ))
   (( segid "    " and resid 200  and name HB2 ))
      3.400     1.400     1.400 peak   477 spectrum    1 weight  0.10000E+01 volume  0.47619E-02 ppm1      8.173 ppm2      3.815 CV     1
 ASSI {  479}
   (( segid "    " and resid 172  and name H   ))
   (( segid "    " and resid 172  and name HB3 ))
      3.400     1.500     1.500 peak   479 spectrum    1 weight  0.10000E+01 volume  0.33824E-02 ppm1      8.334 ppm2      2.628 CV     1
 ASSI {  481}
   (( segid "    " and resid 201  and name H   ))
   (( segid "    " and resid 201  and name HB3 ))
      2.600     0.900     0.900 peak   481 spectrum    1 weight  0.10000E+01 volume  0.54708E-02 ppm1      8.173 ppm2      2.661 CV     1
 ASSI {  482}
   (( segid "    " and resid 201  and name H   ))
   (( segid "    " and resid 201  and name HB2 ))
      2.500     0.800     0.800 peak   482 spectrum    1 weight  0.10000E+01 volume  0.83939E-02 ppm1      8.173 ppm2      2.607 CV     1
 ASSI {  484}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 170  and name HG2 ))
      3.800     1.800     1.800 peak   484 spectrum    1 weight  0.10000E+01 volume  0.19989E-02 ppm1      8.189 ppm2      2.125 CV     1
 ASSI {  486}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 170  and name HB3 ))
      2.300     0.600     0.600 peak   486 spectrum    1 weight  0.10000E+01 volume  0.41140E-02 ppm1      8.192 ppm2      1.946 CV     1
 ASSI {  489}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 170  and name HB2 ))
      3.300     1.400     1.400 peak   489 spectrum    1 weight  0.10000E+01 volume  0.27497E-02 ppm1      8.186 ppm2      1.797 CV     1
 ASSI {  490}
   (( segid "    " and resid 172  and name H   ))
   (( segid "    " and resid 170  and name HB3 ))
      3.700     1.700     1.700 peak   490 spectrum    1 weight  0.10000E+01 volume  0.44590E-03 ppm1      8.331 ppm2      1.950 CV     1
 ASSI {  491}
   (( segid "    " and resid 172  and name H   ))
   (( segid "    " and resid 171  and name HB2 ))
      2.900     1.000     1.000 peak   491 spectrum    1 weight  0.10000E+01 volume  0.13263E-02 ppm1      8.334 ppm2      1.370 CV     1
 ASSI {  493}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 171  and name HG  ))
      5.600     4.000     0.400 peak   493 spectrum    1 weight  0.10000E+01 volume  0.42874E-03 ppm1      7.718 ppm2      1.435 CV     1
 ASSI {  494}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 171  and name HG  ))
      2.000     0.500     0.500 peak   494 spectrum    1 weight  0.10000E+01 volume  0.68733E-02 ppm1      8.187 ppm2      1.431 CV     1
 ASSI {  495}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 171  and name HB2 ))
      2.300     0.700     0.700 peak   495 spectrum    1 weight  0.10000E+01 volume  0.52651E-02 ppm1      8.186 ppm2      1.367 CV     1
 ASSI {  496}
   (( segid "    " and resid 172  and name H   ))
   (( segid "    " and resid 171  and name HB3 ))
      3.700     1.800     1.800 peak   496 spectrum    1 weight  0.10000E+01 volume  0.15645E-02 ppm1      8.335 ppm2      0.871 CV     1
 ASSI {  497}
   (( segid "    " and resid 172  and name H   ))
   (  segid "    " and resid 171  and name HD1%)
      4.900     3.000     1.100 peak   497 spectrum    1 weight  0.10000E+01 volume  0.11643E-02 ppm1      8.332 ppm2      0.698 CV     1
 ASSI {  500}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 171  and name HB3 ))
      3.200     1.300     1.300 peak   500 spectrum    1 weight  0.10000E+01 volume  0.37253E-02 ppm1      8.187 ppm2      0.872 CV     1
 ASSI {  501}
   (( segid "    " and resid 133  and name H   ))
   (  segid "    " and resid 133  and name HD2%)
      3.300     1.400     1.400 peak   501 spectrum    1 weight  0.10000E+01 volume  0.26487E-02 ppm1      8.208 ppm2      0.800 CV     1
 OR {  501}
   (( segid "    " and resid 133  and name H   ))
   (  segid "    " and resid 133  and name HD1%)
 ASSI {  504}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 169  and name H   ))
      2.400     0.700     0.700 peak   504 spectrum    1 weight  0.10000E+01 volume  0.52364E-02 ppm1      7.909 ppm2      8.326 CV     1
 ASSI {  505}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 171  and name H   ))
      3.400     1.400     1.400 peak   505 spectrum    1 weight  0.10000E+01 volume  0.26278E-02 ppm1      7.911 ppm2      8.189 CV     1
 ASSI {  507}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 138  and name H   ))
      2.700     0.900     0.900 peak   507 spectrum    1 weight  0.10000E+01 volume  0.42551E-02 ppm1      8.323 ppm2      8.083 CV     1
 ASSI {  508}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 169  and name HA  ))
      2.200     0.600     0.600 peak   508 spectrum    1 weight  0.10000E+01 volume  0.89447E-02 ppm1      7.910 ppm2      4.462 CV     1
 ASSI {  509}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 170  and name HA  ))
      2.400     0.700     0.700 peak   509 spectrum    1 weight  0.10000E+01 volume  0.74623E-02 ppm1      7.910 ppm2      4.204 CV     1
 ASSI {  510}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 169  and name HA  ))
      1.900     0.400     0.400 peak   510 spectrum    1 weight  0.10000E+01 volume  0.11776E-01 ppm1      8.323 ppm2      4.463 CV     1
 ASSI {  512}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 169  and name HB2 ))
      2.400     0.700     0.700 peak   512 spectrum    1 weight  0.10000E+01 volume  0.67190E-02 ppm1      8.322 ppm2      2.608 CV     1
 ASSI {  513}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 169  and name HB3 ))
      2.700     0.900     0.900 peak   513 spectrum    1 weight  0.10000E+01 volume  0.58690E-02 ppm1      8.322 ppm2      2.649 CV     1
 ASSI {  514}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 169  and name HB2 ))
      4.000     2.000     2.000 peak   514 spectrum    1 weight  0.10000E+01 volume  0.25744E-02 ppm1      7.909 ppm2      2.611 CV     1
 ASSI {  515}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 169  and name HB3 ))
      3.800     1.800     1.800 peak   515 spectrum    1 weight  0.10000E+01 volume  0.24582E-02 ppm1      7.910 ppm2      2.652 CV     1
 ASSI {  517}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 170  and name HB3 ))
      3.100     1.200     1.200 peak   517 spectrum    1 weight  0.10000E+01 volume  0.44381E-02 ppm1      7.910 ppm2      1.937 CV     1
 ASSI {  518}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 170  and name HB2 ))
      2.300     0.700     0.700 peak   518 spectrum    1 weight  0.10000E+01 volume  0.72641E-02 ppm1      7.909 ppm2      1.797 CV     1
 ASSI {  519}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 138  and name HB2 ))
      4.500     2.500     1.500 peak   519 spectrum    1 weight  0.10000E+01 volume  0.11490E-02 ppm1      7.907 ppm2      1.692 CV     1
 ASSI {  520}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 135  and name HG2 ))
      4.700     2.700     1.300 peak   520 spectrum    1 weight  0.10000E+01 volume  0.91467E-03 ppm1      8.322 ppm2      2.132 CV     1
 ASSI {  521}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 138  and name HB2 ))
      2.800     1.000     1.000 peak   521 spectrum    1 weight  0.10000E+01 volume  0.36530E-02 ppm1      8.322 ppm2      1.696 CV     1
 ASSI {  523}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 138  and name HD2 ))
      4.300     2.300     1.700 peak   523 spectrum    1 weight  0.10000E+01 volume  0.64789E-03 ppm1      7.912 ppm2      1.577 CV     1
 OR {  523}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 138  and name HD3 ))
 ASSI {  524}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 138  and name HG3 ))
      3.800     1.800     1.800 peak   524 spectrum    1 weight  0.10000E+01 volume  0.10519E-02 ppm1      7.909 ppm2      1.333 CV     1
 OR {  524}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 138  and name HG2 ))
 ASSI {  525}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 138  and name HG3 ))
      3.500     1.500     1.500 peak   525 spectrum    1 weight  0.10000E+01 volume  0.29079E-02 ppm1      8.322 ppm2      1.327 CV     1
 OR {  525}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 138  and name HG2 ))
 ASSI {  527}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 10   and name H   ))
      3.300     1.400     1.400 peak   527 spectrum    1 weight  0.10000E+01 volume  0.14520E-02 ppm1      8.077 ppm2      8.887 CV     1
 ASSI {  528}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 12   and name H   ))
      2.500     0.800     0.800 peak   528 spectrum    1 weight  0.10000E+01 volume  0.30888E-02 ppm1      8.078 ppm2      8.762 CV     1
 ASSI {  529}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 11   and name H   ))
      4.700     2.800     1.300 peak   529 spectrum    1 weight  0.10000E+01 volume  0.60406E-03 ppm1      8.072 ppm2      9.098 CV     1
 ASSI {  530}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 136  and name H   ))
      2.400     0.700     0.700 peak   530 spectrum    1 weight  0.10000E+01 volume  0.51984E-02 ppm1      8.133 ppm2      8.383 CV     1
 ASSI {  531}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 33   and name H   ))
      3.500     1.500     1.500 peak   531 spectrum    1 weight  0.10000E+01 volume  0.74318E-03 ppm1      8.087 ppm2      7.453 CV     1
 ASSI {  533}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 169  and name HA  ))
      4.900     3.100     1.100 peak   533 spectrum    1 weight  0.10000E+01 volume  0.88418E-03 ppm1      8.084 ppm2      4.462 CV     1
 ASSI {  535}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 11   and name HA2 ))
      5.100     3.200     0.900 peak   535 spectrum    1 weight  0.10000E+01 volume  0.12424E-02 ppm1      8.076 ppm2      3.960 CV     1
 ASSI {  536}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 11   and name HA3 ))
      4.100     2.100     1.900 peak   536 spectrum    1 weight  0.10000E+01 volume  0.11833E-02 ppm1      8.075 ppm2      3.671 CV     1
 ASSI {  537}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 169  and name HB3 ))
      4.600     2.600     1.400 peak   537 spectrum    1 weight  0.10000E+01 volume  0.53165E-03 ppm1      8.083 ppm2      2.641 CV     1
 ASSI {  538}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 169  and name HB2 ))
      4.300     2.300     1.700 peak   538 spectrum    1 weight  0.10000E+01 volume  0.53547E-03 ppm1      8.081 ppm2      2.605 CV     1
 ASSI {  539}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 12   and name HB2 ))
      3.800     1.800     1.800 peak   539 spectrum    1 weight  0.10000E+01 volume  0.16426E-02 ppm1      8.078 ppm2      2.848 CV     1
 ASSI {  540}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HE3 ))
      4.800     2.900     1.200 peak   540 spectrum    1 weight  0.10000E+01 volume  0.80223E-03 ppm1      8.132 ppm2      2.903 CV     1
 OR {  540}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HE2 ))
 ASSI {  541}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 13   and name HB  ))
      2.400     0.700     0.700 peak   541 spectrum    1 weight  0.10000E+01 volume  0.79215E-02 ppm1      8.078 ppm2      2.179 CV     1
 ASSI {  543}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 135  and name HB2 ))
      3.400     1.400     1.400 peak   543 spectrum    1 weight  0.10000E+01 volume  0.10061E-02 ppm1      8.080 ppm2      1.902 CV     1
 ASSI {  545}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 137  and name HB2 ))
      1.800     0.400     0.400 peak   545 spectrum    1 weight  0.10000E+01 volume  0.10852E-01 ppm1      8.083 ppm2      1.695 CV     1
 ASSI {  546}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HD3 ))
      3.700     1.700     1.700 peak   546 spectrum    1 weight  0.10000E+01 volume  0.23496E-02 ppm1      8.082 ppm2      1.591 CV     1
 OR {  546}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HD2 ))
 ASSI {  547}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 135  and name HB3 ))
      2.400     0.700     0.700 peak   547 spectrum    1 weight  0.10000E+01 volume  0.39732E-02 ppm1      8.134 ppm2      1.987 CV     1
 ASSI {  548}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HB3 ))
      3.200     1.300     1.300 peak   548 spectrum    1 weight  0.10000E+01 volume  0.53374E-02 ppm1      8.133 ppm2      1.809 CV     1
 ASSI {  549}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HB2 ))
      2.200     0.600     0.600 peak   549 spectrum    1 weight  0.10000E+01 volume  0.71839E-02 ppm1      8.133 ppm2      1.689 CV     1
 ASSI {  550}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HD2 ))
      4.100     2.100     1.900 peak   550 spectrum    1 weight  0.10000E+01 volume  0.14863E-02 ppm1      8.134 ppm2      1.594 CV     1
 OR {  550}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HD3 ))
 ASSI {  551}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HG3 ))
      2.300     0.700     0.700 peak   551 spectrum    1 weight  0.10000E+01 volume  0.47182E-02 ppm1      8.133 ppm2      1.338 CV     1
 ASSI {  555}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 135  and name H   ))
      3.200     1.300     1.300 peak   555 spectrum    1 weight  0.10000E+01 volume  0.37331E-02 ppm1      8.381 ppm2      8.270 CV     1
 ASSI {  559}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 133  and name HA  ))
      4.700     2.700     1.300 peak   559 spectrum    1 weight  0.10000E+01 volume  0.10747E-02 ppm1      8.268 ppm2      4.302 CV     1
 ASSI {  561}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 134  and name HA  ))
      3.600     3.600     2.400 peak   561 spectrum    1 weight  0.10000E+01 volume  0.13510E-02 ppm1      8.381 ppm2      4.431 CV     1
 ASSI {  562}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 135  and name HA  ))
      1.700     0.400     0.500 peak   562 spectrum    1 weight  0.10000E+01 volume  0.27195E-01 ppm1      8.382 ppm2      4.130 CV     1
 ASSI {  564}
   (( segid "    " and resid 136  and name H   ))
   (  segid "    " and resid 134  and name HE% )
      2.300     2.300     3.700 peak   564 spectrum    1 weight  0.10000E+01 volume  0.11978E-01 ppm1      8.382 ppm2      1.985 CV     1
 ASSI {  565}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 136  and name HB3 ))
      2.000     0.500     0.500 peak   565 spectrum    1 weight  0.10000E+01 volume  0.13341E-01 ppm1      8.382 ppm2      1.897 CV     1
 ASSI {  567}
   (( segid "    " and resid 135  and name H   ))
   (  segid "    " and resid 134  and name HE% )
      3.000     1.100     1.100 peak   567 spectrum    1 weight  0.10000E+01 volume  0.61151E-02 ppm1      8.267 ppm2      1.984 CV     1
 ASSI {  568}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 135  and name HB2 ))
      1.800     0.400     0.400 peak   568 spectrum    1 weight  0.10000E+01 volume  0.94230E-02 ppm1      8.268 ppm2      1.902 CV     1
 ASSI {  569}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name HG3 ))
      4.000     2.000     2.000 peak   569 spectrum    1 weight  0.10000E+01 volume  0.10061E-02 ppm1      8.268 ppm2      2.541 CV     1
 ASSI {  570}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name HG2 ))
      5.300     3.500     0.700 peak   570 spectrum    1 weight  0.10000E+01 volume  0.99660E-03 ppm1      8.268 ppm2      2.416 CV     1
 ASSI {  571}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 133  and name HB2 ))
      2.800     1.000     1.000 peak   571 spectrum    1 weight  0.10000E+01 volume  0.78318E-03 ppm1      8.265 ppm2      1.576 CV     1
 ASSI {  572}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 133  and name HB3 ))
      4.100     2.100     1.900 peak   572 spectrum    1 weight  0.10000E+01 volume  0.11548E-02 ppm1      8.267 ppm2      1.486 CV     1
 OR {  572}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 133  and name HG  ))
 ASSI {  573}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 137  and name HD2 ))
      5.300     3.400     0.700 peak   573 spectrum    1 weight  0.10000E+01 volume  0.63265E-03 ppm1      8.383 ppm2      1.593 CV     1
 OR {  573}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 137  and name HD3 ))
 ASSI {  574}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 137  and name HG3 ))
      4.300     2.300     1.700 peak   574 spectrum    1 weight  0.10000E+01 volume  0.83844E-03 ppm1      8.379 ppm2      1.340 CV     1
 ASSI {  575}
   (( segid "    " and resid 135  and name H   ))
   (  segid "    " and resid 133  and name HD1%)
      4.200     2.200     1.800 peak   575 spectrum    1 weight  0.10000E+01 volume  0.74127E-03 ppm1      8.267 ppm2      0.806 CV     1
 ASSI {  576}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 132  and name H   ))
      3.900     1.900     1.900 peak   576 spectrum    1 weight  0.10000E+01 volume  0.16083E-02 ppm1      8.207 ppm2      8.666 CV     1
 ASSI {  577}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 135  and name HA  ))
      3.700     1.700     1.700 peak   577 spectrum    1 weight  0.10000E+01 volume  0.11529E-02 ppm1      8.189 ppm2      4.129 CV     1
 ASSI {  579}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 133  and name HA  ))
      2.200     0.600     0.600 peak   579 spectrum    1 weight  0.10000E+01 volume  0.10195E-01 ppm1      8.188 ppm2      4.303 CV     1
 ASSI {  580}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 133  and name HA  ))
      2.500     0.800     0.800 peak   580 spectrum    1 weight  0.10000E+01 volume  0.43942E-02 ppm1      8.208 ppm2      4.305 CV     1
 ASSI {  583}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 133  and name HB2 ))
      2.200     0.600     0.600 peak   583 spectrum    1 weight  0.10000E+01 volume  0.21476E-02 ppm1      8.187 ppm2      1.572 CV     1
 ASSI {  584}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 133  and name HB2 ))
      2.500     0.800     0.800 peak   584 spectrum    1 weight  0.10000E+01 volume  0.48020E-02 ppm1      8.207 ppm2      1.569 CV     1
 ASSI {  585}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 133  and name HG  ))
      2.000     0.500     0.500 peak   585 spectrum    1 weight  0.10000E+01 volume  0.68485E-02 ppm1      8.208 ppm2      1.495 CV     1
 ASSI {  592}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 130  and name HA  ))
      2.300     0.700     0.700 peak   592 spectrum    1 weight  0.10000E+01 volume  0.25916E-02 ppm1      8.413 ppm2      4.401 CV     1
 ASSI {  595}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 87   and name HA  ))
      4.400     2.400     1.600 peak   595 spectrum    1 weight  0.10000E+01 volume  0.41732E-03 ppm1      8.325 ppm2      4.639 CV     1
 ASSI {  598}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 131  and name HD3 ))
      4.600     2.700     1.400 peak   598 spectrum    1 weight  0.10000E+01 volume  0.43828E-03 ppm1      8.418 ppm2      3.053 CV     1
 ASSI {  602}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 132  and name HB3 ))
      3.900     1.900     1.900 peak   602 spectrum    1 weight  0.10000E+01 volume  0.19056E-02 ppm1      8.665 ppm2      1.838 CV     1
 ASSI {  603}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 172  and name HB2 ))
      3.100     1.200     1.200 peak   603 spectrum    1 weight  0.10000E+01 volume  0.59264E-03 ppm1      8.411 ppm2      2.824 CV     1
 ASSI {  604}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 25   and name HB  ))
      4.300     2.300     1.700 peak   604 spectrum    1 weight  0.10000E+01 volume  0.56786E-03 ppm1      8.423 ppm2      2.755 CV     1
 ASSI {  605}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 172  and name HB3 ))
      4.600     2.600     1.400 peak   605 spectrum    1 weight  0.10000E+01 volume  0.42494E-03 ppm1      8.420 ppm2      2.624 CV     1
 ASSI {  606}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 63   and name HG2 ))
      5.100     3.300     0.900 peak   606 spectrum    1 weight  0.10000E+01 volume  0.68410E-03 ppm1      8.423 ppm2      2.400 CV     1
 ASSI {  607}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 63   and name HG3 ))
      3.800     1.800     1.800 peak   607 spectrum    1 weight  0.10000E+01 volume  0.12100E-02 ppm1      8.422 ppm2      2.282 CV     1
 ASSI {  608}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 63   and name HB3 ))
      4.300     2.400     1.700 peak   608 spectrum    1 weight  0.10000E+01 volume  0.14902E-02 ppm1      8.422 ppm2      2.050 CV     1
 ASSI {  609}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 131  and name HB2 ))
      2.900     1.000     1.000 peak   609 spectrum    1 weight  0.10000E+01 volume  0.95659E-03 ppm1      8.409 ppm2      1.985 CV     1
 ASSI {  610}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 63   and name HB2 ))
      3.200     1.300     1.300 peak   610 spectrum    1 weight  0.10000E+01 volume  0.95088E-03 ppm1      8.421 ppm2      1.922 CV     1
 ASSI {  611}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 191  and name HG  ))
      4.800     2.900     1.200 peak   611 spectrum    1 weight  0.10000E+01 volume  0.82130E-03 ppm1      8.663 ppm2      1.641 CV     1
 ASSI {  612}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 131  and name HB3 ))
      3.700     1.800     1.800 peak   612 spectrum    1 weight  0.10000E+01 volume  0.96422E-03 ppm1      8.665 ppm2      1.524 CV     1
 ASSI {  613}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 192  and name HG  ))
      3.800     1.800     1.800 peak   613 spectrum    1 weight  0.10000E+01 volume  0.44970E-03 ppm1      8.667 ppm2      1.390 CV     1
 ASSI {  614}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 130  and name HB  ))
      4.000     2.000     2.000 peak   614 spectrum    1 weight  0.10000E+01 volume  0.18065E-02 ppm1      8.413 ppm2      1.644 CV     1
 ASSI {  616}
   (( segid "    " and resid 64   and name H   ))
   (  segid "    " and resid 25   and name HG2%)
      4.300     2.300     1.700 peak   616 spectrum    1 weight  0.10000E+01 volume  0.61740E-03 ppm1      8.423 ppm2      0.994 CV     1
 ASSI {  618}
   (( segid "    " and resid 132  and name H   ))
   (  segid "    " and resid 191  and name HD2%)
      3.800     1.800     1.800 peak   618 spectrum    1 weight  0.10000E+01 volume  0.19227E-02 ppm1      8.665 ppm2      0.753 CV     1
 ASSI {  622}
   (( segid "    " and resid 131  and name H   ))
   (  segid "    " and resid 174  and name HD2%)
      3.700     1.700     1.700 peak   622 spectrum    1 weight  0.10000E+01 volume  0.12977E-02 ppm1      8.416 ppm2      0.680 CV     1
 OR {  622}
   (( segid "    " and resid 131  and name H   ))
   (  segid "    " and resid 174  and name HD1%)
 ASSI {  623}
   (( segid "    " and resid 131  and name H   ))
   (  segid "    " and resid 130  and name HG1%)
      4.200     2.200     1.800 peak   623 spectrum    1 weight  0.10000E+01 volume  0.87656E-03 ppm1      8.413 ppm2      0.222 CV     1
 ASSI {  625}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 131  and name H   ))
      4.300     2.300     1.700 peak   625 spectrum    1 weight  0.10000E+01 volume  0.40590E-03 ppm1      8.788 ppm2      8.416 CV     1
 ASSI {  626}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 173  and name HE3 ))
      4.200     2.200     1.800 peak   626 spectrum    1 weight  0.10000E+01 volume  0.41161E-03 ppm1      8.839 ppm2      7.559 CV     1
 ASSI {  628}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 129  and name HA  ))
      3.600     1.600     1.600 peak   628 spectrum    1 weight  0.10000E+01 volume  0.49353E-03 ppm1      8.840 ppm2      5.566 CV     1
 ASSI {  629}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 193  and name HA  ))
      3.800     1.800     1.800 peak   629 spectrum    1 weight  0.10000E+01 volume  0.68981E-03 ppm1      8.785 ppm2      4.876 CV     1
 ASSI {  630}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 128  and name HA  ))
      3.200     1.300     1.300 peak   630 spectrum    1 weight  0.10000E+01 volume  0.11510E-02 ppm1      8.841 ppm2      4.619 CV     1
 ASSI {  632}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 173  and name HA  ))
      5.100     3.300     0.900 peak   632 spectrum    1 weight  0.10000E+01 volume  0.31824E-03 ppm1      8.782 ppm2      4.636 CV     1
 ASSI {  633}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 173  and name HA  ))
      4.500     2.500     1.500 peak   633 spectrum    1 weight  0.10000E+01 volume  0.55452E-03 ppm1      8.414 ppm2      4.653 CV     1
 ASSI {  634}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 128  and name HB2 ))
      3.600     1.600     1.600 peak   634 spectrum    1 weight  0.10000E+01 volume  0.68028E-03 ppm1      8.839 ppm2      3.666 CV     1
 ASSI {  635}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 129  and name HB2 ))
      3.300     1.400     1.400 peak   635 spectrum    1 weight  0.10000E+01 volume  0.46686E-03 ppm1      8.835 ppm2      1.164 CV     1
 ASSI {  636}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 129  and name HB3 ))
      3.600     1.600     1.600 peak   636 spectrum    1 weight  0.10000E+01 volume  0.88418E-03 ppm1      8.841 ppm2      1.492 CV     1
 ASSI {  638}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 129  and name HB3 ))
      3.100     1.200     1.200 peak   638 spectrum    1 weight  0.10000E+01 volume  0.13530E-02 ppm1      8.786 ppm2      1.512 CV     1
 ASSI {  639}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 192  and name HB2 ))
      3.900     1.900     1.900 peak   639 spectrum    1 weight  0.10000E+01 volume  0.10004E-02 ppm1      8.786 ppm2      1.388 CV     1
 ASSI {  640}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 191  and name HB3 ))
      3.800     1.800     1.800 peak   640 spectrum    1 weight  0.10000E+01 volume  0.42303E-03 ppm1      8.788 ppm2      1.256 CV     1
 ASSI {  641}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 129  and name HB2 ))
      4.400     2.400     1.600 peak   641 spectrum    1 weight  0.10000E+01 volume  0.76794E-03 ppm1      8.788 ppm2      1.164 CV     1
 ASSI {  643}
   (( segid "    " and resid 130  and name H   ))
   (  segid "    " and resid 130  and name HG2%)
      4.200     2.200     1.800 peak   643 spectrum    1 weight  0.10000E+01 volume  0.96039E-03 ppm1      8.786 ppm2      0.478 CV     1
 ASSI {  651}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 197  and name H   ))
      5.600     3.900     0.400 peak   651 spectrum    1 weight  0.10000E+01 volume  0.36969E-03 ppm1      8.878 ppm2      7.557 CV     1
 ASSI {  653}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 196  and name H   ))
      3.900     1.900     1.900 peak   653 spectrum    1 weight  0.10000E+01 volume  0.61740E-03 ppm1      8.876 ppm2      8.344 CV     1
 ASSI {  654}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 128  and name H   ))
      4.600     2.600     1.400 peak   654 spectrum    1 weight  0.10000E+01 volume  0.58882E-03 ppm1      7.809 ppm2      8.880 CV     1
 ASSI {  656}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name H   ))
      3.000     1.100     1.100 peak   656 spectrum    1 weight  0.10000E+01 volume  0.15988E-02 ppm1      7.807 ppm2      7.699 CV     1
 ASSI {  657}
   (( segid "    " and resid 127  and name H   ))
   (  segid "    " and resid 127  and name HE% )
      4.500     2.600     1.500 peak   657 spectrum    1 weight  0.10000E+01 volume  0.82701E-03 ppm1      7.806 ppm2      6.637 CV     1
 ASSI {  658}
   (( segid "    " and resid 127  and name H   ))
   (  segid "    " and resid 127  and name HD% )
      3.200     1.300     1.300 peak   658 spectrum    1 weight  0.10000E+01 volume  0.25725E-02 ppm1      7.806 ppm2      6.860 CV     1
 ASSI {  659}
   (( segid "    " and resid 128  and name H   ))
   (  segid "    " and resid 127  and name HD% )
      3.900     1.900     1.900 peak   659 spectrum    1 weight  0.10000E+01 volume  0.14959E-02 ppm1      8.878 ppm2      6.858 CV     1
 ASSI {  660}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 173  and name HZ3 ))
      4.400     2.500     1.600 peak   660 spectrum    1 weight  0.10000E+01 volume  0.42686E-03 ppm1      8.879 ppm2      6.709 CV     1
 ASSI {  661}
   (( segid "    " and resid 128  and name H   ))
   (  segid "    " and resid 127  and name HE% )
      5.500     3.700     0.500 peak   661 spectrum    1 weight  0.10000E+01 volume  0.51260E-03 ppm1      8.878 ppm2      6.638 CV     1
 ASSI {  662}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 173  and name HZ3 ))
      5.000     3.100     1.000 peak   662 spectrum    1 weight  0.10000E+01 volume  0.32586E-03 ppm1      8.834 ppm2      6.713 CV     1
 ASSI {  663}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 193  and name HA  ))
      5.200     3.400     0.800 peak   663 spectrum    1 weight  0.10000E+01 volume  0.28012E-03 ppm1      8.885 ppm2      4.865 CV     1
 ASSI {  664}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 128  and name HA  ))
      2.900     1.100     1.100 peak   664 spectrum    1 weight  0.10000E+01 volume  0.14197E-02 ppm1      8.877 ppm2      4.618 CV     1
 ASSI {  665}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 125  and name HA  ))
      3.600     1.600     1.600 peak   665 spectrum    1 weight  0.10000E+01 volume  0.96993E-03 ppm1      7.806 ppm2      4.454 CV     1
 ASSI {  667}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 195  and name HA  ))
      5.000     3.100     1.000 peak   667 spectrum    1 weight  0.10000E+01 volume  0.45732E-03 ppm1      7.810 ppm2      3.619 CV     1
 ASSI {  668}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 195  and name HA  ))
      3.700     1.700     1.700 peak   668 spectrum    1 weight  0.10000E+01 volume  0.14349E-02 ppm1      8.877 ppm2      3.632 CV     1
 ASSI {  669}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 127  and name HB2 ))
      3.800     1.800     1.800 peak   669 spectrum    1 weight  0.10000E+01 volume  0.20256E-02 ppm1      8.878 ppm2      2.786 CV     1
 ASSI {  670}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 127  and name HB3 ))
      3.500     1.600     1.600 peak   670 spectrum    1 weight  0.10000E+01 volume  0.27859E-02 ppm1      7.806 ppm2      2.786 CV     1
 ASSI {  671}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HB3 ))
      4.500     2.600     1.500 peak   671 spectrum    1 weight  0.10000E+01 volume  0.62311E-03 ppm1      7.809 ppm2      2.109 CV     1
 OR {  671}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
 ASSI {  672}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HG2 ))
      4.100     2.100     1.900 peak   672 spectrum    1 weight  0.10000E+01 volume  0.10633E-02 ppm1      7.805 ppm2      1.829 CV     1
 OR {  672}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
 ASSI {  673}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 194  and name HB2 ))
      3.300     1.300     1.300 peak   673 spectrum    1 weight  0.10000E+01 volume  0.67265E-03 ppm1      8.881 ppm2      1.502 CV     1
 ASSI {  674}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 194  and name HG2 ))
      4.600     2.600     1.400 peak   674 spectrum    1 weight  0.10000E+01 volume  0.50878E-03 ppm1      8.876 ppm2      1.403 CV     1
 ASSI {  676}
   (( segid "    " and resid 128  and name H   ))
   (  segid "    " and resid 130  and name HG1%)
      5.200     3.400     0.800 peak   676 spectrum    1 weight  0.10000E+01 volume  0.27632E-03 ppm1      8.878 ppm2      0.209 CV     1
 ASSI {  677}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 114  and name H   ))
      2.700     0.900     0.900 peak   677 spectrum    1 weight  0.10000E+01 volume  0.21933E-02 ppm1      7.653 ppm2      7.487 CV     1
 ASSI {  678}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 119  and name H   ))
      2.300     0.600     0.600 peak   678 spectrum    1 weight  0.10000E+01 volume  0.25934E-02 ppm1      7.688 ppm2      7.472 CV     1
 ASSI {  679}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 127  and name H   ))
      3.900     1.900     1.900 peak   679 spectrum    1 weight  0.10000E+01 volume  0.13015E-02 ppm1      8.064 ppm2      7.797 CV     1
 ASSI {  680}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 126  and name H   ))
      2.500     0.800     0.800 peak   680 spectrum    1 weight  0.10000E+01 volume  0.30565E-02 ppm1      8.064 ppm2      7.701 CV     1
 ASSI {  682}
   (( segid "    " and resid 126  and name H   ))
   (  segid "    " and resid 127  and name HD% )
      3.700     1.700     1.700 peak   682 spectrum    1 weight  0.10000E+01 volume  0.75843E-03 ppm1      7.700 ppm2      6.863 CV     1
 ASSI {  684}
   (( segid "    " and resid 125  and name H   ))
   (  segid "    " and resid 127  and name HD% )
      4.700     2.800     1.300 peak   684 spectrum    1 weight  0.10000E+01 volume  0.62311E-03 ppm1      8.063 ppm2      6.862 CV     1
 ASSI {  685}
   (( segid "    " and resid 125  and name H   ))
   (  segid "    " and resid 127  and name HE% )
      5.000     3.100     1.000 peak   685 spectrum    1 weight  0.10000E+01 volume  0.42303E-03 ppm1      8.064 ppm2      6.659 CV     1
 ASSI {  686}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 123  and name HA  ))
      4.300     2.300     1.700 peak   686 spectrum    1 weight  0.10000E+01 volume  0.15778E-02 ppm1      8.063 ppm2      4.899 CV     1
 ASSI {  687}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 125  and name HA  ))
      2.500     0.800     0.800 peak   687 spectrum    1 weight  0.10000E+01 volume  0.58310E-02 ppm1      8.063 ppm2      4.460 CV     1
 ASSI {  688}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 126  and name HA  ))
      4.400     2.400     1.600 peak   688 spectrum    1 weight  0.10000E+01 volume  0.55643E-03 ppm1      8.058 ppm2      4.186 CV     1
 ASSI {  691}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 118  and name HA  ))
      2.500     0.800     0.800 peak   691 spectrum    1 weight  0.10000E+01 volume  0.42399E-02 ppm1      7.687 ppm2      4.100 CV     1
 ASSI {  692}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 114  and name HA  ))
      4.100     2.100     1.900 peak   692 spectrum    1 weight  0.10000E+01 volume  0.57739E-03 ppm1      7.690 ppm2      3.843 CV     1
 ASSI {  693}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 116  and name HA  ))
      3.700     1.700     1.700 peak   693 spectrum    1 weight  0.10000E+01 volume  0.53356E-03 ppm1      7.689 ppm2      3.746 CV     1
 ASSI {  694}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 115  and name HA  ))
      4.100     2.100     1.900 peak   694 spectrum    1 weight  0.10000E+01 volume  0.79081E-03 ppm1      7.688 ppm2      3.372 CV     1
 ASSI {  696}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 124  and name HB3 ))
      4.300     2.300     1.700 peak   696 spectrum    1 weight  0.10000E+01 volume  0.68601E-03 ppm1      8.064 ppm2      3.075 CV     1
 ASSI {  697}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 123  and name HB2 ))
      4.400     2.400     1.600 peak   697 spectrum    1 weight  0.10000E+01 volume  0.95659E-03 ppm1      8.063 ppm2      2.787 CV     1
 ASSI {  698}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 123  and name HB3 ))
      4.600     2.600     1.400 peak   698 spectrum    1 weight  0.10000E+01 volume  0.74506E-03 ppm1      8.064 ppm2      2.716 CV     1
 ASSI {  699}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 125  and name HB3 ))
      2.700     0.900     0.900 peak   699 spectrum    1 weight  0.10000E+01 volume  0.65342E-02 ppm1      8.063 ppm2      2.461 CV     1
 ASSI {  700}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
      4.100     2.200     1.900 peak   700 spectrum    1 weight  0.10000E+01 volume  0.87847E-03 ppm1      8.064 ppm2      2.111 CV     1
 OR {  700}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 126  and name HB3 ))
 ASSI {  701}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
      3.300     1.400     1.400 peak   701 spectrum    1 weight  0.10000E+01 volume  0.12215E-02 ppm1      7.700 ppm2      2.109 CV     1
 OR {  701}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 126  and name HB3 ))
 ASSI {  702}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 118  and name HB2 ))
      2.500     0.800     0.800 peak   702 spectrum    1 weight  0.10000E+01 volume  0.39845E-02 ppm1      7.688 ppm2      1.945 CV     1
 ASSI {  703}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 126  and name HG2 ))
      3.000     1.200     1.200 peak   703 spectrum    1 weight  0.10000E+01 volume  0.17588E-02 ppm1      7.700 ppm2      1.829 CV     1
 OR {  703}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
 ASSI {  707}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 126  and name HG2 ))
      3.600     1.600     1.600 peak   707 spectrum    1 weight  0.10000E+01 volume  0.12481E-02 ppm1      8.063 ppm2      1.822 CV     1
 ASSI {  711}
   (( segid "    " and resid 125  and name H   ))
   (  segid "    " and resid 121  and name HG2%)
      5.000     3.100     1.000 peak   711 spectrum    1 weight  0.10000E+01 volume  0.43257E-03 ppm1      8.064 ppm2      0.499 CV     1
 ASSI {  712}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 122  and name H   ))
      3.300     1.400     1.400 peak   712 spectrum    1 weight  0.10000E+01 volume  0.14597E-02 ppm1      8.689 ppm2      8.500 CV     1
 ASSI {  713}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 79   and name H   ))
      3.900     1.900     1.900 peak   713 spectrum    1 weight  0.10000E+01 volume  0.87276E-03 ppm1      8.676 ppm2      9.046 CV     1
 ASSI {  714}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 6    and name H   ))
      4.500     2.600     1.500 peak   714 spectrum    1 weight  0.10000E+01 volume  0.44970E-03 ppm1      8.676 ppm2      8.878 CV     1
 ASSI {  715}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 124  and name H   ))
      4.800     2.800     1.200 peak   715 spectrum    1 weight  0.10000E+01 volume  0.46495E-03 ppm1      8.694 ppm2      7.690 CV     1
 ASSI {  716}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 122  and name HB  ))
      2.800     1.000     1.000 peak   716 spectrum    1 weight  0.10000E+01 volume  0.35292E-02 ppm1      8.690 ppm2      4.177 CV     1
 OR {  716}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI {  717}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 7    and name HA  ))
      3.300     1.400     1.400 peak   717 spectrum    1 weight  0.10000E+01 volume  0.76794E-03 ppm1      8.676 ppm2      4.497 CV     1
 ASSI {  718}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 78   and name HA  ))
      3.000     1.100     1.100 peak   718 spectrum    1 weight  0.10000E+01 volume  0.13834E-02 ppm1      8.676 ppm2      5.326 CV     1
 ASSI {  719}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 6    and name HA  ))
      2.400     0.700     0.700 peak   719 spectrum    1 weight  0.10000E+01 volume  0.32700E-02 ppm1      8.675 ppm2      4.969 CV     1
 ASSI {  720}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 123  and name HA  ))
      3.000     1.100     1.100 peak   720 spectrum    1 weight  0.10000E+01 volume  0.21457E-02 ppm1      8.688 ppm2      4.900 CV     1
 ASSI {  721}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 123  and name HB2 ))
      3.200     1.300     1.300 peak   721 spectrum    1 weight  0.10000E+01 volume  0.16407E-02 ppm1      8.688 ppm2      2.782 CV     1
 ASSI {  722}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 123  and name HB3 ))
      3.300     1.400     1.400 peak   722 spectrum    1 weight  0.10000E+01 volume  0.14520E-02 ppm1      8.690 ppm2      2.719 CV     1
 ASSI {  723}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 7    and name HB2 ))
      2.700     0.900     0.900 peak   723 spectrum    1 weight  0.10000E+01 volume  0.14673E-02 ppm1      8.675 ppm2      1.825 CV     1
 ASSI {  724}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 6    and name HB3 ))
      3.900     1.900     1.900 peak   724 spectrum    1 weight  0.10000E+01 volume  0.83844E-03 ppm1      8.677 ppm2      1.646 CV     1
 ASSI {  727}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 7    and name HG2 ))
      3.400     1.400     1.400 peak   727 spectrum    1 weight  0.10000E+01 volume  0.14463E-02 ppm1      8.678 ppm2      1.181 CV     1
 ASSI {  730}
   (( segid "    " and resid 7    and name H   ))
   (  segid "    " and resid 6    and name HD2%)
      4.300     2.300     1.700 peak   730 spectrum    1 weight  0.10000E+01 volume  0.15473E-02 ppm1      8.675 ppm2      0.884 CV     1
 ASSI {  731}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 121  and name HG12))
      5.300     3.500     0.700 peak   731 spectrum    1 weight  0.10000E+01 volume  0.43257E-03 ppm1      8.692 ppm2      0.824 CV     1
 ASSI {  732}
   (( segid "    " and resid 7    and name H   ))
   (  segid "    " and resid 8    and name HD1%)
      3.600     1.600     1.600 peak   732 spectrum    1 weight  0.10000E+01 volume  0.16636E-02 ppm1      8.677 ppm2      0.711 CV     1
 ASSI {  734}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
      6.000     4.800     0.000 peak   734 spectrum    1 weight  0.10000E+01 volume  0.33157E-03 ppm1      8.691 ppm2      0.292 CV     1
 ASSI {  737}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 122  and name H   ))
      3.900     1.900     1.900 peak   737 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      7.933 ppm2      8.503 CV     1
 ASSI {  738}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 120  and name H   ))
      2.600     0.800     0.800 peak   738 spectrum    1 weight  0.10000E+01 volume  0.28012E-02 ppm1      7.936 ppm2      7.547 CV     1
 ASSI {  739}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 119  and name H   ))
      3.700     1.700     1.700 peak   739 spectrum    1 weight  0.10000E+01 volume  0.83464E-03 ppm1      7.936 ppm2      7.470 CV     1
 ASSI {  740}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 121  and name HA  ))
      2.700     0.900     0.900 peak   740 spectrum    1 weight  0.10000E+01 volume  0.42381E-02 ppm1      8.500 ppm2      4.136 CV     1
 ASSI {  742}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 121  and name HA  ))
      2.900     1.000     1.000 peak   742 spectrum    1 weight  0.10000E+01 volume  0.24315E-02 ppm1      7.936 ppm2      4.113 CV     1
 ASSI {  743}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 116  and name HA  ))
      3.600     1.600     1.600 peak   743 spectrum    1 weight  0.10000E+01 volume  0.12310E-02 ppm1      7.935 ppm2      3.734 CV     1
 ASSI {  744}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 120  and name HA2 ))
      3.200     1.300     1.300 peak   744 spectrum    1 weight  0.10000E+01 volume  0.16121E-02 ppm1      7.937 ppm2      3.674 CV     1
 ASSI {  745}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 120  and name HA3 ))
      3.300     1.400     1.400 peak   745 spectrum    1 weight  0.10000E+01 volume  0.18046E-02 ppm1      7.936 ppm2      4.059 CV     1
 ASSI {  746}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 116  and name HB2 ))
      4.400     2.400     1.600 peak   746 spectrum    1 weight  0.10000E+01 volume  0.69744E-03 ppm1      7.934 ppm2      2.983 CV     1
 ASSI {  747}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 116  and name HB3 ))
      5.600     3.900     0.400 peak   747 spectrum    1 weight  0.10000E+01 volume  0.37920E-03 ppm1      7.938 ppm2      2.813 CV     1
 ASSI {  748}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 121  and name HB  ))
      3.600     1.600     1.600 peak   748 spectrum    1 weight  0.10000E+01 volume  0.77938E-03 ppm1      8.499 ppm2      1.217 CV     1
 ASSI {  749}
   (( segid "    " and resid 122  and name H   ))
   (  segid "    " and resid 122  and name HG2%)
      3.700     1.700     1.700 peak   749 spectrum    1 weight  0.10000E+01 volume  0.19837E-02 ppm1      8.499 ppm2      1.135 CV     1
 ASSI {  752}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 121  and name HG13))
      4.500     2.500     1.500 peak   752 spectrum    1 weight  0.10000E+01 volume  0.65743E-03 ppm1      8.501 ppm2      0.819 CV     1
 OR {  752}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 121  and name HG12))
 ASSI {  754}
   (( segid "    " and resid 122  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
      2.800     2.800     3.200 peak   754 spectrum    1 weight  0.10000E+01 volume  0.53736E-03 ppm1      8.501 ppm2      0.287 CV     1
 ASSI {  755}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 121  and name HG13))
      2.700     0.900     0.900 peak   755 spectrum    1 weight  0.10000E+01 volume  0.14044E-02 ppm1      7.935 ppm2      0.813 CV     1
 OR {  755}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 121  and name HG12))
 ASSI {  761}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 118  and name H   ))
      3.200     1.300     1.300 peak   761 spectrum    1 weight  0.10000E+01 volume  0.75651E-03 ppm1      7.546 ppm2      7.694 CV     1
 ASSI {  763}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 119  and name H   ))
      2.300     0.700     0.700 peak   763 spectrum    1 weight  0.10000E+01 volume  0.30966E-02 ppm1      7.546 ppm2      7.465 CV     1
 ASSI {  764}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 119  and name HA  ))
      3.000     1.100     1.100 peak   764 spectrum    1 weight  0.10000E+01 volume  0.22276E-02 ppm1      7.547 ppm2      4.313 CV     1
 ASSI {  765}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 120  and name HA3 ))
      2.900     1.000     1.000 peak   765 spectrum    1 weight  0.10000E+01 volume  0.56881E-02 ppm1      7.547 ppm2      4.045 CV     1
 ASSI {  766}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 120  and name HA2 ))
      2.400     0.700     0.700 peak   766 spectrum    1 weight  0.10000E+01 volume  0.55204E-02 ppm1      7.547 ppm2      3.676 CV     1
 ASSI {  768}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 118  and name HA  ))
      3.000     1.200     1.200 peak   768 spectrum    1 weight  0.10000E+01 volume  0.20085E-02 ppm1      7.472 ppm2      4.099 CV     1
 ASSI {  769}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 116  and name HA  ))
      3.900     1.900     1.900 peak   769 spectrum    1 weight  0.10000E+01 volume  0.81939E-03 ppm1      7.472 ppm2      3.739 CV     1
 ASSI {  770}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 120  and name HA2 ))
      5.100     3.200     0.900 peak   770 spectrum    1 weight  0.10000E+01 volume  0.50307E-03 ppm1      7.476 ppm2      3.683 CV     1
 ASSI {  771}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 119  and name HG12))
      1.800     0.400     0.400 peak   771 spectrum    1 weight  0.10000E+01 volume  0.28565E-02 ppm1      7.472 ppm2      1.238 CV     1
 ASSI {  772}
   (( segid "    " and resid 119  and name H   ))
   (  segid "    " and resid 117  and name HB% )
      2.600     2.600     3.400 peak   772 spectrum    1 weight  0.10000E+01 volume  0.80034E-03 ppm1      7.471 ppm2      1.423 CV     1
 ASSI {  773}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 118  and name HG2 ))
      3.600     1.600     1.600 peak   773 spectrum    1 weight  0.10000E+01 volume  0.59644E-03 ppm1      7.470 ppm2      1.631 CV     1
 ASSI {  775}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 118  and name HB2 ))
      2.100     0.600     0.600 peak   775 spectrum    1 weight  0.10000E+01 volume  0.30108E-02 ppm1      7.472 ppm2      1.952 CV     1
 ASSI {  776}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 119  and name HG12))
      3.300     1.400     1.400 peak   776 spectrum    1 weight  0.10000E+01 volume  0.20733E-02 ppm1      7.547 ppm2      1.236 CV     1
 ASSI {  778}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 118  and name HG2 ))
      4.900     3.000     1.100 peak   778 spectrum    1 weight  0.10000E+01 volume  0.31824E-03 ppm1      7.548 ppm2      1.621 CV     1
 ASSI {  779}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 119  and name HB  ))
      3.400     1.400     1.400 peak   779 spectrum    1 weight  0.10000E+01 volume  0.15969E-02 ppm1      7.547 ppm2      1.953 CV     1
 ASSI {  781}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 119  and name HD1%)
      4.800     2.900     1.200 peak   781 spectrum    1 weight  0.10000E+01 volume  0.75651E-03 ppm1      7.544 ppm2      0.583 CV     1
 ASSI {  782}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 121  and name HG2%)
      5.800     4.200     0.200 peak   782 spectrum    1 weight  0.10000E+01 volume  0.51260E-03 ppm1      7.547 ppm2      0.497 CV     1
 ASSI {  783}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
      5.500     3.800     0.500 peak   783 spectrum    1 weight  0.10000E+01 volume  0.56215E-03 ppm1      7.548 ppm2      0.287 CV     1
 ASSI {  784}
   (( segid "    " and resid 119  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
      5.900     4.400     0.100 peak   784 spectrum    1 weight  0.10000E+01 volume  0.33728E-03 ppm1      7.467 ppm2      0.283 CV     1
 ASSI {  788}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 116  and name H   ))
      2.900     1.000     1.000 peak   788 spectrum    1 weight  0.10000E+01 volume  0.19494E-02 ppm1      7.755 ppm2      8.350 CV     1
 ASSI {  789}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 116  and name H   ))
      4.200     2.200     1.800 peak   789 spectrum    1 weight  0.10000E+01 volume  0.44781E-03 ppm1      7.689 ppm2      8.348 CV     1
 ASSI {  790}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 115  and name H   ))
      4.200     2.300     1.800 peak   790 spectrum    1 weight  0.10000E+01 volume  0.40590E-03 ppm1      7.753 ppm2      8.541 CV     1
 ASSI {  791}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 117  and name HA  ))
      2.700     0.900     0.900 peak   791 spectrum    1 weight  0.10000E+01 volume  0.50020E-02 ppm1      7.754 ppm2      4.080 CV     1
 ASSI {  792}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 114  and name HA  ))
      3.200     1.300     1.300 peak   792 spectrum    1 weight  0.10000E+01 volume  0.18427E-02 ppm1      7.754 ppm2      3.844 CV     1
 ASSI {  793}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 116  and name HA  ))
      3.300     1.300     1.300 peak   793 spectrum    1 weight  0.10000E+01 volume  0.13072E-02 ppm1      7.756 ppm2      3.746 CV     1
 ASSI {  794}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 113  and name HA  ))
      3.500     1.600     1.600 peak   794 spectrum    1 weight  0.10000E+01 volume  0.79652E-03 ppm1      7.752 ppm2      3.636 CV     1
 ASSI {  795}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 116  and name HB2 ))
      3.400     1.500     1.500 peak   795 spectrum    1 weight  0.10000E+01 volume  0.12729E-02 ppm1      7.755 ppm2      2.986 CV     1
 ASSI {  796}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 116  and name HB3 ))
      3.600     1.600     1.600 peak   796 spectrum    1 weight  0.10000E+01 volume  0.13739E-02 ppm1      7.754 ppm2      2.822 CV     1
 ASSI {  797}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 115  and name HB  ))
      4.400     2.400     1.600 peak   797 spectrum    1 weight  0.10000E+01 volume  0.85942E-03 ppm1      7.753 ppm2      1.767 CV     1
 ASSI {  800}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 115  and name HG2%)
      4.500     2.600     1.500 peak   800 spectrum    1 weight  0.10000E+01 volume  0.90323E-03 ppm1      7.753 ppm2      0.741 CV     1
 ASSI {  801}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 121  and name HG2%)
      5.000     3.200     1.000 peak   801 spectrum    1 weight  0.10000E+01 volume  0.50878E-03 ppm1      7.751 ppm2      0.489 CV     1
 ASSI {  802}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
      5.300     3.600     0.700 peak   802 spectrum    1 weight  0.10000E+01 volume  0.36969E-03 ppm1      7.753 ppm2      0.294 CV     1
 ASSI {  803}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 115  and name H   ))
      3.000     1.100     1.100 peak   803 spectrum    1 weight  0.10000E+01 volume  0.10176E-02 ppm1      8.349 ppm2      8.536 CV     1
 ASSI {  810}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 117  and name HA  ))
      5.300     3.500     0.700 peak   810 spectrum    1 weight  0.10000E+01 volume  0.40778E-03 ppm1      8.349 ppm2      4.075 CV     1
 ASSI {  811}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 112  and name HA  ))
      3.400     1.400     1.400 peak   811 spectrum    1 weight  0.10000E+01 volume  0.95088E-03 ppm1      8.349 ppm2      3.842 CV     1
 ASSI {  812}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 116  and name HA  ))
      3.000     1.100     1.100 peak   812 spectrum    1 weight  0.10000E+01 volume  0.15873E-02 ppm1      8.348 ppm2      3.745 CV     1
 ASSI {  813}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 113  and name HA  ))
      3.700     1.700     1.700 peak   813 spectrum    1 weight  0.10000E+01 volume  0.53927E-03 ppm1      8.345 ppm2      3.637 CV     1
 ASSI {  816}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 111  and name HA  ))
      4.500     2.600     1.500 peak   816 spectrum    1 weight  0.10000E+01 volume  0.35824E-03 ppm1      8.532 ppm2      3.996 CV     1
 ASSI {  820}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 115  and name HA  ))
      4.600     2.700     1.400 peak   820 spectrum    1 weight  0.10000E+01 volume  0.31441E-03 ppm1      7.752 ppm2      3.373 CV     1
 ASSI {  821}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 116  and name HB2 ))
      3.700     1.700     1.700 peak   821 spectrum    1 weight  0.10000E+01 volume  0.12596E-02 ppm1      8.346 ppm2      2.984 CV     1
 ASSI {  822}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 116  and name HB3 ))
      3.000     1.100     1.100 peak   822 spectrum    1 weight  0.10000E+01 volume  0.13320E-02 ppm1      8.346 ppm2      2.818 CV     1
 ASSI {  823}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 115  and name HB  ))
      3.000     1.100     1.100 peak   823 spectrum    1 weight  0.10000E+01 volume  0.13968E-02 ppm1      8.348 ppm2      1.746 CV     1
 ASSI {  824}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 115  and name HB  ))
      2.900     1.000     1.000 peak   824 spectrum    1 weight  0.10000E+01 volume  0.18046E-02 ppm1      8.532 ppm2      1.743 CV     1
 ASSI {  825}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 118  and name HG2 ))
      3.700     1.700     1.700 peak   825 spectrum    1 weight  0.10000E+01 volume  0.12786E-02 ppm1      8.533 ppm2      1.630 CV     1
 ASSI {  828}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 118  and name HG2 ))
      3.900     1.900     1.900 peak   828 spectrum    1 weight  0.10000E+01 volume  0.72602E-03 ppm1      8.346 ppm2      1.629 CV     1
 ASSI {  830}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 121  and name HB  ))
      4.800     2.900     1.200 peak   830 spectrum    1 weight  0.10000E+01 volume  0.78701E-03 ppm1      8.346 ppm2      1.225 CV     1
 ASSI {  832}
   (( segid "    " and resid 115  and name H   ))
   (  segid "    " and resid 114  and name HG2%)
      3.800     1.800     1.800 peak   832 spectrum    1 weight  0.10000E+01 volume  0.92801E-03 ppm1      8.535 ppm2      1.166 CV     1
 ASSI {  833}
   (( segid "    " and resid 115  and name H   ))
   (  segid "    " and resid 115  and name HG2%)
      3.900     1.900     1.900 peak   833 spectrum    1 weight  0.10000E+01 volume  0.25382E-02 ppm1      8.534 ppm2      0.732 CV     1
 ASSI {  837}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 115  and name H   ))
      2.800     1.000     1.000 peak   837 spectrum    1 weight  0.10000E+01 volume  0.17512E-02 ppm1      7.487 ppm2      8.533 CV     1
 ASSI {  838}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 115  and name H   ))
      4.300     2.300     1.700 peak   838 spectrum    1 weight  0.10000E+01 volume  0.48973E-03 ppm1      7.653 ppm2      8.539 CV     1
 ASSI {  839}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 111  and name H   ))
      4.000     2.000     2.000 peak   839 spectrum    1 weight  0.10000E+01 volume  0.57928E-03 ppm1      7.655 ppm2      8.423 CV     1
 ASSI {  840}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 116  and name H   ))
      4.300     2.300     1.700 peak   840 spectrum    1 weight  0.10000E+01 volume  0.55832E-03 ppm1      7.485 ppm2      8.346 CV     1
 ASSI {  841}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 112  and name H   ))
      4.100     2.100     1.900 peak   841 spectrum    1 weight  0.10000E+01 volume  0.41161E-03 ppm1      7.487 ppm2      8.764 CV     1
 ASSI {  842}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 17   and name H   ))
      4.300     2.300     1.700 peak   842 spectrum    1 weight  0.10000E+01 volume  0.75843E-03 ppm1      7.657 ppm2      9.133 CV     1
 ASSI {  843}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 112  and name H   ))
      2.900     1.000     1.000 peak   843 spectrum    1 weight  0.10000E+01 volume  0.16674E-02 ppm1      7.653 ppm2      8.750 CV     1
 ASSI {  847}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 17   and name HA  ))
      2.200     0.600     0.600 peak   847 spectrum    1 weight  0.10000E+01 volume  0.83368E-02 ppm1      7.657 ppm2      4.377 CV     1
 ASSI {  848}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 114  and name HB  ))
      4.700     2.800     1.300 peak   848 spectrum    1 weight  0.10000E+01 volume  0.62122E-03 ppm1      7.650 ppm2      4.242 CV     1
 ASSI {  849}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 110  and name HA  ))
      4.100     2.100     1.900 peak   849 spectrum    1 weight  0.10000E+01 volume  0.52974E-03 ppm1      7.489 ppm2      4.385 CV     1
 ASSI {  850}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 114  and name HB  ))
      2.500     0.800     0.800 peak   850 spectrum    1 weight  0.10000E+01 volume  0.37902E-02 ppm1      7.487 ppm2      4.235 CV     1
 ASSI {  851}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 111  and name HA  ))
      3.900     1.900     1.900 peak   851 spectrum    1 weight  0.10000E+01 volume  0.61549E-03 ppm1      7.653 ppm2      3.999 CV     1
 ASSI {  852}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 112  and name HA  ))
      3.200     1.200     1.200 peak   852 spectrum    1 weight  0.10000E+01 volume  0.14463E-02 ppm1      7.654 ppm2      3.843 CV     1
 ASSI {  853}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 113  and name HA  ))
      2.700     0.900     0.900 peak   853 spectrum    1 weight  0.10000E+01 volume  0.28849E-02 ppm1      7.653 ppm2      3.630 CV     1
 ASSI {  854}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 111  and name HA  ))
      3.300     1.400     1.400 peak   854 spectrum    1 weight  0.10000E+01 volume  0.12805E-02 ppm1      7.488 ppm2      3.994 CV     1
 ASSI {  855}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 114  and name HA  ))
      2.800     1.000     1.000 peak   855 spectrum    1 weight  0.10000E+01 volume  0.34072E-02 ppm1      7.486 ppm2      3.844 CV     1
 ASSI {  856}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 113  and name HA  ))
      3.300     1.400     1.400 peak   856 spectrum    1 weight  0.10000E+01 volume  0.12748E-02 ppm1      7.487 ppm2      3.632 CV     1
 ASSI {  857}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 115  and name HA  ))
      4.900     3.000     1.100 peak   857 spectrum    1 weight  0.10000E+01 volume  0.42303E-03 ppm1      7.485 ppm2      3.374 CV     1
 ASSI {  859}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HG3 ))
      3.100     1.200     1.200 peak   859 spectrum    1 weight  0.10000E+01 volume  0.32948E-02 ppm1      7.657 ppm2      2.024 CV     1
 ASSI {  860}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
      2.200     0.600     0.600 peak   860 spectrum    1 weight  0.10000E+01 volume  0.60236E-02 ppm1      7.653 ppm2      1.929 CV     1
 ASSI {  861}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HB2 ))
      2.500     0.800     0.800 peak   861 spectrum    1 weight  0.10000E+01 volume  0.36548E-02 ppm1      7.657 ppm2      1.594 CV     1
 ASSI {  864}
   (( segid "    " and resid 114  and name H   ))
   (  segid "    " and resid 117  and name HB% )
      4.400     2.500     1.600 peak   864 spectrum    1 weight  0.10000E+01 volume  0.63836E-03 ppm1      7.485 ppm2      1.431 CV     1
 ASSI {  865}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
      3.300     1.300     1.300 peak   865 spectrum    1 weight  0.10000E+01 volume  0.34051E-02 ppm1      7.487 ppm2      1.929 CV     1
 ASSI {  866}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 113  and name HB3 ))
      3.100     1.200     1.200 peak   866 spectrum    1 weight  0.10000E+01 volume  0.12691E-02 ppm1      7.485 ppm2      1.744 CV     1
 ASSI {  871}
   (( segid "    " and resid 113  and name H   ))
   (  segid "    " and resid 112  and name HD1%)
      4.400     2.400     1.600 peak   871 spectrum    1 weight  0.10000E+01 volume  0.15302E-02 ppm1      7.652 ppm2      0.730 CV     1
 ASSI {  872}
   (( segid "    " and resid 18   and name H   ))
   (  segid "    " and resid 3    and name HB% )
      5.700     4.100     0.300 peak   872 spectrum    1 weight  0.10000E+01 volume  0.57548E-03 ppm1      7.657 ppm2      1.106 CV     1
 ASSI {  878}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 110  and name H   ))
      4.300     2.400     1.700 peak   878 spectrum    1 weight  0.10000E+01 volume  0.38491E-03 ppm1      8.754 ppm2      7.027 CV     1
 ASSI {  879}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 111  and name HA  ))
      2.900     1.000     1.000 peak   879 spectrum    1 weight  0.10000E+01 volume  0.20046E-02 ppm1      8.418 ppm2      3.996 CV     1
 ASSI {  880}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 112  and name HA  ))
      5.000     3.200     1.000 peak   880 spectrum    1 weight  0.10000E+01 volume  0.36207E-03 ppm1      8.414 ppm2      3.840 CV     1
 ASSI {  881}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 109  and name HA  ))
      4.000     2.000     2.000 peak   881 spectrum    1 weight  0.10000E+01 volume  0.48020E-03 ppm1      8.419 ppm2      3.803 CV     1
 ASSI {  883}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 110  and name HA  ))
      4.000     2.000     2.000 peak   883 spectrum    1 weight  0.10000E+01 volume  0.59453E-03 ppm1      8.751 ppm2      4.384 CV     1
 ASSI {  884}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 108  and name HA  ))
      3.500     1.500     1.500 peak   884 spectrum    1 weight  0.10000E+01 volume  0.88800E-03 ppm1      8.417 ppm2      3.459 CV     1
 ASSI {  885}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 108  and name HA  ))
      4.100     2.100     1.900 peak   885 spectrum    1 weight  0.10000E+01 volume  0.56786E-03 ppm1      8.752 ppm2      3.459 CV     1
 ASSI {  886}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 110  and name HB2 ))
      4.200     2.200     1.800 peak   886 spectrum    1 weight  0.10000E+01 volume  0.99471E-03 ppm1      8.416 ppm2      2.673 CV     1
 ASSI {  887}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 110  and name HB3 ))
      2.700     2.700     3.300 peak   887 spectrum    1 weight  0.10000E+01 volume  0.21838E-02 ppm1      8.417 ppm2      2.575 CV     1
 ASSI {  888}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 111  and name HG3 ))
      4.300     2.300     1.700 peak   888 spectrum    1 weight  0.10000E+01 volume  0.12138E-02 ppm1      8.418 ppm2      2.234 CV     1
 ASSI {  889}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 111  and name HB3 ))
      2.800     1.000     1.000 peak   889 spectrum    1 weight  0.10000E+01 volume  0.17169E-02 ppm1      8.416 ppm2      2.016 CV     1
 ASSI {  890}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 111  and name HB2 ))
      2.900     1.000     1.000 peak   890 spectrum    1 weight  0.10000E+01 volume  0.14997E-02 ppm1      8.417 ppm2      1.731 CV     1
 ASSI {  891}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 112  and name HB2 ))
      4.700     2.700     1.300 peak   891 spectrum    1 weight  0.10000E+01 volume  0.54881E-03 ppm1      8.418 ppm2      1.636 CV     1
 ASSI {  892}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 106  and name HD3 ))
      3.400     1.500     1.500 peak   892 spectrum    1 weight  0.10000E+01 volume  0.51640E-03 ppm1      8.416 ppm2      1.495 CV     1
 ASSI {  894}
   (( segid "    " and resid 112  and name H   ))
   (  segid "    " and resid 108  and name HG1%)
      3.900     1.900     1.900 peak   894 spectrum    1 weight  0.10000E+01 volume  0.59073E-03 ppm1      8.753 ppm2      0.509 CV     1
 ASSI {  895}
   (( segid "    " and resid 111  and name H   ))
   (  segid "    " and resid 112  and name HD1%)
      4.900     3.000     1.100 peak   895 spectrum    1 weight  0.10000E+01 volume  0.79652E-03 ppm1      8.418 ppm2      0.735 CV     1
 ASSI {  896}
   (( segid "    " and resid 18   and name H   ))
   (  segid "    " and resid 16   and name HG2%)
      4.600     2.700     1.400 peak   896 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      7.657 ppm2      0.927 CV     1
 ASSI {  897}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 111  and name H   ))
      4.100     2.100     1.900 peak   897 spectrum    1 weight  0.10000E+01 volume  0.33728E-03 ppm1      8.780 ppm2      8.421 CV     1
 ASSI {  898}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 108  and name H   ))
      3.000     1.100     1.100 peak   898 spectrum    1 weight  0.10000E+01 volume  0.87847E-03 ppm1      8.776 ppm2      7.906 CV     1
 ASSI {  900}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 107  and name HB  ))
      3.200     1.300     1.300 peak   900 spectrum    1 weight  0.10000E+01 volume  0.12310E-02 ppm1      8.775 ppm2      4.434 CV     1
 ASSI {  901}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 176  and name HA  ))
      3.500     1.600     1.600 peak   901 spectrum    1 weight  0.10000E+01 volume  0.11757E-02 ppm1      8.775 ppm2      4.256 CV     1
 ASSI {  903}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 109  and name HA  ))
      2.800     1.000     1.000 peak   903 spectrum    1 weight  0.10000E+01 volume  0.29118E-02 ppm1      8.776 ppm2      3.781 CV     1
 ASSI {  904}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 108  and name HA  ))
      3.400     1.400     1.400 peak   904 spectrum    1 weight  0.10000E+01 volume  0.88800E-03 ppm1      8.777 ppm2      3.479 CV     1
 ASSI {  905}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 176  and name HB2 ))
      5.300     3.500     0.700 peak   905 spectrum    1 weight  0.10000E+01 volume  0.65932E-03 ppm1      8.778 ppm2      3.022 CV     1
 ASSI {  906}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 110  and name HB3 ))
      4.900     3.000     1.100 peak   906 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      8.778 ppm2      2.594 CV     1
 ASSI {  907}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 108  and name HB  ))
      2.800     1.000     1.000 peak   907 spectrum    1 weight  0.10000E+01 volume  0.11128E-02 ppm1      8.777 ppm2      2.326 CV     1
 ASSI {  908}
   (( segid "    " and resid 109  and name H   ))
   (  segid "    " and resid 107  and name HG2%)
      3.900     1.900     1.900 peak   908 spectrum    1 weight  0.10000E+01 volume  0.29764E-02 ppm1      8.776 ppm2      1.203 CV     1
 ASSI {  909}
   (( segid "    " and resid 109  and name H   ))
   (  segid "    " and resid 108  and name HG2%)
      4.300     2.300     1.700 peak   909 spectrum    1 weight  0.10000E+01 volume  0.10538E-02 ppm1      8.774 ppm2      0.935 CV     1
 ASSI {  910}
   (( segid "    " and resid 109  and name H   ))
   (  segid "    " and resid 108  and name HG1%)
      3.900     1.900     1.900 peak   910 spectrum    1 weight  0.10000E+01 volume  0.11986E-02 ppm1      8.776 ppm2      0.512 CV     1
 ASSI {  912}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 109  and name H   ))
      4.900     3.000     1.100 peak   912 spectrum    1 weight  0.10000E+01 volume  0.30299E-03 ppm1      8.512 ppm2      8.783 CV     1
 ASSI {  913}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 108  and name H   ))
      5.000     3.100     1.000 peak   913 spectrum    1 weight  0.10000E+01 volume  0.35062E-03 ppm1      8.513 ppm2      7.900 CV     1
 ASSI {  919}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 107  and name HB  ))
      2.600     0.800     0.800 peak   919 spectrum    1 weight  0.10000E+01 volume  0.93755E-03 ppm1      7.907 ppm2      4.433 CV     1
 ASSI {  921}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 107  and name HB  ))
      4.100     2.100     1.900 peak   921 spectrum    1 weight  0.10000E+01 volume  0.51640E-03 ppm1      8.515 ppm2      4.429 CV     1
 ASSI {  922}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 107  and name HA  ))
      3.400     1.400     1.400 peak   922 spectrum    1 weight  0.10000E+01 volume  0.88609E-03 ppm1      8.513 ppm2      3.790 CV     1
 ASSI {  925}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 110  and name HB2 ))
      3.900     1.900     1.900 peak   925 spectrum    1 weight  0.10000E+01 volume  0.89751E-03 ppm1      8.512 ppm2      2.675 CV     1
 ASSI {  927}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 108  and name HB  ))
      3.000     1.100     1.100 peak   927 spectrum    1 weight  0.10000E+01 volume  0.84417E-03 ppm1      7.908 ppm2      2.323 CV     1
 ASSI {  928}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 106  and name HB3 ))
      4.200     2.200     1.800 peak   928 spectrum    1 weight  0.10000E+01 volume  0.14673E-02 ppm1      8.511 ppm2      1.962 CV     1
 ASSI {  929}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 106  and name HB2 ))
      3.000     1.100     1.100 peak   929 spectrum    1 weight  0.10000E+01 volume  0.94706E-03 ppm1      8.511 ppm2      1.832 CV     1
 ASSI {  930}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 106  and name HD2 ))
      4.500     2.500     1.500 peak   930 spectrum    1 weight  0.10000E+01 volume  0.78510E-03 ppm1      8.512 ppm2      1.467 CV     1
 ASSI {  931}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 106  and name HG2 ))
      5.200     3.400     0.800 peak   931 spectrum    1 weight  0.10000E+01 volume  0.67456E-03 ppm1      8.513 ppm2      1.330 CV     1
 ASSI {  937}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 105  and name H   ))
      2.900     1.100     1.100 peak   937 spectrum    1 weight  0.10000E+01 volume  0.18331E-02 ppm1      7.228 ppm2      8.598 CV     1
 ASSI {  938}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 107  and name H   ))
      4.600     2.600     1.400 peak   938 spectrum    1 weight  0.10000E+01 volume  0.70697E-03 ppm1      7.227 ppm2      8.517 CV     1
 ASSI {  939}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 104  and name H   ))
      4.700     2.800     1.300 peak   939 spectrum    1 weight  0.10000E+01 volume  0.40778E-03 ppm1      7.229 ppm2      8.406 CV     1
 ASSI {  940}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 104  and name H   ))
      3.100     1.200     1.200 peak   940 spectrum    1 weight  0.10000E+01 volume  0.70315E-03 ppm1      8.598 ppm2      8.398 CV     1
 ASSI {  941}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 61   and name HD1 ))
      4.400     2.400     1.600 peak   941 spectrum    1 weight  0.10000E+01 volume  0.40778E-03 ppm1      8.592 ppm2      7.323 CV     1
 ASSI {  943}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 106  and name HA  ))
      3.100     1.200     1.200 peak   943 spectrum    1 weight  0.10000E+01 volume  0.18008E-02 ppm1      7.228 ppm2      4.509 CV     1
 ASSI {  944}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 104  and name HA  ))
      3.600     1.600     1.600 peak   944 spectrum    1 weight  0.10000E+01 volume  0.77556E-03 ppm1      7.229 ppm2      4.245 CV     1
 ASSI {  946}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 106  and name HA  ))
      4.800     2.900     1.200 peak   946 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      8.601 ppm2      4.510 CV     1
 ASSI {  947}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 104  and name HA  ))
      3.900     1.900     1.900 peak   947 spectrum    1 weight  0.10000E+01 volume  0.69172E-03 ppm1      8.598 ppm2      4.245 CV     1
 ASSI {  948}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 105  and name HA  ))
      3.200     1.300     1.300 peak   948 spectrum    1 weight  0.10000E+01 volume  0.14787E-02 ppm1      8.596 ppm2      4.156 CV     1
 ASSI {  949}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 105  and name HB2 ))
      4.500     2.500     1.500 peak   949 spectrum    1 weight  0.10000E+01 volume  0.53356E-03 ppm1      7.225 ppm2      3.699 CV     1
 ASSI {  950}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 105  and name HB2 ))
      3.900     1.900     1.900 peak   950 spectrum    1 weight  0.10000E+01 volume  0.96422E-03 ppm1      8.599 ppm2      3.704 CV     1
 ASSI {  952}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 105  and name HB3 ))
      3.200     1.300     1.300 peak   952 spectrum    1 weight  0.10000E+01 volume  0.91085E-03 ppm1      8.597 ppm2      2.422 CV     1
 ASSI {  953}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 103  and name HB2 ))
      5.000     3.200     1.000 peak   953 spectrum    1 weight  0.10000E+01 volume  0.28394E-03 ppm1      8.602 ppm2      2.241 CV     1
 ASSI {  954}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 106  and name HB3 ))
      4.200     2.200     1.800 peak   954 spectrum    1 weight  0.10000E+01 volume  0.54499E-03 ppm1      8.598 ppm2      1.953 CV     1
 ASSI {  955}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 106  and name HB2 ))
      5.500     3.700     0.500 peak   955 spectrum    1 weight  0.10000E+01 volume  0.34682E-03 ppm1      8.596 ppm2      1.842 CV     1
 ASSI {  956}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 105  and name HB3 ))
      4.600     2.600     1.400 peak   956 spectrum    1 weight  0.10000E+01 volume  0.44970E-03 ppm1      7.231 ppm2      2.430 CV     1
 ASSI {  957}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 103  and name HB2 ))
      4.600     2.700     1.400 peak   957 spectrum    1 weight  0.10000E+01 volume  0.60786E-03 ppm1      7.226 ppm2      2.246 CV     1
 ASSI {  958}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 106  and name HB3 ))
      3.100     1.200     1.200 peak   958 spectrum    1 weight  0.10000E+01 volume  0.25763E-02 ppm1      7.228 ppm2      1.957 CV     1
 ASSI {  959}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 106  and name HB2 ))
      3.700     1.700     1.700 peak   959 spectrum    1 weight  0.10000E+01 volume  0.19913E-02 ppm1      7.228 ppm2      1.836 CV     1
 ASSI {  961}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 106  and name HD2 ))
      4.600     2.600     1.400 peak   961 spectrum    1 weight  0.10000E+01 volume  0.67265E-03 ppm1      7.228 ppm2      1.475 CV     1
 ASSI {  962}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 106  and name HG2 ))
      3.500     1.600     1.600 peak   962 spectrum    1 weight  0.10000E+01 volume  0.15244E-02 ppm1      7.229 ppm2      1.327 CV     1
 ASSI {  963}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 106  and name HG3 ))
      2.600     0.800     0.800 peak   963 spectrum    1 weight  0.10000E+01 volume  0.19056E-02 ppm1      7.228 ppm2      1.145 CV     1
 ASSI {  964}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 106  and name HD2 ))
      5.500     3.800     0.500 peak   964 spectrum    1 weight  0.10000E+01 volume  0.27441E-03 ppm1      8.602 ppm2      1.484 CV     1
 ASSI {  965}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 106  and name HG2 ))
      4.500     2.600     1.500 peak   965 spectrum    1 weight  0.10000E+01 volume  0.34682E-03 ppm1      8.596 ppm2      1.331 CV     1
 ASSI {  966}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 106  and name HG3 ))
      4.100     2.100     1.900 peak   966 spectrum    1 weight  0.10000E+01 volume  0.65743E-03 ppm1      8.595 ppm2      1.142 CV     1
 ASSI {  967}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 84   and name HD3 ))
      4.300     2.300     1.700 peak   967 spectrum    1 weight  0.10000E+01 volume  0.25916E-03 ppm1      8.599 ppm2      1.050 CV     1
 OR {  967}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 84   and name HD2 ))
 ASSI {  968}
   (( segid "    " and resid 106  and name H   ))
   (  segid "    " and resid 102  and name HG1%)
      5.500     3.800     0.500 peak   968 spectrum    1 weight  0.10000E+01 volume  0.44019E-03 ppm1      7.227 ppm2      0.735 CV     1
 ASSI {  970}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 103  and name H   ))
      5.200     3.300     0.800 peak   970 spectrum    1 weight  0.10000E+01 volume  0.28394E-03 ppm1      8.395 ppm2      8.017 CV     1
 ASSI {  974}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 104  and name HA  ))
      3.200     1.300     1.300 peak   974 spectrum    1 weight  0.10000E+01 volume  0.12577E-02 ppm1      8.392 ppm2      4.239 CV     1
 ASSI {  976}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 85   and name HA  ))
      4.500     2.500     1.500 peak   976 spectrum    1 weight  0.10000E+01 volume  0.31441E-03 ppm1      8.390 ppm2      4.675 CV     1
 ASSI {  979}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 104  and name HB3 ))
      3.100     1.200     1.200 peak   979 spectrum    1 weight  0.10000E+01 volume  0.98900E-03 ppm1      8.397 ppm2      2.464 CV     1
 ASSI {  980}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 103  and name HB2 ))
      4.500     2.500     1.500 peak   980 spectrum    1 weight  0.10000E+01 volume  0.50689E-03 ppm1      8.398 ppm2      2.247 CV     1
 ASSI {  981}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 103  and name HB2 ))
      2.700     0.900     0.900 peak   981 spectrum    1 weight  0.10000E+01 volume  0.20142E-02 ppm1      8.021 ppm2      2.249 CV     1
 ASSI {  982}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 103  and name HB3 ))
      3.400     1.400     1.400 peak   982 spectrum    1 weight  0.10000E+01 volume  0.19208E-02 ppm1      8.021 ppm2      2.608 CV     1
 ASSI {  983}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 102  and name HB  ))
      3.100     1.200     1.200 peak   983 spectrum    1 weight  0.10000E+01 volume  0.24620E-02 ppm1      8.021 ppm2      1.954 CV     1
 ASSI {  984}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 106  and name HG3 ))
      4.400     2.500     1.600 peak   984 spectrum    1 weight  0.10000E+01 volume  0.32775E-03 ppm1      8.396 ppm2      1.143 CV     1
 ASSI {  987}
   (( segid "    " and resid 104  and name H   ))
   (  segid "    " and resid 102  and name HG1%)
      4.900     3.000     1.100 peak   987 spectrum    1 weight  0.10000E+01 volume  0.47069E-03 ppm1      8.398 ppm2      0.735 CV     1
 ASSI {  989}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 102  and name H   ))
      4.600     2.600     1.400 peak   989 spectrum    1 weight  0.10000E+01 volume  0.47069E-03 ppm1      8.323 ppm2      8.821 CV     1
 ASSI {  993}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 103  and name H   ))
      4.800     2.800     1.200 peak   993 spectrum    1 weight  0.10000E+01 volume  0.35444E-03 ppm1      8.819 ppm2      8.021 CV     1
 ASSI {  996}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 101  and name HG3 ))
      2.900     2.900     3.100 peak   996 spectrum    1 weight  0.10000E+01 volume  0.44590E-03 ppm1      8.814 ppm2      2.504 CV     1
 ASSI {  997}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 101  and name HG2 ))
      2.900     2.900     3.100 peak   997 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      8.817 ppm2      2.440 CV     1
 ASSI {  998}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 101  and name HG3 ))
      4.000     2.000     2.000 peak   998 spectrum    1 weight  0.10000E+01 volume  0.16388E-02 ppm1      8.324 ppm2      2.495 CV     1
 ASSI {  999}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 101  and name HG2 ))
      2.700     0.900     0.900 peak   999 spectrum    1 weight  0.10000E+01 volume  0.17531E-02 ppm1      8.324 ppm2      2.439 CV     1
 ASSI { 1000}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 102  and name HB  ))
      3.600     1.600     1.600 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.77365E-03 ppm1      8.821 ppm2      1.938 CV     1
 ASSI { 1001}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 101  and name HB2 ))
      4.300     2.300     1.700 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.10443E-02 ppm1      8.818 ppm2      1.887 CV     1
 ASSI { 1004}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 101  and name HB2 ))
      2.600     0.800     0.800 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.20371E-02 ppm1      8.326 ppm2      1.884 CV     1
 ASSI { 1006}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 101  and name HB3 ))
      3.400     1.400     1.400 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.26487E-02 ppm1      8.326 ppm2      1.578 CV     1
 ASSI { 1008}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 100  and name HG13))
      4.900     3.000     1.100 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.53736E-03 ppm1      8.322 ppm2      1.070 CV     1
 ASSI { 1009}
   (( segid "    " and resid 101  and name H   ))
   (  segid "    " and resid 99   and name HG2%)
      3.000     3.000     3.000 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.35824E-03 ppm1      8.328 ppm2      0.911 CV     1
 ASSI { 1013}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 88   and name H   ))
      3.400     1.400     1.400 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.80034E-03 ppm1      9.166 ppm2      9.021 CV     1
 ASSI { 1014}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 90   and name H   ))
      4.500     2.500     1.500 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.63836E-03 ppm1      9.166 ppm2      8.806 CV     1
 ASSI { 1015}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 99   and name H   ))
      4.500     2.600     1.500 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.49736E-03 ppm1      9.165 ppm2      8.410 CV     1
 ASSI { 1016}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 101  and name H   ))
      4.700     2.700     1.300 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.41352E-03 ppm1      9.166 ppm2      8.326 CV     1
 ASSI { 1017}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 99   and name HA  ))
      2.400     0.700     0.700 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.38551E-02 ppm1      9.166 ppm2      4.931 CV     1
 ASSI { 1020}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 99   and name HA  ))
      3.100     1.200     1.200 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.14844E-02 ppm1      8.414 ppm2      4.930 CV     1
 ASSI { 1021}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name HA  ))
      2.300     0.600     0.600 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.89046E-02 ppm1      8.414 ppm2      4.603 CV     1
 ASSI { 1022}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 99   and name HB  ))
      2.600     0.800     0.800 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.42913E-02 ppm1      8.414 ppm2      3.824 CV     1
 ASSI { 1023}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 99   and name HB  ))
      4.500     2.600     1.500 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.62885E-03 ppm1      9.168 ppm2      3.829 CV     1
 ASSI { 1025}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 31   and name HG2 ))
      3.700     1.800     1.800 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.20580E-02 ppm1      8.329 ppm2      2.724 CV     1
 ASSI { 1026}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 31   and name HG3 ))
      2.500     0.800     0.800 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.17474E-02 ppm1      8.329 ppm2      2.523 CV     1
 ASSI { 1027}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 31   and name HB3 ))
      3.900     1.900     1.900 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.14101E-02 ppm1      8.330 ppm2      2.329 CV     1
 ASSI { 1029}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 88   and name HB2 ))
      4.000     2.000     2.000 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.49544E-03 ppm1      9.168 ppm2      1.848 CV     1
 ASSI { 1034}
   (( segid "    " and resid 98   and name H   ))
   (( segid "    " and resid 98   and name HG3 ))
      3.200     1.300     1.300 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.10443E-02 ppm1      9.128 ppm2      1.319 CV     1
 ASSI { 1037}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 100  and name HG13))
      4.300     2.300     1.700 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.12329E-02 ppm1      9.164 ppm2      1.074 CV     1
 ASSI { 1040}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name HB2 ))
      2.700     0.900     0.900 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.27689E-02 ppm1      8.414 ppm2      1.635 CV     1
 ASSI { 1047}
   (( segid "    " and resid 98   and name H   ))
   (( segid "    " and resid 97   and name H   ))
      4.200     2.200     1.800 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.97755E-03 ppm1      9.129 ppm2      8.407 CV     1
 ASSI { 1052}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 96   and name HB  ))
      3.500     1.500     1.500 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.30927E-02 ppm1      8.394 ppm2      4.068 CV     1
 ASSI { 1053}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 97   and name HA  ))
      3.100     1.200     1.200 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.13339E-02 ppm1      8.393 ppm2      4.870 CV     1
 ASSI { 1054}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 97   and name HB  ))
      2.500     0.800     0.800 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.43732E-02 ppm1      8.394 ppm2      1.808 CV     1
 ASSI { 1055}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 91   and name HG3 ))
      4.200     2.200     1.800 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.34682E-03 ppm1      8.392 ppm2      1.358 CV     1
 ASSI { 1062}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 92   and name H   ))
      3.500     1.600     1.600 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.56786E-03 ppm1      8.050 ppm2      8.937 CV     1
 ASSI { 1063}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 93   and name H   ))
      5.000     3.100     1.000 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.35062E-03 ppm1      8.046 ppm2      8.497 CV     1
 ASSI { 1064}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 97   and name H   ))
      4.300     2.300     1.700 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.11643E-02 ppm1      8.049 ppm2      8.395 CV     1
 ASSI { 1065}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 94   and name H   ))
      2.600     0.800     0.800 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.30451E-02 ppm1      7.983 ppm2      7.667 CV     1
 ASSI { 1066}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 92   and name H   ))
      4.000     2.000     2.000 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.58882E-03 ppm1      7.982 ppm2      8.939 CV     1
 ASSI { 1067}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 93   and name H   ))
      3.900     1.900     1.900 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.49736E-03 ppm1      7.983 ppm2      8.496 CV     1
 ASSI { 1068}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      4.900     3.000     1.100 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.40590E-03 ppm1      8.051 ppm2      4.579 CV     1
 ASSI { 1069}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 95   and name HA2 ))
      3.400     1.400     1.400 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.13453E-02 ppm1      8.050 ppm2      4.318 CV     1
 ASSI { 1070}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 96   and name HA  ))
      2.800     1.000     1.000 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.26526E-02 ppm1      8.050 ppm2      4.173 CV     1
 ASSI { 1071}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 96   and name HB  ))
      2.800     0.900     0.900 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.23438E-02 ppm1      8.050 ppm2      4.068 CV     1
 ASSI { 1072}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      4.400     2.400     1.600 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      7.984 ppm2      4.574 CV     1
 ASSI { 1073}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 94   and name HA  ))
      3.100     1.200     1.200 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.22486E-02 ppm1      7.983 ppm2      4.440 CV     1
 ASSI { 1074}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 95   and name HA2 ))
      2.500     0.800     0.800 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.41179E-02 ppm1      7.983 ppm2      4.320 CV     1
 ASSI { 1075}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 96   and name HA  ))
      5.300     3.500     0.700 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.43448E-03 ppm1      7.981 ppm2      4.170 CV     1
 ASSI { 1076}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 93   and name HA  ))
      3.100     1.200     1.200 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.15454E-02 ppm1      7.983 ppm2      4.070 CV     1
 ASSI { 1077}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 95   and name HA3 ))
      3.700     1.700     1.700 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.13244E-02 ppm1      8.050 ppm2      3.491 CV     1
 ASSI { 1078}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 94   and name HB3 ))
      4.400     2.400     1.600 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.40590E-03 ppm1      8.049 ppm2      3.028 CV     1
 ASSI { 1079}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 95   and name HA3 ))
      3.000     1.100     1.100 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.42647E-02 ppm1      7.983 ppm2      3.495 CV     1
 ASSI { 1080}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 94   and name HB3 ))
      4.100     2.100     1.900 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.84226E-03 ppm1      7.982 ppm2      3.027 CV     1
 ASSI { 1081}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 92   and name HG3 ))
      4.900     3.000     1.100 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.72602E-03 ppm1      8.051 ppm2      2.575 CV     1
 ASSI { 1082}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 92   and name HB3 ))
      3.900     1.900     1.900 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.11472E-02 ppm1      8.050 ppm2      2.253 CV     1
 ASSI { 1083}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 94   and name HB2 ))
      3.900     1.900     1.900 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.78701E-03 ppm1      7.982 ppm2      2.541 CV     1
 ASSI { 1084}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 92   and name HG2 ))
      5.400     3.600     0.600 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.37349E-03 ppm1      7.979 ppm2      2.444 CV     1
 ASSI { 1085}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 92   and name HB3 ))
      3.800     1.800     1.800 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.90705E-03 ppm1      7.983 ppm2      2.251 CV     1
 ASSI { 1086}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 93   and name HB2 ))
      4.200     2.200     1.800 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.77747E-03 ppm1      7.984 ppm2      1.727 CV     1
 ASSI { 1087}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 93   and name HB3 ))
      4.200     2.300     1.800 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.10481E-02 ppm1      7.983 ppm2      1.637 CV     1
 ASSI { 1088}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 91   and name HG3 ))
      4.600     2.700     1.400 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.83844E-03 ppm1      7.982 ppm2      1.367 CV     1
 ASSI { 1089}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 91   and name HG3 ))
      4.100     2.100     1.900 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.52974E-03 ppm1      8.051 ppm2      1.364 CV     1
 ASSI { 1090}
   (( segid "    " and resid 95   and name H   ))
   (  segid "    " and resid 96   and name HG2%)
      5.700     4.100     0.300 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.63836E-03 ppm1      7.983 ppm2      1.072 CV     1
 ASSI { 1091}
   (( segid "    " and resid 95   and name H   ))
   (  segid "    " and resid 93   and name HD2%)
      4.400     2.500     1.600 peak  1091 spectrum    1 weight  0.10000E+01 volume  0.63073E-03 ppm1      7.984 ppm2      0.952 CV     1
 ASSI { 1092}
   (( segid "    " and resid 96   and name H   ))
   (  segid "    " and resid 97   and name HG1%)
      5.300     3.500     0.700 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.44019E-03 ppm1      8.052 ppm2      0.821 CV     1
 ASSI { 1094}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 92   and name H   ))
      4.800     2.900     1.200 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.52403E-03 ppm1      7.666 ppm2      8.936 CV     1
 ASSI { 1095}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 93   and name H   ))
      2.800     0.900     0.900 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.18884E-02 ppm1      7.668 ppm2      8.494 CV     1
 ASSI { 1096}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name H   ))
      5.000     3.100     1.000 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.33157E-03 ppm1      8.494 ppm2      8.938 CV     1
 ASSI { 1100}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      4.100     2.100     1.900 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.12825E-02 ppm1      7.666 ppm2      4.573 CV     1
 ASSI { 1101}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 94   and name HA  ))
      2.700     0.900     0.900 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.45676E-02 ppm1      7.667 ppm2      4.441 CV     1
 ASSI { 1102}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 95   and name HA2 ))
      5.200     3.400     0.800 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.54499E-03 ppm1      7.668 ppm2      4.320 CV     1
 ASSI { 1103}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 93   and name HA  ))
      3.300     1.300     1.300 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.19761E-02 ppm1      7.668 ppm2      4.069 CV     1
 ASSI { 1104}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      2.500     0.800     0.800 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.25135E-02 ppm1      8.494 ppm2      4.572 CV     1
 ASSI { 1105}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 94   and name HA  ))
      5.400     3.700     0.600 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.28774E-03 ppm1      8.492 ppm2      4.443 CV     1
 ASSI { 1106}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 94   and name HB3 ))
      3.400     1.400     1.400 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.28164E-02 ppm1      7.667 ppm2      3.037 CV     1
 ASSI { 1107}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 95   and name HA3 ))
      5.400     3.600     0.600 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.56786E-03 ppm1      7.665 ppm2      3.503 CV     1
 ASSI { 1108}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HG3 ))
      3.800     1.800     1.800 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.81559E-03 ppm1      8.494 ppm2      2.584 CV     1
 ASSI { 1109}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HG2 ))
      4.700     2.800     1.300 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.61931E-03 ppm1      8.496 ppm2      2.445 CV     1
 ASSI { 1110}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HB3 ))
      2.400     0.700     0.700 peak  1110 spectrum    1 weight  0.10000E+01 volume  0.17969E-02 ppm1      8.495 ppm2      2.249 CV     1
 ASSI { 1111}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 94   and name HB2 ))
      2.600     0.900     0.900 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.31842E-02 ppm1      7.667 ppm2      2.536 CV     1
 ASSI { 1112}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 92   and name HB3 ))
      2.600     0.900     0.900 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.26696E-02 ppm1      7.667 ppm2      2.253 CV     1
 ASSI { 1114}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 93   and name HB2 ))
      2.600     0.800     0.800 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.40856E-02 ppm1      8.494 ppm2      1.741 CV     1
 ASSI { 1116}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 93   and name HB2 ))
      2.600     0.800     0.800 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.24544E-02 ppm1      7.666 ppm2      1.737 CV     1
 ASSI { 1120}
   (( segid "    " and resid 93   and name H   ))
   (  segid "    " and resid 93   and name HD2%)
      2.500     0.800     0.800 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.22771E-02 ppm1      8.494 ppm2      0.954 CV     1
 OR { 1120}
   (( segid "    " and resid 93   and name H   ))
   (  segid "    " and resid 93   and name HD1%)
 ASSI { 1122}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 90   and name H   ))
      4.800     2.900     1.200 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.30299E-03 ppm1      9.215 ppm2      8.799 CV     1
 ASSI { 1127}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      3.100     1.200     1.200 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.10404E-02 ppm1      8.936 ppm2      4.575 CV     1
 ASSI { 1131}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HG2 ))
      3.600     1.600     1.600 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.11090E-02 ppm1      8.937 ppm2      2.442 CV     1
 ASSI { 1132}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HB3 ))
      3.800     1.800     1.800 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.11643E-02 ppm1      8.937 ppm2      2.253 CV     1
 ASSI { 1134}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 91   and name HG3 ))
      3.600     1.700     1.700 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.98326E-03 ppm1      8.938 ppm2      1.369 CV     1
 ASSI { 1135}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 91   and name HB2 ))
      2.900     1.100     1.100 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.13244E-02 ppm1      9.214 ppm2      1.378 CV     1
 ASSI { 1139}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 90   and name HG2%)
      3.000     1.100     1.100 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.18541E-02 ppm1      9.213 ppm2      0.637 CV     1
 OR { 1139}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 90   and name HD1%)
 ASSI { 1140}
   (( segid "    " and resid 92   and name H   ))
   (  segid "    " and resid 93   and name HD2%)
      6.000     4.500     0.000 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.32966E-03 ppm1      8.940 ppm2      0.934 CV     1
 ASSI { 1141}
   (( segid "    " and resid 92   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
      4.900     3.000     1.100 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.72984E-03 ppm1      8.937 ppm2      0.696 CV     1
 ASSI { 1142}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 98   and name H   ))
      3.200     1.300     1.300 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.94706E-03 ppm1      8.808 ppm2      9.146 CV     1
 ASSI { 1143}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 90   and name H   ))
      5.100     3.300     0.900 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.32203E-03 ppm1      8.482 ppm2      8.810 CV     1
 ASSI { 1144}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 88   and name H   ))
      4.900     3.000     1.100 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      8.484 ppm2      9.020 CV     1
 ASSI { 1145}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 88   and name HA  ))
      2.600     0.800     0.800 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.28678E-02 ppm1      8.481 ppm2      4.625 CV     1
 ASSI { 1147}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 99   and name HA  ))
      3.700     1.700     1.700 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.11490E-02 ppm1      8.806 ppm2      4.927 CV     1
 ASSI { 1148}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HA  ))
      2.500     0.800     0.800 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.30947E-02 ppm1      8.806 ppm2      4.642 CV     1
 ASSI { 1149}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HB3 ))
      4.000     2.000     2.000 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1      8.804 ppm2      1.815 CV     1
 ASSI { 1151}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HD3 ))
      5.200     3.400     0.800 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.44399E-03 ppm1      8.803 ppm2      1.497 CV     1
 OR { 1151}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HD2 ))
 ASSI { 1152}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 98   and name HG3 ))
      3.100     1.200     1.200 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.13282E-02 ppm1      8.805 ppm2      1.329 CV     1
 ASSI { 1154}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 89   and name HB3 ))
      4.000     2.000     2.000 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      8.482 ppm2      1.817 CV     1
 ASSI { 1155}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 89   and name HD3 ))
      4.200     2.200     1.800 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      8.482 ppm2      1.477 CV     1
 OR { 1155}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 89   and name HD2 ))
 ASSI { 1156}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 89   and name HG3 ))
      3.500     1.500     1.500 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.18312E-02 ppm1      8.482 ppm2      1.317 CV     1
 ASSI { 1157}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 88   and name HB3 ))
      4.300     2.300     1.700 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.52403E-03 ppm1      8.482 ppm2      1.092 CV     1
 ASSI { 1163}
   (( segid "    " and resid 89   and name H   ))
   (  segid "    " and resid 88   and name HD1%)
      4.400     2.400     1.600 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.11357E-02 ppm1      8.480 ppm2      0.697 CV     1
 ASSI { 1164}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 102  and name H   ))
      3.900     1.900     1.900 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.58690E-03 ppm1      9.021 ppm2      8.817 CV     1
 ASSI { 1167}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 101  and name HA  ))
      3.300     1.300     1.300 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.10462E-02 ppm1      9.020 ppm2      4.858 CV     1
 ASSI { 1168}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 87   and name HA  ))
      2.500     0.800     0.800 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.34263E-02 ppm1      9.020 ppm2      4.634 CV     1
 ASSI { 1169}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 100  and name HA  ))
      4.500     2.600     1.500 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.28774E-03 ppm1      9.022 ppm2      4.271 CV     1
 ASSI { 1170}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 88   and name HB2 ))
      2.800     1.000     1.000 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.13377E-02 ppm1      9.020 ppm2      1.861 CV     1
 ASSI { 1172}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 87   and name HB2 ))
      4.400     2.400     1.600 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.84226E-03 ppm1      9.021 ppm2      1.667 CV     1
 ASSI { 1173}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 100  and name HB  ))
      4.600     2.700     1.400 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.41352E-03 ppm1      9.022 ppm2      1.586 CV     1
 ASSI { 1174}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 88   and name HG  ))
      4.300     2.300     1.700 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.59073E-03 ppm1      9.023 ppm2      1.299 CV     1
 ASSI { 1175}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 88   and name HB3 ))
      3.800     1.800     1.800 peak  1175 spectrum    1 weight  0.10000E+01 volume  0.93755E-03 ppm1      9.020 ppm2      1.086 CV     1
 ASSI { 1177}
   (( segid "    " and resid 88   and name H   ))
   (  segid "    " and resid 88   and name HD2%)
      4.700     2.800     1.300 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.85180E-03 ppm1      9.022 ppm2      0.772 CV     1
 ASSI { 1180}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 103  and name H   ))
      5.000     3.100     1.000 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.28965E-03 ppm1      9.301 ppm2      8.017 CV     1
 ASSI { 1181}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 102  and name H   ))
      2.900     1.000     1.000 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.10557E-02 ppm1      9.303 ppm2      8.819 CV     1
 ASSI { 1182}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 104  and name H   ))
      4.900     3.000     1.100 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.38111E-03 ppm1      9.303 ppm2      8.392 CV     1
 ASSI { 1183}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 86   and name H   ))
      3.900     1.900     1.900 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.80797E-03 ppm1      7.131 ppm2      9.303 CV     1
 ASSI { 1184}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 104  and name H   ))
      4.400     2.400     1.600 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.44210E-03 ppm1      7.129 ppm2      8.411 CV     1
 ASSI { 1185}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 84   and name H   ))
      2.600     0.800     0.800 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.18370E-02 ppm1      7.129 ppm2      8.105 CV     1
 ASSI { 1186}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 48   and name H   ))
      3.600     1.600     1.600 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.52785E-03 ppm1      8.103 ppm2      8.608 CV     1
 ASSI { 1189}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 47   and name HD% )
      4.800     2.800     1.200 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.42112E-03 ppm1      8.105 ppm2      6.706 CV     1
 ASSI { 1190}
   (( segid "    " and resid 85   and name H   ))
   (  segid "    " and resid 47   and name HD% )
      3.100     3.100     2.900 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.30870E-03 ppm1      7.131 ppm2      6.712 CV     1
 ASSI { 1191}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 85   and name HE21))
      4.900     3.000     1.100 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      7.131 ppm2      6.469 CV     1
 ASSI { 1192}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 47   and name HA  ))
      4.400     2.500     1.600 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.73935E-03 ppm1      7.128 ppm2      4.875 CV     1
 ASSI { 1193}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 85   and name HA  ))
      3.200     1.300     1.300 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.65932E-03 ppm1      7.128 ppm2      4.677 CV     1
 ASSI { 1194}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 46   and name HA  ))
      4.900     3.000     1.100 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      7.128 ppm2      4.472 CV     1
 ASSI { 1195}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 103  and name HA  ))
      4.100     2.100     1.900 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      7.128 ppm2      4.190 CV     1
 ASSI { 1196}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 84   and name HA  ))
      3.000     1.200     1.200 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.12520E-02 ppm1      7.130 ppm2      3.703 CV     1
 ASSI { 1197}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 83   and name HA  ))
      3.600     1.600     1.600 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.13282E-02 ppm1      7.129 ppm2      3.526 CV     1
 ASSI { 1199}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 85   and name HA  ))
      2.600     0.800     0.800 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.11872E-02 ppm1      9.303 ppm2      4.672 CV     1
 ASSI { 1201}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 87   and name HD2 ))
      5.400     3.600     0.600 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.28774E-03 ppm1      9.302 ppm2      3.644 CV     1
 ASSI { 1202}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 87   and name HD3 ))
      5.300     3.500     0.700 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.30490E-03 ppm1      9.304 ppm2      3.518 CV     1
 ASSI { 1206}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 46   and name HA  ))
      4.400     2.400     1.600 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.33919E-03 ppm1      8.101 ppm2      4.471 CV     1
 ASSI { 1207}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HD2 ))
      4.800     2.900     1.200 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.29154E-03 ppm1      9.301 ppm2      2.982 CV     1
 ASSI { 1208}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HD3 ))
      3.500     1.500     1.500 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.39636E-03 ppm1      9.305 ppm2      2.896 CV     1
 ASSI { 1212}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 83   and name HE2 ))
      5.200     3.300     0.800 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.36395E-03 ppm1      7.127 ppm2      2.785 CV     1
 OR { 1212}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 83   and name HE3 ))
 ASSI { 1213}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 103  and name HB3 ))
      5.400     3.600     0.600 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.25535E-03 ppm1      7.130 ppm2      2.603 CV     1
 ASSI { 1215}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 46   and name HB2 ))
      5.700     4.000     0.300 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.37349E-03 ppm1      7.134 ppm2      2.332 CV     1
 ASSI { 1219}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 85   and name HB2 ))
      2.500     0.800     0.800 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.36778E-02 ppm1      7.129 ppm2      1.555 CV     1
 ASSI { 1220}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 83   and name HD2 ))
      4.500     2.600     1.500 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.98138E-03 ppm1      7.129 ppm2      1.454 CV     1
 ASSI { 1221}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 83   and name HB2 ))
      5.000     3.100     1.000 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.69744E-03 ppm1      7.128 ppm2      1.337 CV     1
 ASSI { 1223}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 84   and name HD2 ))
      4.700     2.700     1.300 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.44399E-03 ppm1      7.130 ppm2      1.048 CV     1
 OR { 1223}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 84   and name HD3 ))
 ASSI { 1227}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 83   and name HD2 ))
      5.400     3.700     0.600 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.40398E-03 ppm1      8.103 ppm2      1.453 CV     1
 ASSI { 1228}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 83   and name HB2 ))
      4.800     2.900     1.200 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      8.104 ppm2      1.340 CV     1
 ASSI { 1238}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 84   and name H   ))
      4.800     2.900     1.200 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.41923E-03 ppm1      8.423 ppm2      8.099 CV     1
 ASSI { 1239}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 82   and name H   ))
      4.700     2.700     1.300 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.42494E-03 ppm1      8.420 ppm2      8.684 CV     1
 ASSI { 1240}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 50   and name H   ))
      4.000     2.000     2.000 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.36395E-03 ppm1      8.677 ppm2      9.125 CV     1
 ASSI { 1243}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 47   and name HD% )
      3.900     1.900     1.900 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.43828E-03 ppm1      8.683 ppm2      6.705 CV     1
 ASSI { 1244}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 61   and name HZ3 ))
      4.000     2.000     2.000 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.44781E-03 ppm1      8.677 ppm2      6.631 CV     1
 ASSI { 1245}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 61   and name HH2 ))
      5.300     3.600     0.700 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.30299E-03 ppm1      8.676 ppm2      6.493 CV     1
 ASSI { 1246}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 81   and name HE% )
      3.100     3.100     2.900 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.27249E-03 ppm1      8.682 ppm2      6.306 CV     1
 ASSI { 1247}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 61   and name HH2 ))
      5.100     3.200     0.900 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.29536E-03 ppm1      8.423 ppm2      6.496 CV     1
 ASSI { 1248}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 61   and name HH2 ))
      4.400     2.500     1.600 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.26487E-03 ppm1      8.105 ppm2      6.494 CV     1
 ASSI { 1249}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 81   and name HA  ))
      2.600     0.800     0.800 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.26448E-02 ppm1      8.681 ppm2      5.405 CV     1
 ASSI { 1250}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.12500E-02 ppm1      8.423 ppm2      4.720 CV     1
 ASSI { 1251}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 83   and name HA  ))
      3.100     1.200     1.200 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.10366E-02 ppm1      8.423 ppm2      3.529 CV     1
 ASSI { 1253}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 82   and name HB2 ))
      2.500     0.800     0.800 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.23057E-02 ppm1      8.423 ppm2      1.455 CV     1
 ASSI { 1255}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 82   and name HG2 ))
      3.100     1.200     1.200 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.10881E-02 ppm1      8.680 ppm2      1.457 CV     1
 OR { 1255}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI { 1256}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 82   and name HB3 ))
      3.900     1.900     1.900 peak  1256 spectrum    1 weight  0.10000E+01 volume  0.72031E-03 ppm1      8.681 ppm2      1.691 CV     1
 ASSI { 1258}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 50   and name HB3 ))
      4.700     2.800     1.300 peak  1258 spectrum    1 weight  0.10000E+01 volume  0.32775E-03 ppm1      8.685 ppm2      2.154 CV     1
 ASSI { 1259}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 80   and name HG2 ))
      4.400     2.400     1.600 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.32012E-03 ppm1      8.680 ppm2      2.002 CV     1
 ASSI { 1262}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 84   and name HB3 ))
      3.000     1.100     1.100 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.13625E-02 ppm1      8.424 ppm2      0.915 CV     1
 ASSI { 1264}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 82   and name H   ))
      4.700     2.800     1.300 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.40398E-03 ppm1      8.547 ppm2      8.680 CV     1
 ASSI { 1265}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 80   and name H   ))
      4.900     3.000     1.100 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.39445E-03 ppm1      8.547 ppm2      9.167 CV     1
 ASSI { 1267}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 52   and name H   ))
      4.100     2.100     1.900 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.30108E-03 ppm1      9.178 ppm2      8.153 CV     1
 ASSI { 1268}
   (( segid "    " and resid 81   and name H   ))
   (  segid "    " and resid 81   and name HD% )
      4.600     2.700     1.400 peak  1268 spectrum    1 weight  0.10000E+01 volume  0.73744E-03 ppm1      8.549 ppm2      6.812 CV     1
 ASSI { 1269}
   (( segid "    " and resid 80   and name H   ))
   (  segid "    " and resid 50   and name HD% )
      4.300     2.300     1.700 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.52594E-03 ppm1      9.178 ppm2      5.499 CV     1
 ASSI { 1271}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 80   and name HA  ))
      3.300     1.300     1.300 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.93181E-03 ppm1      9.178 ppm2      5.173 CV     1
 ASSI { 1272}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 79   and name HA  ))
      2.300     0.600     0.600 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.40742E-02 ppm1      9.176 ppm2      4.893 CV     1
 ASSI { 1273}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 51   and name HA  ))
      3.600     1.600     1.600 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.57548E-03 ppm1      9.176 ppm2      4.425 CV     1
 ASSI { 1274}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 81   and name HA  ))
      3.400     1.400     1.400 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.84797E-03 ppm1      8.549 ppm2      5.405 CV     1
 ASSI { 1275}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 80   and name HA  ))
      2.600     0.800     0.800 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.25668E-02 ppm1      8.550 ppm2      5.173 CV     1
 ASSI { 1276}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 8    and name HA  ))
      4.300     2.300     1.700 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.43257E-03 ppm1      8.551 ppm2      4.910 CV     1
 ASSI { 1280}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 81   and name HB3 ))
      3.100     1.200     1.200 peak  1280 spectrum    1 weight  0.10000E+01 volume  0.10004E-02 ppm1      8.548 ppm2      3.104 CV     1
 ASSI { 1281}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 81   and name HB2 ))
      3.100     1.200     1.200 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      8.551 ppm2      2.426 CV     1
 ASSI { 1283}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 9    and name HB2 ))
      5.400     3.700     0.600 peak  1283 spectrum    1 weight  0.10000E+01 volume  0.21914E-03 ppm1      9.177 ppm2      3.573 CV     1
 ASSI { 1285}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 79   and name HG2 ))
      3.800     1.800     1.800 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.10614E-02 ppm1      9.176 ppm2      2.152 CV     1
 OR { 1285}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 79   and name HG3 ))
 ASSI { 1287}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 79   and name HB3 ))
      3.900     1.900     1.900 peak  1287 spectrum    1 weight  0.10000E+01 volume  0.91847E-03 ppm1      9.175 ppm2      1.817 CV     1
 ASSI { 1288}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 79   and name HB2 ))
      4.300     2.300     1.700 peak  1288 spectrum    1 weight  0.10000E+01 volume  0.12158E-02 ppm1      9.177 ppm2      1.708 CV     1
 ASSI { 1289}
   (( segid "    " and resid 80   and name H   ))
   (  segid "    " and resid 79   and name HE% )
      4.900     3.000     1.100 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.59073E-03 ppm1      9.181 ppm2      1.476 CV     1
 ASSI { 1290}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 49   and name HB3 ))
      4.100     2.100     1.900 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.56023E-03 ppm1      9.176 ppm2      1.288 CV     1
 ASSI { 1291}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 10   and name HG12))
      3.500     1.600     1.600 peak  1291 spectrum    1 weight  0.10000E+01 volume  0.52023E-03 ppm1      8.551 ppm2      1.186 CV     1
 ASSI { 1293}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 82   and name HG2 ))
      4.300     2.300     1.700 peak  1293 spectrum    1 weight  0.10000E+01 volume  0.32775E-03 ppm1      8.550 ppm2      1.454 CV     1
 ASSI { 1294}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 80   and name HG2 ))
      3.400     1.400     1.400 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.13892E-02 ppm1      8.550 ppm2      1.991 CV     1
 OR { 1294}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 80   and name HB3 ))
 ASSI { 1295}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 79   and name HB3 ))
      2.900     2.900     3.100 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.41541E-03 ppm1      8.543 ppm2      1.816 CV     1
 ASSI { 1296}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 82   and name HB3 ))
      4.200     2.300     1.800 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.32395E-03 ppm1      8.549 ppm2      1.702 CV     1
 ASSI { 1297}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 50   and name HB3 ))
      5.200     3.300     0.800 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.21914E-03 ppm1      8.555 ppm2      2.145 CV     1
 ASSI { 1301}
   (( segid "    " and resid 80   and name H   ))
   (  segid "    " and resid 49   and name HD2%)
      4.700     2.800     1.300 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.56023E-03 ppm1      9.176 ppm2      0.870 CV     1
 ASSI { 1302}
   (( segid "    " and resid 80   and name H   ))
   (  segid "    " and resid 8    and name HG2%)
      4.000     2.000     2.000 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.10309E-02 ppm1      9.176 ppm2      0.738 CV     1
 ASSI { 1303}
   (( segid "    " and resid 80   and name H   ))
   (  segid "    " and resid 62   and name HD1%)
      3.100     3.100     2.900 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.27058E-03 ppm1      9.175 ppm2      0.410 CV     1
 ASSI { 1304}
   (( segid "    " and resid 81   and name H   ))
   (  segid "    " and resid 32   and name HD1%)
      5.600     3.900     0.400 peak  1304 spectrum    1 weight  0.10000E+01 volume  0.23438E-03 ppm1      8.552 ppm2      0.114 CV     1
 ASSI { 1305}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 9    and name H   ))
      3.900     1.900     1.900 peak  1305 spectrum    1 weight  0.10000E+01 volume  0.49736E-03 ppm1      9.057 ppm2      8.854 CV     1
 ASSI { 1307}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 78   and name H   ))
      5.000     3.100     1.000 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.39065E-03 ppm1      9.054 ppm2      8.155 CV     1
 ASSI { 1308}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 80   and name H   ))
      4.500     2.500     1.500 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.38682E-03 ppm1      9.050 ppm2      9.183 CV     1
 ASSI { 1310}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 78   and name HA  ))
      2.500     0.800     0.800 peak  1310 spectrum    1 weight  0.10000E+01 volume  0.33976E-02 ppm1      9.052 ppm2      5.324 CV     1
 ASSI { 1312}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 78   and name HA  ))
      3.200     1.300     1.300 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.11738E-02 ppm1      8.160 ppm2      5.325 CV     1
 ASSI { 1315}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 78   and name HB  ))
      2.700     0.900     0.900 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.29611E-02 ppm1      8.161 ppm2      3.859 CV     1
 ASSI { 1316}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 77   and name HB2 ))
      3.900     1.900     1.900 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.15988E-02 ppm1      8.160 ppm2      2.810 CV     1
 ASSI { 1317}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 77   and name HB3 ))
      2.900     1.100     1.100 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.20713E-02 ppm1      8.160 ppm2      2.473 CV     1
 ASSI { 1320}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 7    and name HB2 ))
      5.100     3.300     0.900 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.31824E-03 ppm1      8.160 ppm2      1.830 CV     1
 ASSI { 1325}
   (( segid "    " and resid 78   and name H   ))
   (  segid "    " and resid 6    and name HD2%)
      2.700     2.700     3.300 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.71077E-03 ppm1      8.159 ppm2      0.877 CV     1
 ASSI { 1326}
   (( segid "    " and resid 78   and name H   ))
   (  segid "    " and resid 51   and name HD1%)
      2.600     2.600     3.400 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.86513E-03 ppm1      8.160 ppm2      0.791 CV     1
 ASSI { 1327}
   (( segid "    " and resid 78   and name H   ))
   (  segid "    " and resid 51   and name HD2%)
      3.800     1.800     1.800 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.55261E-03 ppm1      8.160 ppm2      0.733 CV     1
 ASSI { 1329}
   (( segid "    " and resid 79   and name H   ))
   (  segid "    " and resid 6    and name HD2%)
      2.900     2.900     3.100 peak  1329 spectrum    1 weight  0.10000E+01 volume  0.42494E-03 ppm1      9.053 ppm2      0.879 CV     1
 ASSI { 1330}
   (( segid "    " and resid 79   and name H   ))
   (  segid "    " and resid 8    and name HD1%)
      3.300     1.300     1.300 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.14997E-02 ppm1      9.052 ppm2      0.721 CV     1
 ASSI { 1331}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 76   and name H   ))
      2.700     0.900     0.900 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.22581E-02 ppm1      8.071 ppm2      9.294 CV     1
 ASSI { 1332}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 74   and name H   ))
      3.500     1.500     1.500 peak  1332 spectrum    1 weight  0.10000E+01 volume  0.66314E-03 ppm1      8.074 ppm2      8.910 CV     1
 ASSI { 1333}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 5    and name H   ))
      4.500     2.500     1.500 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.63073E-03 ppm1      9.294 ppm2      8.663 CV     1
 ASSI { 1336}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 75   and name HD21))
      5.000     3.100     1.000 peak  1336 spectrum    1 weight  0.10000E+01 volume  0.33157E-03 ppm1      9.292 ppm2      7.539 CV     1
 ASSI { 1339}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 77   and name HA  ))
      5.300     3.500     0.700 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      9.290 ppm2      4.588 CV     1
 ASSI { 1340}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 6    and name HA  ))
      3.500     1.500     1.500 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.65552E-03 ppm1      9.296 ppm2      4.971 CV     1
 ASSI { 1341}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 6    and name HA  ))
      3.700     1.700     1.700 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.77365E-03 ppm1      8.070 ppm2      4.975 CV     1
 ASSI { 1342}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 75   and name HA  ))
      4.700     2.700     1.300 peak  1342 spectrum    1 weight  0.10000E+01 volume  0.77176E-03 ppm1      8.071 ppm2      4.721 CV     1
 ASSI { 1344}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 76   and name HA3 ))
      3.300     1.300     1.300 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.13625E-02 ppm1      8.070 ppm2      4.258 CV     1
 ASSI { 1345}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 74   and name HA  ))
      4.600     2.700     1.400 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.27820E-03 ppm1      9.287 ppm2      4.451 CV     1
 ASSI { 1346}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 76   and name HA2 ))
      3.000     1.100     1.100 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.23610E-02 ppm1      9.295 ppm2      3.515 CV     1
 ASSI { 1347}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 76   and name HA2 ))
      3.800     1.800     1.800 peak  1347 spectrum    1 weight  0.10000E+01 volume  0.14673E-02 ppm1      8.072 ppm2      3.512 CV     1
 ASSI { 1348}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 77   and name HB2 ))
      2.400     0.700     0.700 peak  1348 spectrum    1 weight  0.10000E+01 volume  0.33938E-02 ppm1      8.071 ppm2      2.805 CV     1
 ASSI { 1349}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 77   and name HB2 ))
      4.900     3.000     1.100 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.57928E-03 ppm1      9.295 ppm2      2.798 CV     1
 ASSI { 1352}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 77   and name HB3 ))
      3.300     1.400     1.400 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.31767E-02 ppm1      8.071 ppm2      2.472 CV     1
 ASSI { 1353}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 77   and name HB3 ))
      6.000     4.600     0.000 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.32203E-03 ppm1      9.292 ppm2      2.473 CV     1
 ASSI { 1355}
   (( segid "    " and resid 76   and name H   ))
   (  segid "    " and resid 6    and name HD1%)
      4.500     2.500     1.500 peak  1355 spectrum    1 weight  0.10000E+01 volume  0.75460E-03 ppm1      9.293 ppm2      0.704 CV     1
 ASSI { 1356}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 73   and name HB2 ))
      4.900     2.900     1.100 peak  1356 spectrum    1 weight  0.10000E+01 volume  0.51449E-03 ppm1      8.074 ppm2      1.479 CV     1
 ASSI { 1359}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 76   and name H   ))
      3.800     1.800     1.800 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.90134E-03 ppm1      8.364 ppm2      9.294 CV     1
 ASSI { 1360}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 74   and name H   ))
      3.600     1.600     1.600 peak  1360 spectrum    1 weight  0.10000E+01 volume  0.10805E-02 ppm1      8.363 ppm2      8.913 CV     1
 ASSI { 1361}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 5    and name H   ))
      4.800     2.900     1.200 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      8.365 ppm2      8.655 CV     1
 ASSI { 1364}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 77   and name H   ))
      4.400     2.500     1.600 peak  1364 spectrum    1 weight  0.10000E+01 volume  0.43637E-03 ppm1      8.369 ppm2      8.074 CV     1
 ASSI { 1365}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HD21))
      2.400     0.700     0.700 peak  1365 spectrum    1 weight  0.10000E+01 volume  0.13244E-02 ppm1      8.363 ppm2      7.534 CV     1
 ASSI { 1366}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HD22))
      4.100     2.100     1.900 peak  1366 spectrum    1 weight  0.10000E+01 volume  0.11110E-02 ppm1      8.364 ppm2      7.084 CV     1
 ASSI { 1370}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 73   and name HA  ))
      2.300     0.600     0.600 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.49697E-02 ppm1      8.911 ppm2      4.212 CV     1
 ASSI { 1373}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 73   and name HA  ))
      5.200     3.400     0.800 peak  1373 spectrum    1 weight  0.10000E+01 volume  0.46686E-03 ppm1      8.364 ppm2      4.218 CV     1
 ASSI { 1374}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 5    and name HB2 ))
      5.300     3.500     0.700 peak  1374 spectrum    1 weight  0.10000E+01 volume  0.41923E-03 ppm1      8.367 ppm2      3.538 CV     1
 ASSI { 1379}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 77   and name HB2 ))
      3.300     1.400     1.400 peak  1379 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      8.914 ppm2      2.816 CV     1
 ASSI { 1380}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 77   and name HB3 ))
      4.700     2.800     1.300 peak  1380 spectrum    1 weight  0.10000E+01 volume  0.64218E-03 ppm1      8.911 ppm2      2.470 CV     1
 ASSI { 1381}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HB3 ))
      3.400     1.500     1.500 peak  1381 spectrum    1 weight  0.10000E+01 volume  0.36910E-02 ppm1      8.363 ppm2      2.686 CV     1
 ASSI { 1383}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 74   and name HB2 ))
      2.000     0.500     0.500 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.33881E-02 ppm1      8.364 ppm2      1.723 CV     1
 ASSI { 1384}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 74   and name HB3 ))
      2.900     1.100     1.100 peak  1384 spectrum    1 weight  0.10000E+01 volume  0.45086E-02 ppm1      8.363 ppm2      1.618 CV     1
 ASSI { 1385}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 74   and name HB2 ))
      3.300     1.400     1.400 peak  1385 spectrum    1 weight  0.10000E+01 volume  0.12291E-02 ppm1      8.909 ppm2      1.721 CV     1
 ASSI { 1387}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 73   and name HB2 ))
      3.100     1.200     1.200 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.13110E-02 ppm1      8.909 ppm2      1.485 CV     1
 ASSI { 1388}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 73   and name HB3 ))
      3.900     1.900     1.900 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.14330E-02 ppm1      8.910 ppm2      1.321 CV     1
 ASSI { 1389}
   (( segid "    " and resid 75   and name H   ))
   (  segid "    " and resid 6    and name HD2%)
      4.500     2.600     1.500 peak  1389 spectrum    1 weight  0.10000E+01 volume  0.49164E-03 ppm1      8.361 ppm2      0.874 CV     1
 ASSI { 1393}
   (( segid "    " and resid 73   and name H   ))
   (  segid "    " and resid 71   and name HD% )
      5.300     3.500     0.700 peak  1393 spectrum    1 weight  0.10000E+01 volume  0.54690E-03 ppm1      6.775 ppm2      7.236 CV     1
 ASSI { 1394}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 72   and name H   ))
      2.700     0.900     0.900 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.17779E-02 ppm1      6.774 ppm2      7.827 CV     1
 ASSI { 1395}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 71   and name H   ))
      4.300     2.300     1.700 peak  1395 spectrum    1 weight  0.10000E+01 volume  0.56406E-03 ppm1      6.771 ppm2      7.565 CV     1
 ASSI { 1396}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 74   and name H   ))
      4.300     2.300     1.700 peak  1396 spectrum    1 weight  0.10000E+01 volume  0.80606E-03 ppm1      6.773 ppm2      8.911 CV     1
 ASSI { 1397}
   (( segid "    " and resid 72   and name H   ))
   (( segid "    " and resid 71   and name H   ))
      4.800     2.800     1.200 peak  1397 spectrum    1 weight  0.10000E+01 volume  0.11853E-02 ppm1      7.826 ppm2      7.556 CV     1
 ASSI { 1398}
   (( segid "    " and resid 72   and name H   ))
   (  segid "    " and resid 71   and name HD% )
      3.800     1.800     1.800 peak  1398 spectrum    1 weight  0.10000E+01 volume  0.76794E-03 ppm1      7.825 ppm2      7.237 CV     1
 ASSI { 1402}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 72   and name HA  ))
      2.700     0.900     0.900 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.35196E-02 ppm1      6.774 ppm2      4.078 CV     1
 ASSI { 1403}
   (( segid "    " and resid 72   and name H   ))
   (( segid "    " and resid 69   and name HA  ))
      4.400     2.400     1.600 peak  1403 spectrum    1 weight  0.10000E+01 volume  0.90705E-03 ppm1      7.825 ppm2      4.375 CV     1
 ASSI { 1407}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 69   and name HB2 ))
      4.700     2.800     1.300 peak  1407 spectrum    1 weight  0.10000E+01 volume  0.42303E-03 ppm1      6.772 ppm2      2.786 CV     1
 ASSI { 1408}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 71   and name HB2 ))
      4.200     2.200     1.800 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.62311E-03 ppm1      6.774 ppm2      2.682 CV     1
 ASSI { 1409}
   (( segid "    " and resid 72   and name H   ))
   (( segid "    " and resid 71   and name HB3 ))
      2.300     2.300     3.700 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      7.827 ppm2      3.156 CV     1
 ASSI { 1410}
   (( segid "    " and resid 72   and name H   ))
   (( segid "    " and resid 71   and name HB2 ))
      4.500     2.600     1.500 peak  1410 spectrum    1 weight  0.10000E+01 volume  0.48020E-03 ppm1      7.825 ppm2      2.677 CV     1
 ASSI { 1411}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 73   and name HG  ))
      2.200     0.600     0.600 peak  1411 spectrum    1 weight  0.10000E+01 volume  0.42476E-02 ppm1      6.774 ppm2      1.514 CV     1
 ASSI { 1412}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 73   and name HB3 ))
      3.200     1.300     1.300 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.19570E-02 ppm1      6.774 ppm2      1.322 CV     1
 ASSI { 1414}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 72   and name HB2 ))
      3.900     1.900     1.900 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.74318E-03 ppm1      6.774 ppm2      2.066 CV     1
 ASSI { 1415}
   (( segid "    " and resid 73   and name H   ))
   (  segid "    " and resid 72   and name HE% )
      2.900     2.900     3.100 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      6.771 ppm2      1.947 CV     1
 ASSI { 1417}
   (( segid "    " and resid 72   and name H   ))
   (( segid "    " and resid 72   and name HG2 ))
      3.400     1.400     1.400 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.13568E-02 ppm1      7.825 ppm2      2.283 CV     1
 ASSI { 1418}
   (( segid "    " and resid 72   and name H   ))
   (( segid "    " and resid 72   and name HB2 ))
      2.800     1.000     1.000 peak  1418 spectrum    1 weight  0.10000E+01 volume  0.12195E-02 ppm1      7.825 ppm2      2.076 CV     1
 ASSI { 1419}
   (( segid "    " and resid 72   and name H   ))
   (( segid "    " and resid 72   and name HB3 ))
      3.800     1.800     1.800 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.11815E-02 ppm1      7.824 ppm2      2.028 CV     1
 ASSI { 1420}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 72   and name HB3 ))
      4.300     2.300     1.700 peak  1420 spectrum    1 weight  0.10000E+01 volume  0.70126E-03 ppm1      6.773 ppm2      2.026 CV     1
 ASSI { 1421}
   (( segid "    " and resid 72   and name H   ))
   (( segid "    " and resid 73   and name HG  ))
      4.500     2.500     1.500 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.51640E-03 ppm1      7.827 ppm2      1.514 CV     1
 ASSI { 1424}
   (( segid "    " and resid 71   and name H   ))
   (  segid "    " and resid 71   and name HD% )
      3.100     1.200     1.200 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.31994E-02 ppm1      7.556 ppm2      7.233 CV     1
 ASSI { 1428}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 69   and name H   ))
      4.300     2.300     1.700 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.41923E-03 ppm1      7.554 ppm2      8.085 CV     1
 ASSI { 1430}
   (( segid "    " and resid 71   and name H   ))
   (  segid "    " and resid 70   and name HE% )
      5.000     3.100     1.000 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      7.552 ppm2      6.543 CV     1
 ASSI { 1431}
   (( segid "    " and resid 70   and name H   ))
   (  segid "    " and resid 70   and name HE% )
      5.800     4.200     0.200 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.54499E-03 ppm1      7.904 ppm2      6.544 CV     1
 ASSI { 1432}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 71   and name H   ))
      2.800     0.900     0.900 peak  1432 spectrum    1 weight  0.10000E+01 volume  0.20104E-02 ppm1      7.901 ppm2      7.556 CV     1
 ASSI { 1433}
   (( segid "    " and resid 70   and name H   ))
   (  segid "    " and resid 71   and name HD% )
      4.300     2.300     1.700 peak  1433 spectrum    1 weight  0.10000E+01 volume  0.10290E-02 ppm1      7.905 ppm2      7.234 CV     1
 ASSI { 1436}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
      4.900     3.000     1.100 peak  1436 spectrum    1 weight  0.10000E+01 volume  0.34491E-03 ppm1      7.907 ppm2      4.850 CV     1
 ASSI { 1437}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 69   and name HA  ))
      3.400     1.400     1.400 peak  1437 spectrum    1 weight  0.10000E+01 volume  0.12481E-02 ppm1      7.903 ppm2      4.378 CV     1
 ASSI { 1439}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 72   and name HA  ))
      4.400     2.400     1.600 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.94326E-03 ppm1      7.558 ppm2      4.080 CV     1
 ASSI { 1440}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 71   and name HA  ))
      3.000     1.100     1.100 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.24048E-02 ppm1      7.557 ppm2      4.000 CV     1
 ASSI { 1442}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      3.100     3.100     2.900 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.29345E-03 ppm1      7.902 ppm2      4.085 CV     1
 ASSI { 1443}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 70   and name HA  ))
      2.800     0.900     0.900 peak  1443 spectrum    1 weight  0.10000E+01 volume  0.35845E-02 ppm1      7.902 ppm2      3.926 CV     1
 ASSI { 1444}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 70   and name HB3 ))
      2.400     0.700     0.700 peak  1444 spectrum    1 weight  0.10000E+01 volume  0.28373E-02 ppm1      7.902 ppm2      3.111 CV     1
 ASSI { 1445}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 70   and name HB2 ))
      3.000     1.100     1.100 peak  1445 spectrum    1 weight  0.10000E+01 volume  0.26906E-02 ppm1      7.902 ppm2      2.831 CV     1
 ASSI { 1446}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 71   and name HB2 ))
      4.700     2.800     1.300 peak  1446 spectrum    1 weight  0.10000E+01 volume  0.50689E-03 ppm1      7.901 ppm2      2.685 CV     1
 ASSI { 1447}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 69   and name HB3 ))
      3.600     1.600     1.600 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.51260E-03 ppm1      7.904 ppm2      2.439 CV     1
 ASSI { 1448}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 71   and name HB3 ))
      3.700     1.700     1.700 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.19151E-02 ppm1      7.558 ppm2      3.149 CV     1
 ASSI { 1449}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 70   and name HB2 ))
      4.200     2.200     1.800 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.10652E-02 ppm1      7.555 ppm2      2.836 CV     1
 ASSI { 1450}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 71   and name HB2 ))
      2.500     0.800     0.800 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.18103E-02 ppm1      7.558 ppm2      2.681 CV     1
 ASSI { 1451}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 69   and name HB3 ))
      3.000     3.000     3.000 peak  1451 spectrum    1 weight  0.10000E+01 volume  0.33348E-03 ppm1      7.559 ppm2      2.434 CV     1
 ASSI { 1452}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 73   and name HG  ))
      4.400     2.400     1.600 peak  1452 spectrum    1 weight  0.10000E+01 volume  0.48211E-03 ppm1      7.900 ppm2      1.522 CV     1
 ASSI { 1454}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 73   and name HG  ))
      3.700     1.700     1.700 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.93563E-03 ppm1      7.557 ppm2      1.524 CV     1
 ASSI { 1457}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 66   and name HG2 ))
      4.700     2.700     1.300 peak  1457 spectrum    1 weight  0.10000E+01 volume  0.47640E-03 ppm1      7.901 ppm2      0.988 CV     1
 ASSI { 1458}
   (( segid "    " and resid 70   and name H   ))
   (  segid "    " and resid 73   and name HD1%)
      5.000     3.100     1.000 peak  1458 spectrum    1 weight  0.10000E+01 volume  0.46877E-03 ppm1      7.901 ppm2      0.829 CV     1
 OR { 1458}
   (( segid "    " and resid 70   and name H   ))
   (  segid "    " and resid 73   and name HD2%)
 ASSI { 1460}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name H   ))
      2.900     1.000     1.000 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.16254E-02 ppm1      8.079 ppm2      8.354 CV     1
 ASSI { 1461}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 70   and name H   ))
      2.700     0.900     0.900 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.20161E-02 ppm1      8.079 ppm2      7.900 CV     1
 ASSI { 1463}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 71   and name HD% )
      4.900     3.000     1.100 peak  1463 spectrum    1 weight  0.10000E+01 volume  0.43828E-03 ppm1      8.078 ppm2      7.231 CV     1
 ASSI { 1465}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 70   and name HD% )
      5.700     4.000     0.300 peak  1465 spectrum    1 weight  0.10000E+01 volume  0.39636E-03 ppm1      8.078 ppm2      6.071 CV     1
 ASSI { 1466}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 73   and name H   ))
      5.200     3.300     0.800 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.33157E-03 ppm1      8.077 ppm2      6.782 CV     1
 ASSI { 1467}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
      4.200     2.200     1.800 peak  1467 spectrum    1 weight  0.10000E+01 volume  0.78510E-03 ppm1      8.079 ppm2      4.853 CV     1
 ASSI { 1469}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      3.600     1.600     1.600 peak  1469 spectrum    1 weight  0.10000E+01 volume  0.13625E-02 ppm1      8.079 ppm2      4.098 CV     1
 ASSI { 1470}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HA  ))
      3.100     1.200     1.200 peak  1470 spectrum    1 weight  0.10000E+01 volume  0.21418E-02 ppm1      8.078 ppm2      3.921 CV     1
 ASSI { 1471}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 68   and name HA  ))
      2.800     1.000     1.000 peak  1471 spectrum    1 weight  0.10000E+01 volume  0.18370E-02 ppm1      8.350 ppm2      3.916 CV     1
 ASSI { 1474}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
      4.400     2.500     1.600 peak  1474 spectrum    1 weight  0.10000E+01 volume  0.62693E-03 ppm1      8.331 ppm2      4.624 CV     1
 ASSI { 1475}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
      2.400     0.700     0.700 peak  1475 spectrum    1 weight  0.10000E+01 volume  0.20637E-02 ppm1      8.352 ppm2      4.854 CV     1
 ASSI { 1476}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 24   and name HA  ))
      3.700     1.800     1.800 peak  1476 spectrum    1 weight  0.10000E+01 volume  0.45544E-03 ppm1      8.356 ppm2      4.721 CV     1
 ASSI { 1477}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 70   and name HB3 ))
      4.700     2.700     1.300 peak  1477 spectrum    1 weight  0.10000E+01 volume  0.56977E-03 ppm1      8.081 ppm2      3.113 CV     1
 ASSI { 1478}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 69   and name HB2 ))
      2.700     0.900     0.900 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.32128E-02 ppm1      8.079 ppm2      2.776 CV     1
 ASSI { 1479}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 69   and name HB3 ))
      2.600     0.800     0.800 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.32909E-02 ppm1      8.078 ppm2      2.439 CV     1
 ASSI { 1480}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 21   and name HB3 ))
      4.600     2.600     1.400 peak  1480 spectrum    1 weight  0.10000E+01 volume  0.97946E-03 ppm1      8.078 ppm2      2.344 CV     1
 ASSI { 1481}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 21   and name HB2 ))
      4.400     2.400     1.600 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.10023E-02 ppm1      8.077 ppm2      2.097 CV     1
 ASSI { 1482}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HB2 ))
      2.500     0.800     0.800 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.20008E-02 ppm1      8.078 ppm2      1.944 CV     1
 ASSI { 1483}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HG  ))
      4.400     2.400     1.600 peak  1483 spectrum    1 weight  0.10000E+01 volume  0.97564E-03 ppm1      8.078 ppm2      1.653 CV     1
 ASSI { 1484}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 67   and name HB% )
      2.900     1.100     1.100 peak  1484 spectrum    1 weight  0.10000E+01 volume  0.39465E-02 ppm1      8.078 ppm2      1.389 CV     1
 ASSI { 1488}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 30   and name HB2 ))
      3.900     1.900     1.900 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.11948E-02 ppm1      8.330 ppm2      2.094 CV     1
 ASSI { 1489}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 31   and name HB2 ))
      2.700     0.900     0.900 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.17512E-02 ppm1      8.331 ppm2      1.979 CV     1
 ASSI { 1490}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 30   and name HB3 ))
      3.900     1.900     1.900 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.10290E-02 ppm1      8.328 ppm2      1.866 CV     1
 ASSI { 1491}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HB3 ))
      3.600     1.600     1.600 peak  1491 spectrum    1 weight  0.10000E+01 volume  0.14101E-02 ppm1      8.079 ppm2      1.089 CV     1
 ASSI { 1492}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 73   and name HD2%)
      4.800     2.900     1.200 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.61931E-03 ppm1      8.080 ppm2      0.817 CV     1
 ASSI { 1495}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 66   and name HG2 ))
      3.700     1.700     1.700 peak  1495 spectrum    1 weight  0.10000E+01 volume  0.82322E-03 ppm1      8.351 ppm2      0.980 CV     1
 ASSI { 1496}
   (( segid "    " and resid 68   and name H   ))
   (  segid "    " and resid 73   and name HD1%)
      5.500     3.700     0.500 peak  1496 spectrum    1 weight  0.10000E+01 volume  0.46495E-03 ppm1      8.354 ppm2      0.827 CV     1
 ASSI { 1497}
   (( segid "    " and resid 31   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
      4.200     2.200     1.800 peak  1497 spectrum    1 weight  0.10000E+01 volume  0.64598E-03 ppm1      8.341 ppm2      0.718 CV     1
 ASSI { 1498}
   (( segid "    " and resid 68   and name H   ))
   (  segid "    " and resid 68   and name HD2%)
      3.700     1.700     1.700 peak  1498 spectrum    1 weight  0.10000E+01 volume  0.21628E-02 ppm1      8.351 ppm2      0.309 CV     1
 OR { 1498}
   (( segid "    " and resid 68   and name H   ))
   (  segid "    " and resid 68   and name HD1%)
 ASSI { 1499}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 68   and name HD1%)
      4.300     2.300     1.700 peak  1499 spectrum    1 weight  0.10000E+01 volume  0.17055E-02 ppm1      8.078 ppm2      0.312 CV     1
 OR { 1499}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 68   and name HD2%)
 ASSI { 1500}
   (( segid "    " and resid 70   and name H   ))
   (  segid "    " and resid 68   and name HD2%)
      5.500     3.800     0.500 peak  1500 spectrum    1 weight  0.10000E+01 volume  0.31441E-03 ppm1      7.901 ppm2      0.302 CV     1
 ASSI { 1501}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name H   ))
      4.200     2.200     1.800 peak  1501 spectrum    1 weight  0.10000E+01 volume  0.76414E-03 ppm1      8.136 ppm2      7.475 CV     1
 ASSI { 1502}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 25   and name H   ))
      3.700     1.700     1.700 peak  1502 spectrum    1 weight  0.10000E+01 volume  0.82510E-03 ppm1      7.471 ppm2      9.465 CV     1
 ASSI { 1503}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 65   and name H   ))
      2.600     0.800     0.800 peak  1503 spectrum    1 weight  0.10000E+01 volume  0.42569E-02 ppm1      7.470 ppm2      8.154 CV     1
 ASSI { 1504}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 26   and name H   ))
      3.000     3.000     3.000 peak  1504 spectrum    1 weight  0.10000E+01 volume  0.33728E-03 ppm1      7.469 ppm2      8.710 CV     1
 ASSI { 1505}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 64   and name H   ))
      4.200     2.200     1.800 peak  1505 spectrum    1 weight  0.10000E+01 volume  0.69744E-03 ppm1      7.470 ppm2      8.423 CV     1
 ASSI { 1506}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 71   and name HE% )
      6.000     4.700     0.000 peak  1506 spectrum    1 weight  0.10000E+01 volume  0.63836E-03 ppm1      7.471 ppm2      6.857 CV     1
 ASSI { 1507}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 70   and name HD% )
      6.000     4.500     0.000 peak  1507 spectrum    1 weight  0.10000E+01 volume  0.41923E-03 ppm1      7.468 ppm2      6.062 CV     1
 ASSI { 1508}
   (( segid "    " and resid 67   and name H   ))
   (  segid "    " and resid 70   and name HD% )
      4.000     2.000     2.000 peak  1508 spectrum    1 weight  0.10000E+01 volume  0.68219E-03 ppm1      8.133 ppm2      6.067 CV     1
 ASSI { 1509}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
      4.500     2.500     1.500 peak  1509 spectrum    1 weight  0.10000E+01 volume  0.40590E-03 ppm1      7.466 ppm2      4.857 CV     1
 ASSI { 1510}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HA  ))
      2.600     0.900     0.900 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.39388E-02 ppm1      7.470 ppm2      4.383 CV     1
 ASSI { 1511}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 63   and name HA  ))
      4.700     2.800     1.300 peak  1511 spectrum    1 weight  0.10000E+01 volume  0.60598E-03 ppm1      7.470 ppm2      4.219 CV     1
 ASSI { 1512}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 64   and name HA  ))
      3.100     1.200     1.200 peak  1512 spectrum    1 weight  0.10000E+01 volume  0.11605E-02 ppm1      7.470 ppm2      3.914 CV     1
 ASSI { 1513}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 65   and name HA2 ))
      3.100     1.200     1.200 peak  1513 spectrum    1 weight  0.10000E+01 volume  0.19951E-02 ppm1      7.470 ppm2      3.578 CV     1
 ASSI { 1514}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 24   and name HG3 ))
      3.300     1.400     1.400 peak  1514 spectrum    1 weight  0.10000E+01 volume  0.13491E-02 ppm1      7.471 ppm2      2.747 CV     1
 ASSI { 1515}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 24   and name HG2 ))
      3.800     1.800     1.800 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.34299E-03 ppm1      7.470 ppm2      2.608 CV     1
 ASSI { 1519}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 63   and name HB2 ))
      4.300     2.300     1.700 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.11262E-02 ppm1      7.468 ppm2      1.922 CV     1
 ASSI { 1520}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HB3 ))
      2.700     0.900     0.900 peak  1520 spectrum    1 weight  0.10000E+01 volume  0.29498E-02 ppm1      7.470 ppm2      1.528 CV     1
 ASSI { 1521}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 67   and name HB% )
      4.700     2.800     1.300 peak  1521 spectrum    1 weight  0.10000E+01 volume  0.73935E-03 ppm1      7.468 ppm2      1.392 CV     1
 ASSI { 1522}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 24   and name HB2 ))
      5.600     4.000     0.400 peak  1522 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      7.478 ppm2      1.711 CV     1
 ASSI { 1523}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HG2 ))
      3.100     1.200     1.200 peak  1523 spectrum    1 weight  0.10000E+01 volume  0.41884E-02 ppm1      7.470 ppm2      0.994 CV     1
 OR { 1523}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HG3 ))
 ASSI { 1524}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HD3 ))
      2.900     1.000     1.000 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.10214E-02 ppm1      7.469 ppm2      0.869 CV     1
 ASSI { 1525}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 25   and name HG1%)
      2.500     2.500     3.500 peak  1525 spectrum    1 weight  0.10000E+01 volume  0.97184E-03 ppm1      7.469 ppm2      0.759 CV     1
 ASSI { 1526}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HD2 ))
      4.500     2.500     1.500 peak  1526 spectrum    1 weight  0.10000E+01 volume  0.78701E-03 ppm1      7.470 ppm2      0.498 CV     1
 ASSI { 1527}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 26   and name H   ))
      3.000     3.000     3.000 peak  1527 spectrum    1 weight  0.10000E+01 volume  0.36395E-03 ppm1      8.160 ppm2      8.698 CV     1
 ASSI { 1528}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 64   and name H   ))
      2.900     1.000     1.000 peak  1528 spectrum    1 weight  0.10000E+01 volume  0.16331E-02 ppm1      8.158 ppm2      8.424 CV     1
 ASSI { 1530}
   (( segid "    " and resid 65   and name H   ))
   (  segid "    " and resid 26   and name HD% )
      2.800     2.800     3.200 peak  1530 spectrum    1 weight  0.10000E+01 volume  0.55832E-03 ppm1      8.158 ppm2      7.071 CV     1
 ASSI { 1532}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 65   and name HA3 ))
      2.300     0.700     0.700 peak  1532 spectrum    1 weight  0.10000E+01 volume  0.52974E-02 ppm1      8.158 ppm2      4.352 CV     1
 ASSI { 1533}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 63   and name HA  ))
      4.200     2.200     1.800 peak  1533 spectrum    1 weight  0.10000E+01 volume  0.12138E-02 ppm1      8.160 ppm2      4.215 CV     1
 ASSI { 1534}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 64   and name HA  ))
      3.200     1.300     1.300 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.10919E-02 ppm1      8.160 ppm2      3.914 CV     1
 ASSI { 1535}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 65   and name HA2 ))
      2.800     1.000     1.000 peak  1535 spectrum    1 weight  0.10000E+01 volume  0.55165E-02 ppm1      8.158 ppm2      3.578 CV     1
 ASSI { 1539}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 63   and name HB2 ))
      3.300     1.400     1.400 peak  1539 spectrum    1 weight  0.10000E+01 volume  0.75080E-03 ppm1      8.155 ppm2      1.924 CV     1
 ASSI { 1541}
   (( segid "    " and resid 65   and name H   ))
   (  segid "    " and resid 25   and name HG2%)
      4.300     2.300     1.700 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.90514E-03 ppm1      8.159 ppm2      0.995 CV     1
 ASSI { 1542}
   (( segid "    " and resid 65   and name H   ))
   (  segid "    " and resid 25   and name HG1%)
      2.800     2.800     3.200 peak  1542 spectrum    1 weight  0.10000E+01 volume  0.50498E-03 ppm1      8.163 ppm2      0.756 CV     1
 ASSI { 1543}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 49   and name H   ))
      4.300     2.300     1.700 peak  1543 spectrum    1 weight  0.10000E+01 volume  0.27632E-03 ppm1      8.785 ppm2      9.077 CV     1
 ASSI { 1544}
   (( segid "    " and resid 63   and name H   ))
   (( segid "    " and resid 62   and name H   ))
      4.700     2.700     1.300 peak  1544 spectrum    1 weight  0.10000E+01 volume  0.28394E-03 ppm1      8.486 ppm2      8.797 CV     1
 ASSI { 1545}
   (( segid "    " and resid 63   and name H   ))
   (  segid "    " and resid 71   and name HD% )
      5.900     4.300     0.100 peak  1545 spectrum    1 weight  0.10000E+01 volume  0.31061E-03 ppm1      8.490 ppm2      7.233 CV     1
 ASSI { 1546}
   (( segid "    " and resid 63   and name H   ))
   (  segid "    " and resid 71   and name HE% )
      4.600     2.600     1.400 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.52594E-03 ppm1      8.490 ppm2      6.853 CV     1
 ASSI { 1553}
   (( segid "    " and resid 63   and name H   ))
   (( segid "    " and resid 62   and name HB2 ))
      4.300     2.300     1.700 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.62122E-03 ppm1      8.489 ppm2      1.177 CV     1
 ASSI { 1554}
   (( segid "    " and resid 63   and name H   ))
   (  segid "    " and resid 25   and name HG2%)
      3.500     1.600     1.600 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.94897E-03 ppm1      8.488 ppm2      0.984 CV     1
 ASSI { 1555}
   (( segid "    " and resid 63   and name H   ))
   (( segid "    " and resid 66   and name HB3 ))
      4.700     2.700     1.300 peak  1555 spectrum    1 weight  0.10000E+01 volume  0.56786E-03 ppm1      8.491 ppm2      1.519 CV     1
 ASSI { 1556}
   (( segid "    " and resid 63   and name H   ))
   (( segid "    " and resid 62   and name HB3 ))
      4.000     2.000     2.000 peak  1556 spectrum    1 weight  0.10000E+01 volume  0.57548E-03 ppm1      8.489 ppm2      1.438 CV     1
 ASSI { 1557}
   (( segid "    " and resid 63   and name H   ))
   (  segid "    " and resid 60   and name HD1%)
      5.300     3.500     0.700 peak  1557 spectrum    1 weight  0.10000E+01 volume  0.34491E-03 ppm1      8.488 ppm2      0.837 CV     1
 ASSI { 1558}
   (( segid "    " and resid 63   and name H   ))
   (  segid "    " and resid 25   and name HG1%)
      4.300     2.300     1.700 peak  1558 spectrum    1 weight  0.10000E+01 volume  0.56023E-03 ppm1      8.491 ppm2      0.759 CV     1
 ASSI { 1559}
   (( segid "    " and resid 63   and name H   ))
   (( segid "    " and resid 62   and name HG  ))
      5.300     3.500     0.700 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.40970E-03 ppm1      8.489 ppm2      0.669 CV     1
 ASSI { 1560}
   (( segid "    " and resid 63   and name H   ))
   (  segid "    " and resid 62   and name HD1%)
      5.600     4.000     0.400 peak  1560 spectrum    1 weight  0.10000E+01 volume  0.48782E-03 ppm1      8.489 ppm2      0.401 CV     1
 ASSI { 1561}
   (( segid "    " and resid 63   and name H   ))
   (  segid "    " and resid 62   and name HD2%)
      4.700     2.800     1.300 peak  1561 spectrum    1 weight  0.10000E+01 volume  0.79272E-03 ppm1      8.490 ppm2     -0.159 CV     1
 ASSI { 1562}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 51   and name H   ))
      3.000     1.100     1.100 peak  1562 spectrum    1 weight  0.10000E+01 volume  0.15492E-02 ppm1      7.231 ppm2      8.441 CV     1
 ASSI { 1563}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 52   and name H   ))
      4.800     2.900     1.200 peak  1563 spectrum    1 weight  0.10000E+01 volume  0.32775E-03 ppm1      7.232 ppm2      8.141 CV     1
 ASSI { 1565}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 61   and name HE3 ))
      5.600     3.900     0.400 peak  1565 spectrum    1 weight  0.10000E+01 volume  0.39065E-03 ppm1      8.459 ppm2      7.522 CV     1
 ASSI { 1567}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 60   and name H   ))
      4.600     2.600     1.400 peak  1567 spectrum    1 weight  0.10000E+01 volume  0.47448E-03 ppm1      8.457 ppm2      7.228 CV     1
 ASSI { 1568}
   (( segid "    " and resid 61   and name H   ))
   (  segid "    " and resid 50   and name HE% )
      4.600     2.600     1.400 peak  1568 spectrum    1 weight  0.10000E+01 volume  0.38111E-03 ppm1      8.462 ppm2      6.506 CV     1
 ASSI { 1569}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 50   and name HZ  ))
      4.400     2.500     1.600 peak  1569 spectrum    1 weight  0.10000E+01 volume  0.78127E-03 ppm1      7.229 ppm2      6.745 CV     1
 ASSI { 1570}
   (( segid "    " and resid 60   and name H   ))
   (  segid "    " and resid 50   and name HE% )
      3.700     1.700     1.700 peak  1570 spectrum    1 weight  0.10000E+01 volume  0.96993E-03 ppm1      7.230 ppm2      6.508 CV     1
 ASSI { 1571}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 59   and name H   ))
      4.600     2.600     1.400 peak  1571 spectrum    1 weight  0.10000E+01 volume  0.14063E-02 ppm1      7.230 ppm2      7.337 CV     1
 ASSI { 1572}
   (( segid "    " and resid 61   and name H   ))
   (  segid "    " and resid 50   and name HD% )
      4.300     2.300     1.700 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.41923E-03 ppm1      8.464 ppm2      5.507 CV     1
 ASSI { 1573}
   (( segid "    " and resid 60   and name H   ))
   (  segid "    " and resid 50   and name HD% )
      4.200     2.200     1.800 peak  1573 spectrum    1 weight  0.10000E+01 volume  0.43637E-03 ppm1      7.229 ppm2      5.503 CV     1
 ASSI { 1576}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 59   and name HA3 ))
      3.000     1.100     1.100 peak  1576 spectrum    1 weight  0.10000E+01 volume  0.30736E-02 ppm1      7.230 ppm2      3.748 CV     1
 ASSI { 1577}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 59   and name HA2 ))
      2.600     0.900     0.900 peak  1577 spectrum    1 weight  0.10000E+01 volume  0.25306E-02 ppm1      7.231 ppm2      3.564 CV     1
 ASSI { 1578}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 105  and name HB2 ))
      5.200     3.400     0.800 peak  1578 spectrum    1 weight  0.10000E+01 volume  0.37349E-03 ppm1      8.459 ppm2      3.702 CV     1
 ASSI { 1579}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 60   and name HA  ))
      2.400     0.700     0.700 peak  1579 spectrum    1 weight  0.10000E+01 volume  0.54005E-02 ppm1      8.459 ppm2      4.478 CV     1
 ASSI { 1580}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 61   and name HA  ))
      3.200     1.300     1.300 peak  1580 spectrum    1 weight  0.10000E+01 volume  0.10366E-02 ppm1      8.459 ppm2      4.871 CV     1
 ASSI { 1581}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 61   and name HB3 ))
      4.200     2.200     1.800 peak  1581 spectrum    1 weight  0.10000E+01 volume  0.14463E-02 ppm1      8.459 ppm2      3.166 CV     1
 ASSI { 1582}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 61   and name HB2 ))
      2.800     1.000     1.000 peak  1582 spectrum    1 weight  0.10000E+01 volume  0.16426E-02 ppm1      8.458 ppm2      3.017 CV     1
 ASSI { 1584}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 60   and name HG13))
      4.400     2.400     1.600 peak  1584 spectrum    1 weight  0.10000E+01 volume  0.55832E-03 ppm1      8.463 ppm2      1.319 CV     1
 ASSI { 1589}
   (( segid "    " and resid 60   and name H   ))
   (  segid "    " and resid 62   and name HD1%)
      5.800     4.100     0.200 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.29728E-03 ppm1      7.231 ppm2      0.390 CV     1
 ASSI { 1592}
   (( segid "    " and resid 60   and name H   ))
   (  segid "    " and resid 62   and name HD2%)
      5.400     3.700     0.600 peak  1592 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      7.235 ppm2     -0.163 CV     1
 ASSI { 1593}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 57   and name H   ))
      3.900     1.900     1.900 peak  1593 spectrum    1 weight  0.10000E+01 volume  0.90896E-03 ppm1      7.338 ppm2      8.132 CV     1
 ASSI { 1594}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name H   ))
      2.400     0.700     0.700 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.39484E-02 ppm1      7.339 ppm2      8.023 CV     1
 ASSI { 1596}
   (( segid "    " and resid 59   and name H   ))
   (  segid "    " and resid 50   and name HE% )
      4.600     2.700     1.400 peak  1596 spectrum    1 weight  0.10000E+01 volume  0.10138E-02 ppm1      7.341 ppm2      6.506 CV     1
 ASSI { 1597}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 50   and name HZ  ))
      4.200     2.200     1.800 peak  1597 spectrum    1 weight  0.10000E+01 volume  0.13949E-02 ppm1      7.341 ppm2      6.742 CV     1
 ASSI { 1601}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HA  ))
      3.000     1.100     1.100 peak  1601 spectrum    1 weight  0.10000E+01 volume  0.33196E-02 ppm1      7.339 ppm2      4.344 CV     1
 ASSI { 1603}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 52   and name HA  ))
      4.300     2.300     1.700 peak  1603 spectrum    1 weight  0.10000E+01 volume  0.10347E-02 ppm1      7.339 ppm2      3.962 CV     1
 ASSI { 1604}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 59   and name HA3 ))
      2.500     0.800     0.800 peak  1604 spectrum    1 weight  0.10000E+01 volume  0.35938E-02 ppm1      7.340 ppm2      3.748 CV     1
 ASSI { 1605}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 59   and name HA2 ))
      2.900     1.100     1.100 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.37540E-02 ppm1      7.339 ppm2      3.565 CV     1
 ASSI { 1606}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 181  and name HD2 ))
      3.900     1.900     1.900 peak  1606 spectrum    1 weight  0.10000E+01 volume  0.66123E-03 ppm1      7.339 ppm2      3.399 CV     1
 ASSI { 1607}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 181  and name HD3 ))
      3.900     1.900     1.900 peak  1607 spectrum    1 weight  0.10000E+01 volume  0.41923E-03 ppm1      7.338 ppm2      3.190 CV     1
 ASSI { 1608}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 59   and name HA3 ))
      5.200     3.400     0.800 peak  1608 spectrum    1 weight  0.10000E+01 volume  0.48402E-03 ppm1      8.022 ppm2      3.740 CV     1
 ASSI { 1609}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 59   and name HA2 ))
      5.300     3.600     0.700 peak  1609 spectrum    1 weight  0.10000E+01 volume  0.45544E-03 ppm1      8.026 ppm2      3.569 CV     1
 ASSI { 1611}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 58   and name HA  ))
      2.700     0.900     0.900 peak  1611 spectrum    1 weight  0.10000E+01 volume  0.31862E-02 ppm1      8.023 ppm2      4.344 CV     1
 ASSI { 1613}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HE2 ))
      2.900     2.900     3.100 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      7.340 ppm2      2.902 CV     1
 OR { 1613}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HE3 ))
 ASSI { 1614}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 53   and name HB3 ))
      3.900     1.900     1.900 peak  1614 spectrum    1 weight  0.10000E+01 volume  0.94517E-03 ppm1      7.340 ppm2      2.612 CV     1
 ASSI { 1615}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 55   and name HB3 ))
      3.000     3.000     3.000 peak  1615 spectrum    1 weight  0.10000E+01 volume  0.32586E-03 ppm1      7.336 ppm2      2.447 CV     1
 ASSI { 1616}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 53   and name HB3 ))
      4.400     2.400     1.600 peak  1616 spectrum    1 weight  0.10000E+01 volume  0.83844E-03 ppm1      8.021 ppm2      2.611 CV     1
 ASSI { 1618}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HB3 ))
      3.500     1.600     1.600 peak  1618 spectrum    1 weight  0.10000E+01 volume  0.17455E-02 ppm1      7.339 ppm2      1.909 CV     1
 ASSI { 1619}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 53   and name HB2 ))
      3.900     1.900     1.900 peak  1619 spectrum    1 weight  0.10000E+01 volume  0.10328E-02 ppm1      7.340 ppm2      2.118 CV     1
 ASSI { 1620}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 53   and name HB2 ))
      4.700     2.700     1.300 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.82701E-03 ppm1      8.021 ppm2      2.114 CV     1
 ASSI { 1621}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 58   and name HB3 ))
      3.400     1.500     1.500 peak  1621 spectrum    1 weight  0.10000E+01 volume  0.22238E-02 ppm1      8.023 ppm2      1.908 CV     1
 ASSI { 1622}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 58   and name HB2 ))
      2.500     2.500     3.500 peak  1622 spectrum    1 weight  0.10000E+01 volume  0.24696E-02 ppm1      8.022 ppm2      1.717 CV     1
 ASSI { 1624}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HB2 ))
      3.100     1.200     1.200 peak  1624 spectrum    1 weight  0.10000E+01 volume  0.13682E-02 ppm1      7.338 ppm2      1.714 CV     1
 ASSI { 1625}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HD3 ))
      4.100     2.100     1.900 peak  1625 spectrum    1 weight  0.10000E+01 volume  0.10023E-02 ppm1      7.338 ppm2      1.627 CV     1
 OR { 1625}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HD2 ))
 ASSI { 1626}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HG2 ))
      2.600     2.600     3.400 peak  1626 spectrum    1 weight  0.10000E+01 volume  0.84606E-03 ppm1      7.340 ppm2      1.296 CV     1
 ASSI { 1627}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HG3 ))
      4.300     2.300     1.700 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.80985E-03 ppm1      7.340 ppm2      1.190 CV     1
 ASSI { 1628}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 58   and name HG2 ))
      3.700     1.700     1.700 peak  1628 spectrum    1 weight  0.10000E+01 volume  0.16502E-02 ppm1      8.022 ppm2      1.285 CV     1
 ASSI { 1631}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 58   and name H   ))
      2.300     0.700     0.700 peak  1631 spectrum    1 weight  0.10000E+01 volume  0.38093E-02 ppm1      8.133 ppm2      8.023 CV     1
 ASSI { 1632}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 56   and name HA  ))
      2.900     1.000     1.000 peak  1632 spectrum    1 weight  0.10000E+01 volume  0.26583E-02 ppm1      8.133 ppm2      4.355 CV     1
 ASSI { 1633}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HA  ))
      2.600     0.900     0.900 peak  1633 spectrum    1 weight  0.10000E+01 volume  0.38072E-02 ppm1      8.133 ppm2      4.141 CV     1
 ASSI { 1634}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 56   and name HD2 ))
      3.100     1.200     1.200 peak  1634 spectrum    1 weight  0.10000E+01 volume  0.13568E-02 ppm1      8.133 ppm2      4.029 CV     1
 ASSI { 1635}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 56   and name HD3 ))
      3.800     1.800     1.800 peak  1635 spectrum    1 weight  0.10000E+01 volume  0.16693E-02 ppm1      8.132 ppm2      3.981 CV     1
 ASSI { 1636}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 55   and name HA  ))
      3.900     1.900     1.900 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.12481E-02 ppm1      8.134 ppm2      4.929 CV     1
 ASSI { 1637}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HE3 ))
      4.600     2.700     1.400 peak  1637 spectrum    1 weight  0.10000E+01 volume  0.14273E-02 ppm1      8.133 ppm2      2.951 CV     1
 ASSI { 1638}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 55   and name HB2 ))
      3.800     1.800     1.800 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.55070E-03 ppm1      8.137 ppm2      2.866 CV     1
 ASSI { 1639}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 55   and name HB3 ))
      3.300     1.300     1.300 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.66694E-03 ppm1      8.133 ppm2      2.448 CV     1
 ASSI { 1641}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HG2 ))
      2.300     0.600     0.600 peak  1641 spectrum    1 weight  0.10000E+01 volume  0.38721E-02 ppm1      8.133 ppm2      1.413 CV     1
 ASSI { 1642}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 58   and name HG2 ))
      5.200     3.400     0.800 peak  1642 spectrum    1 weight  0.10000E+01 volume  0.71077E-03 ppm1      8.131 ppm2      1.284 CV     1
 ASSI { 1643}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HB2 ))
      2.400     0.700     0.700 peak  1643 spectrum    1 weight  0.10000E+01 volume  0.52118E-02 ppm1      8.133 ppm2      1.779 CV     1
 ASSI { 1645}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 56   and name HG2 ))
      2.500     0.800     0.800 peak  1645 spectrum    1 weight  0.10000E+01 volume  0.36548E-02 ppm1      8.134 ppm2      2.019 CV     1
 ASSI { 1646}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 58   and name HB3 ))
      5.300     3.500     0.700 peak  1646 spectrum    1 weight  0.10000E+01 volume  0.83464E-03 ppm1      8.132 ppm2      1.907 CV     1
 ASSI { 1648}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 58   and name H   ))
      3.700     1.700     1.700 peak  1648 spectrum    1 weight  0.10000E+01 volume  0.98326E-03 ppm1      9.263 ppm2      8.025 CV     1
 ASSI { 1649}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 55   and name H   ))
      2.400     0.700     0.700 peak  1649 spectrum    1 weight  0.10000E+01 volume  0.45314E-02 ppm1      8.271 ppm2      9.266 CV     1
 ASSI { 1650}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 55   and name H   ))
      5.100     3.200     0.900 peak  1650 spectrum    1 weight  0.10000E+01 volume  0.50878E-03 ppm1      8.026 ppm2      9.267 CV     1
 ASSI { 1651}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 54   and name H   ))
      3.200     1.300     1.300 peak  1651 spectrum    1 weight  0.10000E+01 volume  0.11357E-02 ppm1      8.028 ppm2      8.271 CV     1
 ASSI { 1652}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 52   and name H   ))
      3.800     1.800     1.800 peak  1652 spectrum    1 weight  0.10000E+01 volume  0.10747E-02 ppm1      8.024 ppm2      8.128 CV     1
 ASSI { 1654}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 59   and name H   ))
      4.300     2.300     1.700 peak  1654 spectrum    1 weight  0.10000E+01 volume  0.74698E-03 ppm1      8.028 ppm2      7.335 CV     1
 ASSI { 1655}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 60   and name H   ))
      4.400     2.400     1.600 peak  1655 spectrum    1 weight  0.10000E+01 volume  0.57548E-03 ppm1      8.029 ppm2      7.236 CV     1
 ASSI { 1656}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 50   and name HZ  ))
      4.600     2.700     1.400 peak  1656 spectrum    1 weight  0.10000E+01 volume  0.73173E-03 ppm1      8.027 ppm2      6.744 CV     1
 ASSI { 1657}
   (( segid "    " and resid 53   and name H   ))
   (  segid "    " and resid 50   and name HE% )
      4.100     2.100     1.900 peak  1657 spectrum    1 weight  0.10000E+01 volume  0.15892E-02 ppm1      8.027 ppm2      6.505 CV     1
 ASSI { 1658}
   (( segid "    " and resid 53   and name H   ))
   (  segid "    " and resid 50   and name HD% )
      4.900     3.000     1.100 peak  1658 spectrum    1 weight  0.10000E+01 volume  0.57548E-03 ppm1      8.030 ppm2      5.504 CV     1
 ASSI { 1659}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 55   and name HA  ))
      2.800     1.000     1.000 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.27725E-02 ppm1      9.265 ppm2      4.928 CV     1
 ASSI { 1662}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 56   and name HD2 ))
      4.800     2.900     1.200 peak  1662 spectrum    1 weight  0.10000E+01 volume  0.81177E-03 ppm1      9.265 ppm2      4.035 CV     1
 ASSI { 1663}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 56   and name HD3 ))
      4.900     2.900     1.100 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.92801E-03 ppm1      9.264 ppm2      3.977 CV     1
 ASSI { 1664}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 54   and name HA  ))
      2.500     0.800     0.800 peak  1664 spectrum    1 weight  0.10000E+01 volume  0.67875E-02 ppm1      8.271 ppm2      4.168 CV     1
 ASSI { 1665}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 52   and name HA  ))
      4.700     2.800     1.300 peak  1665 spectrum    1 weight  0.10000E+01 volume  0.47448E-03 ppm1      8.273 ppm2      3.964 CV     1
 ASSI { 1667}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 55   and name HA  ))
      4.200     2.200     1.800 peak  1667 spectrum    1 weight  0.10000E+01 volume  0.80034E-03 ppm1      8.273 ppm2      4.928 CV     1
 ASSI { 1668}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 53   and name HA  ))
      2.700     0.900     0.900 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.44172E-02 ppm1      8.028 ppm2      4.586 CV     1
 ASSI { 1669}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 54   and name HA  ))
      4.800     2.900     1.200 peak  1669 spectrum    1 weight  0.10000E+01 volume  0.48973E-03 ppm1      8.029 ppm2      4.168 CV     1
 ASSI { 1670}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 52   and name HA  ))
      2.200     0.600     0.600 peak  1670 spectrum    1 weight  0.10000E+01 volume  0.89524E-02 ppm1      8.028 ppm2      3.957 CV     1
 ASSI { 1672}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 52   and name HB3 ))
      2.900     2.900     3.100 peak  1672 spectrum    1 weight  0.10000E+01 volume  0.44399E-03 ppm1      8.273 ppm2      3.703 CV     1
 ASSI { 1674}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 55   and name HB2 ))
      2.300     0.700     0.700 peak  1674 spectrum    1 weight  0.10000E+01 volume  0.41065E-02 ppm1      9.265 ppm2      2.874 CV     1
 ASSI { 1675}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 53   and name HB3 ))
      3.500     1.500     1.500 peak  1675 spectrum    1 weight  0.10000E+01 volume  0.16083E-02 ppm1      9.264 ppm2      2.612 CV     1
 ASSI { 1677}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 55   and name HB3 ))
      3.000     1.100     1.100 peak  1677 spectrum    1 weight  0.10000E+01 volume  0.64619E-02 ppm1      9.265 ppm2      2.452 CV     1
 ASSI { 1678}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 53   and name HB2 ))
      4.500     2.500     1.500 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.12310E-02 ppm1      9.266 ppm2      2.115 CV     1
 ASSI { 1679}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 58   and name HB3 ))
      4.500     2.600     1.500 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.63073E-03 ppm1      9.263 ppm2      1.905 CV     1
 ASSI { 1680}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 58   and name HB2 ))
      3.100     1.200     1.200 peak  1680 spectrum    1 weight  0.10000E+01 volume  0.83273E-03 ppm1      9.266 ppm2      1.711 CV     1
 ASSI { 1682}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 58   and name HB2 ))
      4.200     2.200     1.800 peak  1682 spectrum    1 weight  0.10000E+01 volume  0.35062E-03 ppm1      8.271 ppm2      1.723 CV     1
 ASSI { 1683}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 53   and name HB2 ))
      3.600     1.600     1.600 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.18541E-02 ppm1      8.272 ppm2      2.115 CV     1
 ASSI { 1685}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 54   and name HB2 ))
      2.800     1.000     1.000 peak  1685 spectrum    1 weight  0.10000E+01 volume  0.76641E-02 ppm1      8.271 ppm2      2.455 CV     1
 ASSI { 1686}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 55   and name HB2 ))
      4.300     2.300     1.700 peak  1686 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      8.274 ppm2      2.879 CV     1
 ASSI { 1687}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 53   and name HB3 ))
      2.900     1.000     1.000 peak  1687 spectrum    1 weight  0.10000E+01 volume  0.16940E-02 ppm1      8.269 ppm2      2.612 CV     1
 ASSI { 1688}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 53   and name HB3 ))
      3.100     1.200     1.200 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.27593E-02 ppm1      8.027 ppm2      2.615 CV     1
 ASSI { 1689}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 53   and name HB2 ))
      2.700     0.900     0.900 peak  1689 spectrum    1 weight  0.10000E+01 volume  0.28355E-02 ppm1      8.029 ppm2      2.114 CV     1
 ASSI { 1690}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 58   and name HB2 ))
      4.600     2.700     1.400 peak  1690 spectrum    1 weight  0.10000E+01 volume  0.52211E-03 ppm1      8.027 ppm2      1.721 CV     1
 ASSI { 1691}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 58   and name HG2 ))
      4.500     2.500     1.500 peak  1691 spectrum    1 weight  0.10000E+01 volume  0.57928E-03 ppm1      9.267 ppm2      1.288 CV     1
 ASSI { 1692}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 58   and name HG3 ))
      4.900     3.000     1.100 peak  1692 spectrum    1 weight  0.10000E+01 volume  0.38302E-03 ppm1      9.266 ppm2      1.189 CV     1
 ASSI { 1693}
   (( segid "    " and resid 53   and name H   ))
   (  segid "    " and resid 51   and name HD1%)
      4.000     2.000     2.000 peak  1693 spectrum    1 weight  0.10000E+01 volume  0.45161E-03 ppm1      8.024 ppm2      0.762 CV     1
 ASSI { 1695}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 52   and name HA  ))
      2.800     1.000     1.000 peak  1695 spectrum    1 weight  0.10000E+01 volume  0.24086E-02 ppm1      8.139 ppm2      3.958 CV     1
 ASSI { 1697}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 61   and name HA  ))
      3.800     1.800     1.800 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.86702E-03 ppm1      8.431 ppm2      4.873 CV     1
 ASSI { 1699}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 50   and name H   ))
      5.000     3.100     1.000 peak  1699 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      8.430 ppm2      9.135 CV     1
 ASSI { 1700}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 62   and name H   ))
      4.600     2.600     1.400 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.37540E-03 ppm1      8.428 ppm2      8.786 CV     1
 ASSI { 1701}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 52   and name H   ))
      4.700     2.700     1.300 peak  1701 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      8.432 ppm2      8.138 CV     1
 ASSI { 1702}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 61   and name HE3 ))
      5.700     4.100     0.300 peak  1702 spectrum    1 weight  0.10000E+01 volume  0.24963E-03 ppm1      8.432 ppm2      7.525 CV     1
 ASSI { 1704}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 50   and name HE% )
      4.100     2.100     1.900 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.82893E-03 ppm1      8.139 ppm2      6.504 CV     1
 ASSI { 1705}
   (( segid "    " and resid 51   and name H   ))
   (  segid "    " and resid 50   and name HE% )
      4.400     2.400     1.600 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.45924E-03 ppm1      8.427 ppm2      6.500 CV     1
 ASSI { 1706}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 50   and name HD% )
      3.800     1.800     1.800 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.68410E-03 ppm1      8.138 ppm2      5.504 CV     1
 ASSI { 1707}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 79   and name HA  ))
      3.300     1.400     1.400 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.12081E-02 ppm1      8.137 ppm2      4.895 CV     1
 ASSI { 1710}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 51   and name HB2 ))
      2.700     0.900     0.900 peak  1710 spectrum    1 weight  0.10000E+01 volume  0.15416E-02 ppm1      8.431 ppm2      0.937 CV     1
 ASSI { 1715}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 80   and name HB2 ))
      5.600     4.000     0.400 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.24201E-03 ppm1      8.429 ppm2      1.970 CV     1
 ASSI { 1717}
   (( segid "    " and resid 51   and name H   ))
   (  segid "    " and resid 62   and name HD2%)
      4.600     2.700     1.400 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.53547E-03 ppm1      8.427 ppm2     -0.162 CV     1
 ASSI { 1720}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 61   and name HE3 ))
      3.400     1.500     1.500 peak  1720 spectrum    1 weight  0.10000E+01 volume  0.10233E-02 ppm1      9.079 ppm2      7.516 CV     1
 ASSI { 1721}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 81   and name HD% )
      5.400     3.700     0.600 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.38302E-03 ppm1      9.080 ppm2      6.808 CV     1
 ASSI { 1722}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 61   and name HZ3 ))
      4.100     2.200     1.900 peak  1722 spectrum    1 weight  0.10000E+01 volume  0.59264E-03 ppm1      9.082 ppm2      6.627 CV     1
 ASSI { 1723}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 49   and name HA  ))
      3.200     1.300     1.300 peak  1723 spectrum    1 weight  0.10000E+01 volume  0.95088E-03 ppm1      9.081 ppm2      5.426 CV     1
 ASSI { 1725}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 79   and name HA  ))
      4.600     2.700     1.400 peak  1725 spectrum    1 weight  0.10000E+01 volume  0.38682E-03 ppm1      9.126 ppm2      4.883 CV     1
 ASSI { 1726}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 48   and name HA3 ))
      2.900     1.000     1.000 peak  1726 spectrum    1 weight  0.10000E+01 volume  0.20885E-02 ppm1      9.080 ppm2      4.464 CV     1
 ASSI { 1727}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 48   and name HA2 ))
      2.900     1.100     1.100 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.20409E-02 ppm1      9.078 ppm2      3.936 CV     1
 ASSI { 1728}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 49   and name HG  ))
      3.100     1.200     1.200 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.12215E-02 ppm1      9.080 ppm2      1.775 CV     1
 ASSI { 1729}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 49   and name HB2 ))
      2.600     0.900     0.900 peak  1729 spectrum    1 weight  0.10000E+01 volume  0.14539E-02 ppm1      9.080 ppm2      1.509 CV     1
 ASSI { 1730}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 49   and name HB3 ))
      3.800     1.800     1.800 peak  1730 spectrum    1 weight  0.10000E+01 volume  0.11795E-02 ppm1      9.079 ppm2      1.275 CV     1
 ASSI { 1732}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 80   and name HB3 ))
      4.400     2.400     1.600 peak  1732 spectrum    1 weight  0.10000E+01 volume  0.47448E-03 ppm1      9.129 ppm2      1.980 CV     1
 OR { 1732}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI { 1733}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 49   and name HG  ))
      5.500     3.800     0.500 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.39065E-03 ppm1      9.125 ppm2      1.774 CV     1
 ASSI { 1734}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 49   and name HB2 ))
      4.600     2.700     1.400 peak  1734 spectrum    1 weight  0.10000E+01 volume  0.47448E-03 ppm1      9.124 ppm2      1.486 CV     1
 ASSI { 1735}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 49   and name HB3 ))
      3.600     1.700     1.700 peak  1735 spectrum    1 weight  0.10000E+01 volume  0.10652E-02 ppm1      9.126 ppm2      1.282 CV     1
 ASSI { 1736}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 49   and name HD2%)
      4.000     2.000     2.000 peak  1736 spectrum    1 weight  0.10000E+01 volume  0.10919E-02 ppm1      9.079 ppm2      0.869 CV     1
 ASSI { 1737}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 25   and name HG1%)
      3.300     1.300     1.300 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.18141E-02 ppm1      9.080 ppm2      0.748 CV     1
 ASSI { 1739}
   (( segid "    " and resid 50   and name H   ))
   (  segid "    " and resid 49   and name HD1%)
      5.300     3.500     0.700 peak  1739 spectrum    1 weight  0.10000E+01 volume  0.71460E-03 ppm1      9.127 ppm2      0.745 CV     1
 ASSI { 1740}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 62   and name HD1%)
      5.700     4.000     0.300 peak  1740 spectrum    1 weight  0.10000E+01 volume  0.44019E-03 ppm1      9.081 ppm2      0.398 CV     1
 ASSI { 1741}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 49   and name H   ))
      4.900     2.900     1.100 peak  1741 spectrum    1 weight  0.10000E+01 volume  0.50307E-03 ppm1      8.605 ppm2      9.087 CV     1
 ASSI { 1743}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name H   ))
      4.100     2.100     1.900 peak  1743 spectrum    1 weight  0.10000E+01 volume  0.86702E-03 ppm1      8.608 ppm2      7.508 CV     1
 ASSI { 1744}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 47   and name HE% )
      5.300     3.500     0.700 peak  1744 spectrum    1 weight  0.10000E+01 volume  0.37731E-03 ppm1      8.609 ppm2      7.092 CV     1
 ASSI { 1745}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 81   and name HD% )
      4.600     2.600     1.400 peak  1745 spectrum    1 weight  0.10000E+01 volume  0.37920E-03 ppm1      8.608 ppm2      6.804 CV     1
 ASSI { 1747}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 61   and name HZ3 ))
      3.000     1.100     1.100 peak  1747 spectrum    1 weight  0.10000E+01 volume  0.13720E-02 ppm1      8.609 ppm2      6.624 CV     1
 ASSI { 1748}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 61   and name HH2 ))
      4.100     2.100     1.900 peak  1748 spectrum    1 weight  0.10000E+01 volume  0.55832E-03 ppm1      8.609 ppm2      6.491 CV     1
 ASSI { 1749}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 81   and name HE% )
      5.100     3.300     0.900 peak  1749 spectrum    1 weight  0.10000E+01 volume  0.32203E-03 ppm1      8.613 ppm2      6.310 CV     1
 ASSI { 1750}
   (( segid "    " and resid 47   and name H   ))
   (  segid "    " and resid 47   and name HD% )
      2.900     1.100     1.100 peak  1750 spectrum    1 weight  0.10000E+01 volume  0.37444E-02 ppm1      7.488 ppm2      6.708 CV     1
 ASSI { 1751}
   (( segid "    " and resid 47   and name H   ))
   (  segid "    " and resid 81   and name HE% )
      5.700     4.100     0.300 peak  1751 spectrum    1 weight  0.10000E+01 volume  0.59264E-03 ppm1      7.492 ppm2      6.306 CV     1
 ASSI { 1752}
   (( segid "    " and resid 47   and name H   ))
   (  segid "    " and resid 47   and name HE% )
      4.700     2.700     1.300 peak  1752 spectrum    1 weight  0.10000E+01 volume  0.98138E-03 ppm1      7.490 ppm2      7.091 CV     1
 ASSI { 1753}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 84   and name H   ))
      4.600     2.600     1.400 peak  1753 spectrum    1 weight  0.10000E+01 volume  0.39636E-03 ppm1      7.490 ppm2      8.105 CV     1
 ASSI { 1755}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 46   and name H   ))
      2.700     0.900     0.900 peak  1755 spectrum    1 weight  0.10000E+01 volume  0.33746E-02 ppm1      7.488 ppm2      7.854 CV     1
 ASSI { 1757}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name HA  ))
      2.400     0.700     0.700 peak  1757 spectrum    1 weight  0.10000E+01 volume  0.25363E-02 ppm1      8.609 ppm2      4.873 CV     1
 ASSI { 1758}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 48   and name HA3 ))
      2.900     1.000     1.000 peak  1758 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      8.608 ppm2      4.469 CV     1
 ASSI { 1759}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 48   and name HA2 ))
      3.500     1.500     1.500 peak  1759 spectrum    1 weight  0.10000E+01 volume  0.10805E-02 ppm1      8.609 ppm2      3.938 CV     1
 ASSI { 1760}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 45   and name HA  ))
      3.500     1.500     1.500 peak  1760 spectrum    1 weight  0.10000E+01 volume  0.13282E-02 ppm1      7.488 ppm2      4.623 CV     1
 ASSI { 1761}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 46   and name HA  ))
      3.000     1.100     1.100 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.25477E-02 ppm1      7.488 ppm2      4.475 CV     1
 ASSI { 1762}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 44   and name HA  ))
      4.000     2.000     2.000 peak  1762 spectrum    1 weight  0.10000E+01 volume  0.67265E-03 ppm1      7.490 ppm2      4.229 CV     1
 ASSI { 1763}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 47   and name HA  ))
      2.900     1.000     1.000 peak  1763 spectrum    1 weight  0.10000E+01 volume  0.16254E-02 ppm1      7.489 ppm2      4.871 CV     1
 ASSI { 1764}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 83   and name HA  ))
      4.800     2.900     1.200 peak  1764 spectrum    1 weight  0.10000E+01 volume  0.59835E-03 ppm1      7.490 ppm2      3.527 CV     1
 ASSI { 1768}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 46   and name HB3 ))
      4.100     2.100     1.900 peak  1768 spectrum    1 weight  0.10000E+01 volume  0.11376E-02 ppm1      7.487 ppm2      2.646 CV     1
 ASSI { 1769}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 47   and name HB2 ))
      2.700     0.900     0.900 peak  1769 spectrum    1 weight  0.10000E+01 volume  0.25649E-02 ppm1      7.488 ppm2      2.544 CV     1
 ASSI { 1770}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 46   and name HB2 ))
      3.800     1.800     1.800 peak  1770 spectrum    1 weight  0.10000E+01 volume  0.12462E-02 ppm1      7.489 ppm2      2.326 CV     1
 ASSI { 1771}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 43   and name HG2 ))
      4.800     2.800     1.200 peak  1771 spectrum    1 weight  0.10000E+01 volume  0.55070E-03 ppm1      7.490 ppm2      1.982 CV     1
 OR { 1771}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 43   and name HB2 ))
 ASSI { 1772}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 47   and name HB3 ))
      3.700     1.700     1.700 peak  1772 spectrum    1 weight  0.10000E+01 volume  0.21400E-02 ppm1      7.488 ppm2      1.850 CV     1
 ASSI { 1773}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name HB2 ))
      4.300     2.300     1.700 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.98900E-03 ppm1      8.609 ppm2      2.547 CV     1
 ASSI { 1774}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 84   and name HE3 ))
      5.000     3.100     1.000 peak  1774 spectrum    1 weight  0.10000E+01 volume  0.39254E-03 ppm1      8.608 ppm2      2.350 CV     1
 OR { 1774}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 84   and name HE2 ))
 ASSI { 1775}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name HB3 ))
      3.200     1.300     1.300 peak  1775 spectrum    1 weight  0.10000E+01 volume  0.12939E-02 ppm1      8.607 ppm2      1.849 CV     1
 ASSI { 1777}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 84   and name HG3 ))
      4.300     2.300     1.700 peak  1777 spectrum    1 weight  0.10000E+01 volume  0.41923E-03 ppm1      8.614 ppm2      0.038 CV     1
 ASSI { 1778}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 84   and name HD2 ))
      5.200     3.400     0.800 peak  1778 spectrum    1 weight  0.10000E+01 volume  0.27820E-03 ppm1      7.489 ppm2      1.049 CV     1
 OR { 1778}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 84   and name HD3 ))
 ASSI { 1779}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 83   and name HG3 ))
      4.500     2.600     1.500 peak  1779 spectrum    1 weight  0.10000E+01 volume  0.38491E-03 ppm1      7.492 ppm2      0.913 CV     1
 ASSI { 1780}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 84   and name HD3 ))
      4.800     2.900     1.200 peak  1780 spectrum    1 weight  0.10000E+01 volume  0.33919E-03 ppm1      8.608 ppm2      1.055 CV     1
 ASSI { 1781}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 82   and name HG3 ))
      4.000     2.000     2.000 peak  1781 spectrum    1 weight  0.10000E+01 volume  0.42303E-03 ppm1      8.609 ppm2      1.526 CV     1
 ASSI { 1782}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 84   and name HG2 ))
      4.900     3.000     1.100 peak  1782 spectrum    1 weight  0.10000E+01 volume  0.30108E-03 ppm1      7.491 ppm2      0.553 CV     1
 ASSI { 1783}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 84   and name HG3 ))
      4.500     2.600     1.500 peak  1783 spectrum    1 weight  0.10000E+01 volume  0.32586E-03 ppm1      7.491 ppm2      0.037 CV     1
 ASSI { 1784}
   (( segid "    " and resid 46   and name H   ))
   (  segid "    " and resid 47   and name HD% )
      2.800     1.000     1.000 peak  1784 spectrum    1 weight  0.10000E+01 volume  0.21476E-02 ppm1      7.852 ppm2      6.709 CV     1
 ASSI { 1785}
   (( segid "    " and resid 46   and name H   ))
   (  segid "    " and resid 47   and name HE% )
      4.400     2.500     1.600 peak  1785 spectrum    1 weight  0.10000E+01 volume  0.80034E-03 ppm1      7.850 ppm2      7.084 CV     1
 ASSI { 1788}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 46   and name H   ))
      2.700     0.900     0.900 peak  1788 spectrum    1 weight  0.10000E+01 volume  0.22581E-02 ppm1      8.558 ppm2      7.854 CV     1
 ASSI { 1790}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 47   and name H   ))
      4.700     2.800     1.300 peak  1790 spectrum    1 weight  0.10000E+01 volume  0.65743E-03 ppm1      8.558 ppm2      7.491 CV     1
 ASSI { 1791}
   (( segid "    " and resid 45   and name H   ))
   (  segid "    " and resid 47   and name HD% )
      4.600     2.600     1.400 peak  1791 spectrum    1 weight  0.10000E+01 volume  0.45924E-03 ppm1      8.560 ppm2      6.714 CV     1
 ASSI { 1792}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 45   and name HA  ))
      2.800     0.900     0.900 peak  1792 spectrum    1 weight  0.10000E+01 volume  0.42019E-02 ppm1      8.558 ppm2      4.625 CV     1
 ASSI { 1793}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 46   and name HA  ))
      5.000     3.100     1.000 peak  1793 spectrum    1 weight  0.10000E+01 volume  0.63647E-03 ppm1      8.558 ppm2      4.472 CV     1
 ASSI { 1794}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 44   and name HA  ))
      3.100     1.200     1.200 peak  1794 spectrum    1 weight  0.10000E+01 volume  0.15130E-02 ppm1      8.557 ppm2      4.228 CV     1
 ASSI { 1795}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 44   and name HD2 ))
      3.100     1.200     1.200 peak  1795 spectrum    1 weight  0.10000E+01 volume  0.12996E-02 ppm1      8.559 ppm2      3.799 CV     1
 ASSI { 1796}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 43   and name HA  ))
      3.800     1.800     1.800 peak  1796 spectrum    1 weight  0.10000E+01 volume  0.70126E-03 ppm1      8.557 ppm2      4.697 CV     1
 ASSI { 1798}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 46   and name HA  ))
      2.700     0.900     0.900 peak  1798 spectrum    1 weight  0.10000E+01 volume  0.40055E-02 ppm1      7.853 ppm2      4.476 CV     1
 ASSI { 1799}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 47   and name HA  ))
      4.500     2.500     1.500 peak  1799 spectrum    1 weight  0.10000E+01 volume  0.45732E-03 ppm1      7.853 ppm2      4.871 CV     1
 ASSI { 1800}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 44   and name HA  ))
      3.500     1.600     1.600 peak  1800 spectrum    1 weight  0.10000E+01 volume  0.90323E-03 ppm1      7.853 ppm2      4.232 CV     1
 ASSI { 1801}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 43   and name HD3 ))
      4.800     2.900     1.200 peak  1801 spectrum    1 weight  0.10000E+01 volume  0.64027E-03 ppm1      7.850 ppm2      3.679 CV     1
 OR { 1801}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 43   and name HD2 ))
 ASSI { 1802}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 45   and name HB2 ))
      2.300     0.700     0.700 peak  1802 spectrum    1 weight  0.10000E+01 volume  0.67495E-02 ppm1      8.558 ppm2      2.751 CV     1
 ASSI { 1803}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 43   and name HB3 ))
      4.300     2.300     1.700 peak  1803 spectrum    1 weight  0.10000E+01 volume  0.10957E-02 ppm1      8.558 ppm2      2.325 CV     1
 ASSI { 1804}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 44   and name HB2 ))
      3.400     1.400     1.400 peak  1804 spectrum    1 weight  0.10000E+01 volume  0.14215E-02 ppm1      8.557 ppm2      2.160 CV     1
 ASSI { 1805}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 44   and name HG2 ))
      2.900     1.100     1.100 peak  1805 spectrum    1 weight  0.10000E+01 volume  0.18274E-02 ppm1      8.558 ppm2      2.075 CV     1
 ASSI { 1806}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 43   and name HB2 ))
      2.500     0.800     0.800 peak  1806 spectrum    1 weight  0.10000E+01 volume  0.36491E-02 ppm1      8.558 ppm2      1.990 CV     1
 ASSI { 1807}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 44   and name HG3 ))
      4.200     2.200     1.800 peak  1807 spectrum    1 weight  0.10000E+01 volume  0.13282E-02 ppm1      8.558 ppm2      1.898 CV     1
 ASSI { 1808}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 43   and name HB2 ))
      3.000     1.100     1.100 peak  1808 spectrum    1 weight  0.10000E+01 volume  0.19227E-02 ppm1      7.852 ppm2      1.983 CV     1
 OR { 1808}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI { 1809}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 46   and name HB2 ))
      2.500     0.800     0.800 peak  1809 spectrum    1 weight  0.10000E+01 volume  0.36015E-02 ppm1      7.853 ppm2      2.323 CV     1
 ASSI { 1810}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 45   and name HB2 ))
      3.200     1.300     1.300 peak  1810 spectrum    1 weight  0.10000E+01 volume  0.19437E-02 ppm1      7.852 ppm2      2.751 CV     1
 ASSI { 1811}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 46   and name HB3 ))
      3.400     1.500     1.500 peak  1811 spectrum    1 weight  0.10000E+01 volume  0.32452E-02 ppm1      7.852 ppm2      2.649 CV     1
 ASSI { 1812}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 47   and name HB2 ))
      3.900     1.900     1.900 peak  1812 spectrum    1 weight  0.10000E+01 volume  0.66694E-03 ppm1      7.854 ppm2      2.547 CV     1
 ASSI { 1813}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 41   and name H   ))
      2.500     0.800     0.800 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.73382E-02 ppm1      7.585 ppm2      7.353 CV     1
 ASSI { 1815}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 39   and name H   ))
      3.700     1.700     1.700 peak  1815 spectrum    1 weight  0.10000E+01 volume  0.78701E-03 ppm1      7.350 ppm2      8.004 CV     1
 ASSI { 1816}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 39   and name H   ))
      2.500     0.800     0.800 peak  1816 spectrum    1 weight  0.10000E+01 volume  0.34452E-02 ppm1      7.365 ppm2      8.003 CV     1
 ASSI { 1817}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 42   and name H   ))
      5.000     3.100     1.000 peak  1817 spectrum    1 weight  0.10000E+01 volume  0.31824E-03 ppm1      7.360 ppm2      7.584 CV     1
 ASSI { 1818}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 38   and name H   ))
      4.400     2.400     1.600 peak  1818 spectrum    1 weight  0.10000E+01 volume  0.48973E-03 ppm1      7.366 ppm2      9.469 CV     1
 ASSI { 1819}
   (( segid "    " and resid 42   and name H   ))
   (  segid "    " and resid 81   and name HE% )
      5.400     3.700     0.600 peak  1819 spectrum    1 weight  0.10000E+01 volume  0.38491E-03 ppm1      7.589 ppm2      6.305 CV     1
 ASSI { 1820}
   (( segid "    " and resid 42   and name H   ))
   (  segid "    " and resid 47   and name HD% )
      3.500     1.600     1.600 peak  1820 spectrum    1 weight  0.10000E+01 volume  0.17055E-02 ppm1      7.584 ppm2      6.718 CV     1
 ASSI { 1821}
   (( segid "    " and resid 42   and name H   ))
   (  segid "    " and resid 47   and name HE% )
      3.100     1.200     1.200 peak  1821 spectrum    1 weight  0.10000E+01 volume  0.34814E-02 ppm1      7.585 ppm2      7.087 CV     1
 ASSI { 1822}
   (( segid "    " and resid 41   and name H   ))
   (  segid "    " and resid 47   and name HE% )
      3.800     1.800     1.800 peak  1822 spectrum    1 weight  0.10000E+01 volume  0.72411E-03 ppm1      7.350 ppm2      7.096 CV     1
 ASSI { 1823}
   (( segid "    " and resid 41   and name H   ))
   (  segid "    " and resid 47   and name HD% )
      4.700     2.700     1.300 peak  1823 spectrum    1 weight  0.10000E+01 volume  0.41161E-03 ppm1      7.352 ppm2      6.730 CV     1
 ASSI { 1824}
   (( segid "    " and resid 41   and name H   ))
   (  segid "    " and resid 81   and name HE% )
      5.000     3.200     1.000 peak  1824 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      7.348 ppm2      6.313 CV     1
 ASSI { 1825}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name HA  ))
      4.100     2.100     1.900 peak  1825 spectrum    1 weight  0.10000E+01 volume  0.53736E-03 ppm1      7.585 ppm2      4.706 CV     1
 ASSI { 1826}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name HD3 ))
      3.300     1.400     1.400 peak  1826 spectrum    1 weight  0.10000E+01 volume  0.39732E-02 ppm1      7.585 ppm2      3.672 CV     1
 OR { 1826}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name HD2 ))
 ASSI { 1827}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 42   and name HA2 ))
      2.200     0.600     0.600 peak  1827 spectrum    1 weight  0.10000E+01 volume  0.17066E-01 ppm1      7.585 ppm2      4.233 CV     1
 ASSI { 1828}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 42   and name HA3 ))
      2.400     0.700     0.700 peak  1828 spectrum    1 weight  0.10000E+01 volume  0.80319E-02 ppm1      7.585 ppm2      4.087 CV     1
 ASSI { 1829}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 40   and name HA  ))
      2.400     0.700     0.700 peak  1829 spectrum    1 weight  0.10000E+01 volume  0.39750E-02 ppm1      7.365 ppm2      4.216 CV     1
 ASSI { 1830}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 39   and name HA  ))
      3.000     1.100     1.100 peak  1830 spectrum    1 weight  0.10000E+01 volume  0.22390E-02 ppm1      7.365 ppm2      4.017 CV     1
 ASSI { 1831}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 38   and name HA  ))
      3.600     1.600     1.600 peak  1831 spectrum    1 weight  0.10000E+01 volume  0.10347E-02 ppm1      7.364 ppm2      3.920 CV     1
 ASSI { 1832}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 41   and name HA  ))
      2.200     0.600     0.600 peak  1832 spectrum    1 weight  0.10000E+01 volume  0.13688E-01 ppm1      7.349 ppm2      4.221 CV     1
 ASSI { 1833}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 42   and name HA3 ))
      4.800     2.900     1.200 peak  1833 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      7.347 ppm2      4.106 CV     1
 ASSI { 1834}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 39   and name HA  ))
      3.300     1.400     1.400 peak  1834 spectrum    1 weight  0.10000E+01 volume  0.11395E-02 ppm1      7.351 ppm2      4.016 CV     1
 ASSI { 1835}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 38   and name HA  ))
      3.700     1.700     1.700 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.80034E-03 ppm1      7.350 ppm2      3.920 CV     1
 ASSI { 1837}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 40   and name HB2 ))
      3.500     1.500     1.500 peak  1837 spectrum    1 weight  0.10000E+01 volume  0.19970E-02 ppm1      7.350 ppm2      1.702 CV     1
 ASSI { 1838}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 40   and name HB3 ))
      3.600     1.600     1.600 peak  1838 spectrum    1 weight  0.10000E+01 volume  0.21685E-02 ppm1      7.350 ppm2      1.555 CV     1
 ASSI { 1839}
   (( segid "    " and resid 41   and name H   ))
   (  segid "    " and resid 39   and name HB% )
      4.500     2.500     1.500 peak  1839 spectrum    1 weight  0.10000E+01 volume  0.77365E-03 ppm1      7.352 ppm2      1.106 CV     1
 ASSI { 1840}
   (( segid "    " and resid 40   and name H   ))
   (  segid "    " and resid 41   and name HB% )
      4.200     2.200     1.800 peak  1840 spectrum    1 weight  0.10000E+01 volume  0.10290E-02 ppm1      7.365 ppm2      1.355 CV     1
 ASSI { 1842}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 36   and name HB  ))
      2.800     2.800     3.200 peak  1842 spectrum    1 weight  0.10000E+01 volume  0.47831E-03 ppm1      7.363 ppm2      1.896 CV     1
 ASSI { 1844}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 40   and name HG  ))
      3.200     1.300     1.300 peak  1844 spectrum    1 weight  0.10000E+01 volume  0.48420E-02 ppm1      7.365 ppm2      1.608 CV     1
 ASSI { 1845}
   (( segid "    " and resid 42   and name H   ))
   (  segid "    " and resid 41   and name HB% )
      2.800     1.000     1.000 peak  1845 spectrum    1 weight  0.10000E+01 volume  0.79577E-02 ppm1      7.585 ppm2      1.354 CV     1
 ASSI { 1846}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 40   and name HB2 ))
      3.200     1.200     1.200 peak  1846 spectrum    1 weight  0.10000E+01 volume  0.10519E-02 ppm1      7.586 ppm2      1.700 CV     1
 ASSI { 1847}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 40   and name HB3 ))
      4.400     2.500     1.600 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.97375E-03 ppm1      7.585 ppm2      1.551 CV     1
 ASSI { 1848}
   (( segid "    " and resid 42   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
      4.600     2.600     1.400 peak  1848 spectrum    1 weight  0.10000E+01 volume  0.88800E-03 ppm1      7.586 ppm2      0.845 CV     1
 ASSI { 1850}
   (( segid "    " and resid 41   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
      3.300     1.400     1.400 peak  1850 spectrum    1 weight  0.10000E+01 volume  0.14978E-02 ppm1      7.349 ppm2      0.849 CV     1
 ASSI { 1851}
   (( segid "    " and resid 41   and name H   ))
   (  segid "    " and resid 40   and name HD2%)
      3.000     1.200     1.200 peak  1851 spectrum    1 weight  0.10000E+01 volume  0.22943E-02 ppm1      7.350 ppm2      0.735 CV     1
 ASSI { 1852}
   (( segid "    " and resid 40   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
      2.000     0.500     0.500 peak  1852 spectrum    1 weight  0.10000E+01 volume  0.33558E-02 ppm1      7.365 ppm2      0.845 CV     1
 ASSI { 1853}
   (( segid "    " and resid 40   and name H   ))
   (  segid "    " and resid 40   and name HD2%)
      3.200     1.300     1.300 peak  1853 spectrum    1 weight  0.10000E+01 volume  0.24334E-02 ppm1      7.366 ppm2      0.735 CV     1
 ASSI { 1854}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 40   and name HB3 ))
      2.600     0.800     0.800 peak  1854 spectrum    1 weight  0.10000E+01 volume  0.32718E-02 ppm1      7.366 ppm2      1.548 CV     1
 ASSI { 1856}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 39   and name H   ))
      2.800     1.000     1.000 peak  1856 spectrum    1 weight  0.10000E+01 volume  0.17531E-02 ppm1      9.468 ppm2      8.001 CV     1
 ASSI { 1859}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 81   and name HE% )
      5.200     3.300     0.800 peak  1859 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      7.988 ppm2      6.311 CV     1
 ASSI { 1860}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 36   and name HA  ))
      3.900     1.900     1.900 peak  1860 spectrum    1 weight  0.10000E+01 volume  0.70315E-03 ppm1      9.469 ppm2      4.508 CV     1
 ASSI { 1862}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 39   and name HA  ))
      5.200     3.300     0.800 peak  1862 spectrum    1 weight  0.10000E+01 volume  0.34873E-03 ppm1      9.471 ppm2      4.020 CV     1
 ASSI { 1864}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 37   and name HD2 ))
      2.800     1.000     1.000 peak  1864 spectrum    1 weight  0.10000E+01 volume  0.15359E-02 ppm1      9.470 ppm2      3.752 CV     1
 ASSI { 1868}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 2    and name HA  ))
      2.300     0.700     0.700 peak  1868 spectrum    1 weight  0.10000E+01 volume  0.10744E-01 ppm1      7.975 ppm2      4.115 CV     1
 ASSI { 1869}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 36   and name HA  ))
      2.900     1.000     1.000 peak  1869 spectrum    1 weight  0.10000E+01 volume  0.16979E-02 ppm1      7.976 ppm2      4.509 CV     1
 ASSI { 1874}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 38   and name HB3 ))
      3.300     1.400     1.400 peak  1874 spectrum    1 weight  0.10000E+01 volume  0.28451E-02 ppm1      9.469 ppm2      1.912 CV     1
 ASSI { 1875}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 38   and name HB2 ))
      2.500     0.800     0.800 peak  1875 spectrum    1 weight  0.10000E+01 volume  0.37540E-02 ppm1      9.469 ppm2      1.794 CV     1
 ASSI { 1877}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 38   and name HG2 ))
      4.200     2.200     1.800 peak  1877 spectrum    1 weight  0.10000E+01 volume  0.80797E-03 ppm1      8.003 ppm2      2.244 CV     1
 ASSI { 1878}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 21   and name HG3 ))
      3.800     1.800     1.800 peak  1878 spectrum    1 weight  0.10000E+01 volume  0.23781E-02 ppm1      7.975 ppm2      1.952 CV     1
 ASSI { 1880}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 38   and name HB2 ))
      3.300     1.400     1.400 peak  1880 spectrum    1 weight  0.10000E+01 volume  0.12329E-02 ppm1      8.004 ppm2      1.788 CV     1
 ASSI { 1881}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 35   and name HG3 ))
      2.600     0.900     0.900 peak  1881 spectrum    1 weight  0.10000E+01 volume  0.27210E-02 ppm1      7.978 ppm2      1.673 CV     1
 OR { 1881}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 35   and name HG2 ))
 OR { 1881}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 35   and name HB3 ))
 ASSI { 1882}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 36   and name HG13))
      2.300     0.700     0.700 peak  1882 spectrum    1 weight  0.10000E+01 volume  0.19989E-02 ppm1      7.977 ppm2      1.476 CV     1
 ASSI { 1886}
   (( segid "    " and resid 2    and name H   ))
   (  segid "    " and resid 2    and name HG2%)
      2.200     0.600     0.600 peak  1886 spectrum    1 weight  0.10000E+01 volume  0.16973E-01 ppm1      7.975 ppm2      0.865 CV     1
 OR { 1886}
   (( segid "    " and resid 2    and name H   ))
   (  segid "    " and resid 2    and name HG1%)
 ASSI { 1890}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 32   and name HD1%)
      4.800     2.800     1.200 peak  1890 spectrum    1 weight  0.10000E+01 volume  0.74698E-03 ppm1      7.979 ppm2      0.109 CV     1
 ASSI { 1892}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 3    and name H   ))
      2.500     0.800     0.800 peak  1892 spectrum    1 weight  0.10000E+01 volume  0.73935E-02 ppm1      7.974 ppm2      7.849 CV     1
 ASSI { 1894}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 35   and name H   ))
      2.500     0.800     0.800 peak  1894 spectrum    1 weight  0.10000E+01 volume  0.33291E-02 ppm1      7.976 ppm2      7.517 CV     1
 ASSI { 1897}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 35   and name H   ))
      2.700     0.900     0.900 peak  1897 spectrum    1 weight  0.10000E+01 volume  0.23057E-02 ppm1      7.626 ppm2      7.513 CV     1
 ASSI { 1898}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 33   and name H   ))
      2.700     0.900     0.900 peak  1898 spectrum    1 weight  0.10000E+01 volume  0.18674E-02 ppm1      7.626 ppm2      7.458 CV     1
 ASSI { 1899}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 36   and name H   ))
      3.900     1.900     1.900 peak  1899 spectrum    1 weight  0.10000E+01 volume  0.74506E-03 ppm1      7.630 ppm2      7.981 CV     1
 ASSI { 1901}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 31   and name HA  ))
      3.400     1.400     1.400 peak  1901 spectrum    1 weight  0.10000E+01 volume  0.13053E-02 ppm1      7.626 ppm2      3.864 CV     1
 ASSI { 1902}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 36   and name HA  ))
      5.000     3.200     1.000 peak  1902 spectrum    1 weight  0.10000E+01 volume  0.34682E-03 ppm1      7.518 ppm2      4.508 CV     1
 ASSI { 1903}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 35   and name HA  ))
      2.700     0.900     0.900 peak  1903 spectrum    1 weight  0.10000E+01 volume  0.29136E-02 ppm1      7.516 ppm2      4.331 CV     1
 ASSI { 1906}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 33   and name HA  ))
      3.300     1.400     1.400 peak  1906 spectrum    1 weight  0.10000E+01 volume  0.10138E-02 ppm1      7.626 ppm2      3.553 CV     1
 ASSI { 1907}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
      3.700     1.700     1.700 peak  1907 spectrum    1 weight  0.10000E+01 volume  0.61740E-03 ppm1      7.627 ppm2      3.240 CV     1
 ASSI { 1908}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 33   and name HA  ))
      3.900     1.900     1.900 peak  1908 spectrum    1 weight  0.10000E+01 volume  0.50115E-03 ppm1      7.520 ppm2      3.552 CV     1
 ASSI { 1909}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
      3.700     1.700     1.700 peak  1909 spectrum    1 weight  0.10000E+01 volume  0.66123E-03 ppm1      7.519 ppm2      3.230 CV     1
 ASSI { 1912}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 1    and name HG3 ))
      4.100     2.100     1.900 peak  1912 spectrum    1 weight  0.10000E+01 volume  0.80414E-03 ppm1      7.976 ppm2      2.530 CV     1
 ASSI { 1913}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 1    and name HG2 ))
      2.600     2.600     3.400 peak  1913 spectrum    1 weight  0.10000E+01 volume  0.84417E-03 ppm1      7.974 ppm2      2.468 CV     1
 ASSI { 1914}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 2    and name HB  ))
      2.900     1.000     1.000 peak  1914 spectrum    1 weight  0.10000E+01 volume  0.92744E-02 ppm1      7.974 ppm2      2.059 CV     1
 ASSI { 1915}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 35   and name HG2 ))
      1.900     0.500     0.500 peak  1915 spectrum    1 weight  0.10000E+01 volume  0.48934E-02 ppm1      7.517 ppm2      1.670 CV     1
 ASSI { 1916}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 34   and name HG3 ))
      4.500     2.600     1.500 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.57928E-03 ppm1      7.514 ppm2      2.436 CV     1
 ASSI { 1919}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 35   and name HB2 ))
      3.300     1.400     1.400 peak  1919 spectrum    1 weight  0.10000E+01 volume  0.25820E-02 ppm1      7.516 ppm2      1.882 CV     1
 ASSI { 1920}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 36   and name HG13))
      4.600     2.600     1.400 peak  1920 spectrum    1 weight  0.10000E+01 volume  0.61740E-03 ppm1      7.515 ppm2      1.480 CV     1
 ASSI { 1922}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 34   and name HB3 ))
      2.600     0.800     0.800 peak  1922 spectrum    1 weight  0.10000E+01 volume  0.39065E-02 ppm1      7.627 ppm2      2.032 CV     1
 ASSI { 1923}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 34   and name HB2 ))
      2.700     0.900     0.900 peak  1923 spectrum    1 weight  0.10000E+01 volume  0.36302E-02 ppm1      7.627 ppm2      1.947 CV     1
 ASSI { 1924}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 33   and name HB3 ))
      3.100     1.200     1.200 peak  1924 spectrum    1 weight  0.10000E+01 volume  0.26849E-02 ppm1      7.627 ppm2      1.697 CV     1
 ASSI { 1925}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 36   and name HG13))
      5.200     3.300     0.800 peak  1925 spectrum    1 weight  0.10000E+01 volume  0.42112E-03 ppm1      7.623 ppm2      1.476 CV     1
 ASSI { 1927}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 33   and name HG3 ))
      3.900     1.900     1.900 peak  1927 spectrum    1 weight  0.10000E+01 volume  0.66694E-03 ppm1      7.628 ppm2      1.140 CV     1
 OR { 1927}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 33   and name HG2 ))
 ASSI { 1928}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 39   and name HB% )
      5.300     3.500     0.700 peak  1928 spectrum    1 weight  0.10000E+01 volume  0.33348E-03 ppm1      7.520 ppm2      1.107 CV     1
 ASSI { 1929}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 36   and name HG12))
      5.900     4.400     0.100 peak  1929 spectrum    1 weight  0.10000E+01 volume  0.48591E-03 ppm1      7.517 ppm2      0.887 CV     1
 ASSI { 1930}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
      5.100     3.200     0.900 peak  1930 spectrum    1 weight  0.10000E+01 volume  0.44019E-03 ppm1      7.518 ppm2      0.732 CV     1
 ASSI { 1931}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
      5.700     4.100     0.300 peak  1931 spectrum    1 weight  0.10000E+01 volume  0.47831E-03 ppm1      7.517 ppm2      0.670 CV     1
 ASSI { 1933}
   (( segid "    " and resid 34   and name H   ))
   (  segid "    " and resid 32   and name HD1%)
      5.800     4.100     0.200 peak  1933 spectrum    1 weight  0.10000E+01 volume  0.33919E-03 ppm1      7.628 ppm2      0.110 CV     1
 ASSI { 1934}
   (( segid "    " and resid 34   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
      4.800     2.800     1.200 peak  1934 spectrum    1 weight  0.10000E+01 volume  0.66694E-03 ppm1      7.626 ppm2      0.735 CV     1
 ASSI { 1936}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 32   and name H   ))
      4.400     2.400     1.600 peak  1936 spectrum    1 weight  0.10000E+01 volume  0.29916E-03 ppm1      7.626 ppm2      8.090 CV     1
 ASSI { 1940}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 29   and name HA  ))
      4.000     2.000     2.000 peak  1940 spectrum    1 weight  0.10000E+01 volume  0.99280E-03 ppm1      8.089 ppm2      3.921 CV     1
 ASSI { 1942}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
      3.500     1.500     1.500 peak  1942 spectrum    1 weight  0.10000E+01 volume  0.94135E-03 ppm1      7.450 ppm2      3.236 CV     1
 ASSI { 1943}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
      3.000     1.100     1.100 peak  1943 spectrum    1 weight  0.10000E+01 volume  0.12958E-02 ppm1      8.089 ppm2      3.228 CV     1
 ASSI { 1944}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 33   and name HD2 ))
      4.700     2.800     1.300 peak  1944 spectrum    1 weight  0.10000E+01 volume  0.59264E-03 ppm1      7.450 ppm2      3.026 CV     1
 OR { 1944}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 33   and name HD3 ))
 ASSI { 1945}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 34   and name HB2 ))
      4.300     2.300     1.700 peak  1945 spectrum    1 weight  0.10000E+01 volume  0.95468E-03 ppm1      7.452 ppm2      1.949 CV     1
 ASSI { 1946}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 33   and name HB2 ))
      2.600     0.900     0.900 peak  1946 spectrum    1 weight  0.10000E+01 volume  0.33633E-02 ppm1      7.450 ppm2      1.710 CV     1
 OR { 1946}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 33   and name HB3 ))
 ASSI { 1948}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 32   and name HB  ))
      2.800     1.000     1.000 peak  1948 spectrum    1 weight  0.10000E+01 volume  0.16521E-02 ppm1      8.090 ppm2      1.574 CV     1
 ASSI { 1950}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 31   and name HB2 ))
      2.600     0.900     0.900 peak  1950 spectrum    1 weight  0.10000E+01 volume  0.15569E-02 ppm1      8.089 ppm2      1.969 CV     1
 ASSI { 1951}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 33   and name HG3 ))
      3.100     1.200     1.200 peak  1951 spectrum    1 weight  0.10000E+01 volume  0.11681E-02 ppm1      7.448 ppm2      1.143 CV     1
 OR { 1951}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 33   and name HG2 ))
 ASSI { 1952}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 32   and name HG12))
      4.300     2.300     1.700 peak  1952 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      7.447 ppm2      0.993 CV     1
 OR { 1952}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 32   and name HG13))
 ASSI { 1954}
   (( segid "    " and resid 33   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
      5.000     3.100     1.000 peak  1954 spectrum    1 weight  0.10000E+01 volume  0.31632E-03 ppm1      7.451 ppm2      0.853 CV     1
 ASSI { 1958}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 27   and name HA  ))
      3.800     1.800     1.800 peak  1958 spectrum    1 weight  0.10000E+01 volume  0.11071E-02 ppm1      7.349 ppm2      4.631 CV     1
 ASSI { 1959}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 30   and name HA  ))
      5.100     3.300     0.900 peak  1959 spectrum    1 weight  0.10000E+01 volume  0.52211E-03 ppm1      7.348 ppm2      3.806 CV     1
 ASSI { 1960}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 30   and name HD3 ))
      2.900     1.100     1.100 peak  1960 spectrum    1 weight  0.10000E+01 volume  0.21914E-02 ppm1      7.348 ppm2      3.230 CV     1
 ASSI { 1961}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 30   and name HD2 ))
      2.800     1.000     1.000 peak  1961 spectrum    1 weight  0.10000E+01 volume  0.28050E-02 ppm1      7.348 ppm2      3.152 CV     1
 ASSI { 1962}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 30   and name HB2 ))
      3.400     1.400     1.400 peak  1962 spectrum    1 weight  0.10000E+01 volume  0.11395E-02 ppm1      7.348 ppm2      2.108 CV     1
 ASSI { 1963}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 27   and name HB3 ))
      3.800     1.800     1.800 peak  1963 spectrum    1 weight  0.10000E+01 volume  0.54499E-03 ppm1      7.349 ppm2      2.606 CV     1
 ASSI { 1964}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 30   and name HG3 ))
      3.200     1.300     1.300 peak  1964 spectrum    1 weight  0.10000E+01 volume  0.11967E-02 ppm1      7.349 ppm2      1.658 CV     1
 ASSI { 1965}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 30   and name HG2 ))
      3.300     1.400     1.400 peak  1965 spectrum    1 weight  0.10000E+01 volume  0.10747E-02 ppm1      7.349 ppm2      1.472 CV     1
 ASSI { 1966}
   (( segid "    " and resid 30   and name HE  ))
   (( segid "    " and resid 30   and name HB3 ))
      3.600     1.600     1.600 peak  1966 spectrum    1 weight  0.10000E+01 volume  0.10233E-02 ppm1      7.349 ppm2      1.861 CV     1
 ASSI { 1967}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 28   and name H   ))
      4.000     2.000     2.000 peak  1967 spectrum    1 weight  0.10000E+01 volume  0.45544E-03 ppm1      7.177 ppm2      8.611 CV     1
 ASSI { 1968}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 31   and name H   ))
      2.700     0.900     0.900 peak  1968 spectrum    1 weight  0.10000E+01 volume  0.19951E-02 ppm1      7.178 ppm2      8.328 CV     1
 ASSI { 1969}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 29   and name H   ))
      2.900     1.000     1.000 peak  1969 spectrum    1 weight  0.10000E+01 volume  0.18427E-02 ppm1      7.177 ppm2      8.213 CV     1
 ASSI { 1970}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 32   and name H   ))
      4.300     2.300     1.700 peak  1970 spectrum    1 weight  0.10000E+01 volume  0.40778E-03 ppm1      7.178 ppm2      8.088 CV     1
 ASSI { 1971}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 27   and name H   ))
      4.300     2.400     1.700 peak  1971 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      7.176 ppm2      6.717 CV     1
 ASSI { 1972}
   (( segid "    " and resid 30   and name H   ))
   (  segid "    " and resid 81   and name HE% )
      5.000     3.200     1.000 peak  1972 spectrum    1 weight  0.10000E+01 volume  0.41541E-03 ppm1      7.178 ppm2      6.308 CV     1
 ASSI { 1973}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 30   and name HE  ))
      5.600     3.900     0.400 peak  1973 spectrum    1 weight  0.10000E+01 volume  0.28012E-03 ppm1      7.179 ppm2      7.354 CV     1
 ASSI { 1974}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
      3.200     1.300     1.300 peak  1974 spectrum    1 weight  0.10000E+01 volume  0.18789E-02 ppm1      7.177 ppm2      4.631 CV     1
 ASSI { 1975}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 26   and name HA  ))
      3.700     1.700     1.700 peak  1975 spectrum    1 weight  0.10000E+01 volume  0.60786E-03 ppm1      7.176 ppm2      4.374 CV     1
 ASSI { 1976}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 28   and name HA  ))
      4.000     2.000     2.000 peak  1976 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      7.183 ppm2      4.236 CV     1
 ASSI { 1977}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 29   and name HA  ))
      3.300     1.300     1.300 peak  1977 spectrum    1 weight  0.10000E+01 volume  0.11548E-02 ppm1      7.176 ppm2      3.922 CV     1
 ASSI { 1979}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 29   and name HB3 ))
      2.900     1.100     1.100 peak  1979 spectrum    1 weight  0.10000E+01 volume  0.23553E-02 ppm1      7.178 ppm2      3.215 CV     1
 ASSI { 1980}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 29   and name HB2 ))
      3.600     1.600     1.600 peak  1980 spectrum    1 weight  0.10000E+01 volume  0.15149E-02 ppm1      7.178 ppm2      2.973 CV     1
 ASSI { 1981}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 30   and name HB2 ))
      3.600     1.600     1.600 peak  1981 spectrum    1 weight  0.10000E+01 volume  0.31100E-02 ppm1      7.178 ppm2      2.107 CV     1
 ASSI { 1982}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 31   and name HB2 ))
      4.800     2.900     1.200 peak  1982 spectrum    1 weight  0.10000E+01 volume  0.51640E-03 ppm1      7.177 ppm2      1.988 CV     1
 ASSI { 1983}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 30   and name HB3 ))
      2.600     0.800     0.800 peak  1983 spectrum    1 weight  0.10000E+01 volume  0.30412E-02 ppm1      7.178 ppm2      1.860 CV     1
 ASSI { 1984}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 30   and name HG3 ))
      3.800     1.800     1.800 peak  1984 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      7.178 ppm2      1.663 CV     1
 ASSI { 1985}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 30   and name HG2 ))
      3.100     1.200     1.200 peak  1985 spectrum    1 weight  0.10000E+01 volume  0.11052E-02 ppm1      7.178 ppm2      1.474 CV     1
 ASSI { 1986}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 31   and name HB3 ))
      5.900     4.400     0.100 peak  1986 spectrum    1 weight  0.10000E+01 volume  0.49927E-03 ppm1      7.179 ppm2      2.326 CV     1
 ASSI { 1988}
   (( segid "    " and resid 30   and name H   ))
   (  segid "    " and resid 23   and name HG2%)
      5.300     3.500     0.700 peak  1988 spectrum    1 weight  0.10000E+01 volume  0.31632E-03 ppm1      7.178 ppm2      1.366 CV     1
 ASSI { 1989}
   (( segid "    " and resid 30   and name H   ))
   (  segid "    " and resid 28   and name HB% )
      4.400     2.400     1.600 peak  1989 spectrum    1 weight  0.10000E+01 volume  0.74127E-03 ppm1      7.179 ppm2      1.009 CV     1
 ASSI { 1990}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 28   and name H   ))
      2.900     1.000     1.000 peak  1990 spectrum    1 weight  0.10000E+01 volume  0.18141E-02 ppm1      8.212 ppm2      8.610 CV     1
 ASSI { 1992}
   (( segid "    " and resid 28   and name H   ))
   (  segid "    " and resid 19   and name HD% )
      4.400     2.400     1.600 peak  1992 spectrum    1 weight  0.10000E+01 volume  0.71077E-03 ppm1      8.609 ppm2      7.069 CV     1
 ASSI { 1993}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 27   and name H   ))
      2.600     0.900     0.900 peak  1993 spectrum    1 weight  0.10000E+01 volume  0.25497E-02 ppm1      8.610 ppm2      6.717 CV     1
 ASSI { 1995}
   (( segid "    " and resid 29   and name H   ))
   (  segid "    " and resid 26   and name HD% )
      2.900     2.900     3.100 peak  1995 spectrum    1 weight  0.10000E+01 volume  0.42494E-03 ppm1      8.213 ppm2      7.065 CV     1
 ASSI { 1996}
   (( segid "    " and resid 29   and name H   ))
   (  segid "    " and resid 81   and name HD% )
      5.300     3.500     0.700 peak  1996 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      8.212 ppm2      6.800 CV     1
 ASSI { 1998}
   (( segid "    " and resid 29   and name H   ))
   (  segid "    " and resid 81   and name HE% )
      4.800     2.800     1.200 peak  1998 spectrum    1 weight  0.10000E+01 volume  0.55452E-03 ppm1      8.214 ppm2      6.309 CV     1
 ASSI { 1999}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
      3.500     1.600     1.600 peak  1999 spectrum    1 weight  0.10000E+01 volume  0.10042E-02 ppm1      8.611 ppm2      4.632 CV     1
 ASSI { 2000}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 26   and name HA  ))
      4.100     2.100     1.900 peak  2000 spectrum    1 weight  0.10000E+01 volume  0.52974E-03 ppm1      8.610 ppm2      4.376 CV     1
 ASSI { 2001}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 28   and name HA  ))
      2.800     1.000     1.000 peak  2001 spectrum    1 weight  0.10000E+01 volume  0.16731E-02 ppm1      8.611 ppm2      4.238 CV     1
 ASSI { 2002}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
      4.300     2.300     1.700 peak  2002 spectrum    1 weight  0.10000E+01 volume  0.44210E-03 ppm1      8.210 ppm2      4.626 CV     1
 ASSI { 2003}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 26   and name HA  ))
      3.300     1.400     1.400 peak  2003 spectrum    1 weight  0.10000E+01 volume  0.11262E-02 ppm1      8.211 ppm2      4.376 CV     1
 ASSI { 2004}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 28   and name HA  ))
      3.400     1.500     1.500 peak  2004 spectrum    1 weight  0.10000E+01 volume  0.10195E-02 ppm1      8.213 ppm2      4.238 CV     1
 ASSI { 2005}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 29   and name HA  ))
      2.800     1.000     1.000 peak  2005 spectrum    1 weight  0.10000E+01 volume  0.21095E-02 ppm1      8.212 ppm2      3.928 CV     1
 ASSI { 2006}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 30   and name HA  ))
      5.200     3.400     0.800 peak  2006 spectrum    1 weight  0.10000E+01 volume  0.32966E-03 ppm1      8.213 ppm2      3.806 CV     1
 ASSI { 2008}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 25   and name HA  ))
      3.200     1.300     1.300 peak  2008 spectrum    1 weight  0.10000E+01 volume  0.12615E-02 ppm1      8.610 ppm2      3.284 CV     1
 ASSI { 2009}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 29   and name HB3 ))
      5.000     3.100     1.000 peak  2009 spectrum    1 weight  0.10000E+01 volume  0.51260E-03 ppm1      8.612 ppm2      3.201 CV     1
 ASSI { 2010}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 29   and name HB3 ))
      3.000     1.100     1.100 peak  2010 spectrum    1 weight  0.10000E+01 volume  0.26412E-02 ppm1      8.212 ppm2      3.212 CV     1
 ASSI { 2011}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 25   and name HA  ))
      3.500     1.600     1.600 peak  2011 spectrum    1 weight  0.10000E+01 volume  0.95088E-03 ppm1      8.216 ppm2      3.279 CV     1
 ASSI { 2012}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 29   and name HB2 ))
      5.500     3.800     0.500 peak  2012 spectrum    1 weight  0.10000E+01 volume  0.24010E-03 ppm1      8.612 ppm2      2.962 CV     1
 ASSI { 2013}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 29   and name HB2 ))
      2.900     1.000     1.000 peak  2013 spectrum    1 weight  0.10000E+01 volume  0.19246E-02 ppm1      8.212 ppm2      2.973 CV     1
 ASSI { 2014}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 27   and name HB3 ))
      2.700     0.900     0.900 peak  2014 spectrum    1 weight  0.10000E+01 volume  0.29536E-02 ppm1      8.610 ppm2      2.605 CV     1
 ASSI { 2015}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 31   and name HG2 ))
      5.600     4.000     0.400 peak  2015 spectrum    1 weight  0.10000E+01 volume  0.41352E-03 ppm1      8.607 ppm2      2.736 CV     1
 ASSI { 2018}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 24   and name HB3 ))
      4.100     2.100     1.900 peak  2018 spectrum    1 weight  0.10000E+01 volume  0.66885E-03 ppm1      8.614 ppm2      1.724 CV     1
 ASSI { 2021}
   (( segid "    " and resid 28   and name H   ))
   (  segid "    " and resid 68   and name HD1%)
      4.900     2.900     1.100 peak  2021 spectrum    1 weight  0.10000E+01 volume  0.51449E-03 ppm1      8.609 ppm2      0.307 CV     1
 OR { 2021}
   (( segid "    " and resid 28   and name H   ))
   (  segid "    " and resid 68   and name HD2%)
 ASSI { 2023}
   (( segid "    " and resid 29   and name H   ))
   (  segid "    " and resid 49   and name HD2%)
      4.400     2.500     1.600 peak  2023 spectrum    1 weight  0.10000E+01 volume  0.35633E-03 ppm1      8.211 ppm2      0.865 CV     1
 ASSI { 2024}
   (( segid "    " and resid 29   and name H   ))
   (  segid "    " and resid 49   and name HD1%)
      2.900     1.000     1.000 peak  2024 spectrum    1 weight  0.10000E+01 volume  0.20218E-02 ppm1      8.212 ppm2      0.745 CV     1
 ASSI { 2025}
   (( segid "    " and resid 29   and name H   ))
   (  segid "    " and resid 68   and name HD2%)
      5.300     3.500     0.700 peak  2025 spectrum    1 weight  0.10000E+01 volume  0.38302E-03 ppm1      8.214 ppm2      0.309 CV     1
 ASSI { 2026}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 25   and name H   ))
      4.500     2.500     1.500 peak  2026 spectrum    1 weight  0.10000E+01 volume  0.27820E-03 ppm1      6.720 ppm2      9.470 CV     1
 ASSI { 2030}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 29   and name H   ))
      4.300     2.300     1.700 peak  2030 spectrum    1 weight  0.10000E+01 volume  0.46686E-03 ppm1      6.718 ppm2      8.213 CV     1
 ASSI { 2031}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 25   and name H   ))
      3.200     1.300     1.300 peak  2031 spectrum    1 weight  0.10000E+01 volume  0.10023E-02 ppm1      8.702 ppm2      9.461 CV     1
 ASSI { 2032}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 64   and name H   ))
      5.100     3.200     0.900 peak  2032 spectrum    1 weight  0.10000E+01 volume  0.54881E-03 ppm1      8.701 ppm2      8.423 CV     1
 ASSI { 2033}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 29   and name H   ))
      4.500     2.500     1.500 peak  2033 spectrum    1 weight  0.10000E+01 volume  0.33348E-03 ppm1      8.698 ppm2      8.226 CV     1
 ASSI { 2034}
   (( segid "    " and resid 27   and name H   ))
   (  segid "    " and resid 26   and name HD% )
      3.100     1.200     1.200 peak  2034 spectrum    1 weight  0.10000E+01 volume  0.12520E-02 ppm1      6.716 ppm2      7.066 CV     1
 ASSI { 2036}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 27   and name H   ))
      3.000     1.100     1.100 peak  2036 spectrum    1 weight  0.10000E+01 volume  0.13491E-02 ppm1      8.701 ppm2      6.717 CV     1
 ASSI { 2038}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 26   and name HA  ))
      3.500     1.500     1.500 peak  2038 spectrum    1 weight  0.10000E+01 volume  0.10309E-02 ppm1      6.717 ppm2      4.374 CV     1
 ASSI { 2039}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 28   and name HA  ))
      5.300     3.500     0.700 peak  2039 spectrum    1 weight  0.10000E+01 volume  0.31441E-03 ppm1      6.712 ppm2      4.232 CV     1
 ASSI { 2040}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
      5.500     3.700     0.500 peak  2040 spectrum    1 weight  0.10000E+01 volume  0.30490E-03 ppm1      8.701 ppm2      4.635 CV     1
 ASSI { 2041}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 26   and name HA  ))
      2.800     1.000     1.000 peak  2041 spectrum    1 weight  0.10000E+01 volume  0.28945E-02 ppm1      8.702 ppm2      4.376 CV     1
 ASSI { 2042}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 64   and name HA  ))
      2.700     0.900     0.900 peak  2042 spectrum    1 weight  0.10000E+01 volume  0.23038E-02 ppm1      8.702 ppm2      3.916 CV     1
 ASSI { 2045}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 25   and name HA  ))
      3.900     1.900     1.900 peak  2045 spectrum    1 weight  0.10000E+01 volume  0.55643E-03 ppm1      6.715 ppm2      3.272 CV     1
 ASSI { 2046}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 26   and name HB3 ))
      4.000     2.000     2.000 peak  2046 spectrum    1 weight  0.10000E+01 volume  0.99471E-03 ppm1      6.717 ppm2      3.188 CV     1
 ASSI { 2047}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 26   and name HB2 ))
      3.600     1.600     1.600 peak  2047 spectrum    1 weight  0.10000E+01 volume  0.24696E-02 ppm1      8.702 ppm2      2.803 CV     1
 ASSI { 2048}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 24   and name HG2 ))
      3.200     1.300     1.300 peak  2048 spectrum    1 weight  0.10000E+01 volume  0.11853E-02 ppm1      8.704 ppm2      2.603 CV     1
 ASSI { 2049}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 26   and name HB2 ))
      3.800     1.800     1.800 peak  2049 spectrum    1 weight  0.10000E+01 volume  0.93755E-03 ppm1      6.719 ppm2      2.810 CV     1
 ASSI { 2050}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 24   and name HG3 ))
      2.600     2.600     3.400 peak  2050 spectrum    1 weight  0.10000E+01 volume  0.74127E-03 ppm1      6.717 ppm2      2.732 CV     1
 ASSI { 2051}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 27   and name HB2 ))
      2.500     0.800     0.800 peak  2051 spectrum    1 weight  0.10000E+01 volume  0.47562E-02 ppm1      6.718 ppm2      2.602 CV     1
 OR { 2051}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 27   and name HB3 ))
 ASSI { 2054}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 24   and name HB3 ))
      2.800     1.000     1.000 peak  2054 spectrum    1 weight  0.10000E+01 volume  0.17588E-02 ppm1      6.718 ppm2      1.726 CV     1
 ASSI { 2057}
   (( segid "    " and resid 27   and name H   ))
   (  segid "    " and resid 28   and name HB% )
      4.300     2.300     1.700 peak  2057 spectrum    1 weight  0.10000E+01 volume  0.11548E-02 ppm1      6.719 ppm2      1.005 CV     1
 ASSI { 2058}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 24   and name HB3 ))
      2.900     1.000     1.000 peak  2058 spectrum    1 weight  0.10000E+01 volume  0.14158E-02 ppm1      8.702 ppm2      1.727 CV     1
 ASSI { 2066}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 68   and name H   ))
      4.700     2.700     1.300 peak  2066 spectrum    1 weight  0.10000E+01 volume  0.32203E-03 ppm1      9.460 ppm2      8.353 CV     1
 ASSI { 2069}
   (( segid "    " and resid 25   and name H   ))
   (  segid "    " and resid 26   and name HD% )
      5.400     3.600     0.600 peak  2069 spectrum    1 weight  0.10000E+01 volume  0.25344E-03 ppm1      9.454 ppm2      7.073 CV     1
 ASSI { 2070}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 27   and name H   ))
      4.400     2.400     1.600 peak  2070 spectrum    1 weight  0.10000E+01 volume  0.47831E-03 ppm1      9.134 ppm2      6.716 CV     1
 ASSI { 2072}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 24   and name HA  ))
      2.900     1.100     1.100 peak  2072 spectrum    1 weight  0.10000E+01 volume  0.52403E-03 ppm1      9.465 ppm2      4.719 CV     1
 ASSI { 2073}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 26   and name HA  ))
      5.200     3.400     0.800 peak  2073 spectrum    1 weight  0.10000E+01 volume  0.33919E-03 ppm1      9.462 ppm2      4.377 CV     1
 ASSI { 2077}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 26   and name HB3 ))
      5.400     3.600     0.600 peak  2077 spectrum    1 weight  0.10000E+01 volume  0.28965E-03 ppm1      9.459 ppm2      3.180 CV     1
 ASSI { 2079}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 24   and name HG2 ))
      3.900     1.900     1.900 peak  2079 spectrum    1 weight  0.10000E+01 volume  0.47448E-03 ppm1      9.459 ppm2      2.600 CV     1
 ASSI { 2081}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 27   and name HB3 ))
      3.700     1.700     1.700 peak  2081 spectrum    1 weight  0.10000E+01 volume  0.23496E-02 ppm1      9.136 ppm2      2.602 CV     1
 OR { 2081}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 2083}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 24   and name HB3 ))
      3.900     1.900     1.900 peak  2083 spectrum    1 weight  0.10000E+01 volume  0.91276E-03 ppm1      9.460 ppm2      1.727 CV     1
 OR { 2083}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 24   and name HB2 ))
 ASSI { 2087}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 24   and name HB2 ))
      3.100     1.200     1.200 peak  2087 spectrum    1 weight  0.10000E+01 volume  0.19208E-02 ppm1      9.137 ppm2      1.727 CV     1
 OR { 2087}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 24   and name HB3 ))
 ASSI { 2091}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 24   and name H   ))
      2.900     1.000     1.000 peak  2091 spectrum    1 weight  0.10000E+01 volume  0.68981E-03 ppm1      7.709 ppm2      9.142 CV     1
 ASSI { 2093}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 22   and name H   ))
      2.800     1.000     1.000 peak  2093 spectrum    1 weight  0.10000E+01 volume  0.20694E-02 ppm1      7.709 ppm2      7.377 CV     1
 ASSI { 2096}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
      5.500     3.800     0.500 peak  2096 spectrum    1 weight  0.10000E+01 volume  0.48402E-03 ppm1      7.709 ppm2      4.849 CV     1
 ASSI { 2097}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 22   and name HA  ))
      3.000     1.100     1.100 peak  2097 spectrum    1 weight  0.10000E+01 volume  0.12805E-02 ppm1      7.709 ppm2      4.313 CV     1
 ASSI { 2098}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 20   and name HA  ))
      4.200     2.200     1.800 peak  2098 spectrum    1 weight  0.10000E+01 volume  0.55070E-03 ppm1      7.377 ppm2      4.667 CV     1
 ASSI { 2101}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 21   and name HD2 ))
      3.200     1.300     1.300 peak  2101 spectrum    1 weight  0.10000E+01 volume  0.11586E-02 ppm1      7.375 ppm2      3.892 CV     1
 ASSI { 2102}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 22   and name HB2 ))
      3.200     1.300     1.300 peak  2102 spectrum    1 weight  0.10000E+01 volume  0.20694E-02 ppm1      7.377 ppm2      3.800 CV     1
 ASSI { 2103}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      3.700     1.700     1.700 peak  2103 spectrum    1 weight  0.10000E+01 volume  0.65743E-03 ppm1      7.705 ppm2      4.099 CV     1
 ASSI { 2104}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 22   and name HB3 ))
      4.700     2.700     1.300 peak  2104 spectrum    1 weight  0.10000E+01 volume  0.49544E-03 ppm1      7.710 ppm2      4.037 CV     1
 ASSI { 2105}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 23   and name HB  ))
      2.400     0.700     0.700 peak  2105 spectrum    1 weight  0.10000E+01 volume  0.41161E-02 ppm1      7.709 ppm2      3.915 CV     1
 OR { 2105}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 23   and name HA  ))
 ASSI { 2107}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      3.500     1.500     1.500 peak  2107 spectrum    1 weight  0.10000E+01 volume  0.80414E-03 ppm1      7.380 ppm2      4.096 CV     1
 ASSI { 2108}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 19   and name HB3 ))
      4.800     2.900     1.200 peak  2108 spectrum    1 weight  0.10000E+01 volume  0.25916E-03 ppm1      7.715 ppm2      2.930 CV     1
 ASSI { 2109}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 69   and name HB2 ))
      5.400     3.600     0.600 peak  2109 spectrum    1 weight  0.10000E+01 volume  0.21342E-03 ppm1      7.379 ppm2      2.779 CV     1
 ASSI { 2113}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 20   and name HB2 ))
      3.500     1.600     1.600 peak  2113 spectrum    1 weight  0.10000E+01 volume  0.88800E-03 ppm1      7.709 ppm2      1.903 CV     1
 ASSI { 2114}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 68   and name HG  ))
      4.500     2.500     1.500 peak  2114 spectrum    1 weight  0.10000E+01 volume  0.44210E-03 ppm1      7.713 ppm2      1.656 CV     1
 ASSI { 2117}
   (( segid "    " and resid 22   and name H   ))
   (  segid "    " and resid 4    and name HD2%)
      5.300     3.500     0.700 peak  2117 spectrum    1 weight  0.10000E+01 volume  0.28965E-03 ppm1      7.380 ppm2      0.700 CV     1
 ASSI { 2118}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 4    and name HD2%)
      4.700     2.700     1.300 peak  2118 spectrum    1 weight  0.10000E+01 volume  0.38302E-03 ppm1      7.713 ppm2      0.704 CV     1
 ASSI { 2119}
   (( segid "    " and resid 22   and name H   ))
   (  segid "    " and resid 68   and name HD1%)
      5.200     3.300     0.800 peak  2119 spectrum    1 weight  0.10000E+01 volume  0.24772E-03 ppm1      7.372 ppm2      0.318 CV     1
 ASSI { 2120}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 68   and name HD1%)
      3.800     1.800     1.800 peak  2120 spectrum    1 weight  0.10000E+01 volume  0.12462E-02 ppm1      7.709 ppm2      0.322 CV     1
 OR { 2120}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 68   and name HD2%)
 ASSI { 2121}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 19   and name H   ))
      4.600     2.700     1.400 peak  2121 spectrum    1 weight  0.10000E+01 volume  0.38111E-03 ppm1      9.209 ppm2      8.830 CV     1
 ASSI { 2123}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 18   and name H   ))
      4.800     2.900     1.200 peak  2123 spectrum    1 weight  0.10000E+01 volume  0.47640E-03 ppm1      8.830 ppm2      7.663 CV     1
 ASSI { 2124}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 23   and name H   ))
      4.800     2.900     1.200 peak  2124 spectrum    1 weight  0.10000E+01 volume  0.36586E-03 ppm1      9.209 ppm2      7.712 CV     1
 ASSI { 2127}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HE22))
      5.300     3.500     0.700 peak  2127 spectrum    1 weight  0.10000E+01 volume  0.33157E-03 ppm1      7.663 ppm2      6.679 CV     1
 ASSI { 2129}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 19   and name HA  ))
      3.100     1.200     1.200 peak  2129 spectrum    1 weight  0.10000E+01 volume  0.14863E-02 ppm1      8.829 ppm2      4.863 CV     1
 ASSI { 2131}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 20   and name HA  ))
      3.100     1.200     1.200 peak  2131 spectrum    1 weight  0.10000E+01 volume  0.10557E-02 ppm1      9.208 ppm2      4.658 CV     1
 ASSI { 2132}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 3    and name HA  ))
      4.200     2.200     1.800 peak  2132 spectrum    1 weight  0.10000E+01 volume  0.39065E-03 ppm1      8.832 ppm2      4.274 CV     1
 ASSI { 2133}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 3    and name HA  ))
      4.800     2.900     1.200 peak  2133 spectrum    1 weight  0.10000E+01 volume  0.36395E-03 ppm1      9.209 ppm2      4.274 CV     1
 ASSI { 2134}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 23   and name HB  ))
      3.400     1.400     1.400 peak  2134 spectrum    1 weight  0.10000E+01 volume  0.66314E-03 ppm1      9.208 ppm2      3.907 CV     1
 ASSI { 2135}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 21   and name HD3 ))
      5.100     3.300     0.900 peak  2135 spectrum    1 weight  0.10000E+01 volume  0.57168E-03 ppm1      9.207 ppm2      3.807 CV     1
 ASSI { 2136}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 19   and name HB3 ))
      4.300     2.300     1.700 peak  2136 spectrum    1 weight  0.10000E+01 volume  0.80034E-03 ppm1      8.830 ppm2      2.940 CV     1
 ASSI { 2137}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 19   and name HB2 ))
      3.100     1.200     1.200 peak  2137 spectrum    1 weight  0.10000E+01 volume  0.10100E-02 ppm1      8.829 ppm2      2.293 CV     1
 ASSI { 2138}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 19   and name HB3 ))
      3.100     1.200     1.200 peak  2138 spectrum    1 weight  0.10000E+01 volume  0.12653E-02 ppm1      9.209 ppm2      2.937 CV     1
 ASSI { 2141}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 20   and name HB2 ))
      2.700     0.900     0.900 peak  2141 spectrum    1 weight  0.10000E+01 volume  0.19627E-02 ppm1      9.209 ppm2      1.892 CV     1
 ASSI { 2142}
   (( segid "    " and resid 20   and name H   ))
   (  segid "    " and resid 23   and name HG2%)
      4.000     2.000     2.000 peak  2142 spectrum    1 weight  0.10000E+01 volume  0.51831E-03 ppm1      9.207 ppm2      1.365 CV     1
 ASSI { 2144}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 18   and name HG3 ))
      4.000     2.000     2.000 peak  2144 spectrum    1 weight  0.10000E+01 volume  0.14997E-02 ppm1      8.830 ppm2      2.024 CV     1
 ASSI { 2145}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 4    and name HB2 ))
      2.900     1.000     1.000 peak  2145 spectrum    1 weight  0.10000E+01 volume  0.15016E-02 ppm1      8.830 ppm2      1.580 CV     1
 ASSI { 2146}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 18   and name HB3 ))
      3.100     1.200     1.200 peak  2146 spectrum    1 weight  0.10000E+01 volume  0.13358E-02 ppm1      8.829 ppm2      1.450 CV     1
 ASSI { 2147}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 4    and name HB3 ))
      4.500     2.500     1.500 peak  2147 spectrum    1 weight  0.10000E+01 volume  0.39445E-03 ppm1      8.833 ppm2      1.292 CV     1
 ASSI { 2149}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 6    and name HD1%)
      4.100     2.100     1.900 peak  2149 spectrum    1 weight  0.10000E+01 volume  0.73935E-03 ppm1      8.827 ppm2      0.706 CV     1
 ASSI { 2150}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 68   and name HD1%)
      5.100     3.300     0.900 peak  2150 spectrum    1 weight  0.10000E+01 volume  0.42686E-03 ppm1      8.826 ppm2      0.319 CV     1
 ASSI { 2151}
   (( segid "    " and resid 20   and name H   ))
   (  segid "    " and resid 6    and name HD1%)
      5.500     3.700     0.500 peak  2151 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      9.209 ppm2      0.716 CV     1
 ASSI { 2152}
   (( segid "    " and resid 20   and name H   ))
   (  segid "    " and resid 68   and name HD1%)
      4.400     2.400     1.600 peak  2152 spectrum    1 weight  0.10000E+01 volume  0.76985E-03 ppm1      9.209 ppm2      0.325 CV     1
 ASSI { 2154}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 8    and name H   ))
      4.600     2.600     1.400 peak  2154 spectrum    1 weight  0.10000E+01 volume  0.35444E-03 ppm1      8.581 ppm2      9.025 CV     1
 ASSI { 2155}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 15   and name H   ))
      4.100     2.100     1.900 peak  2155 spectrum    1 weight  0.10000E+01 volume  0.10481E-02 ppm1      8.581 ppm2      8.897 CV     1
 ASSI { 2156}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 8    and name H   ))
      4.000     2.000     2.000 peak  2156 spectrum    1 weight  0.10000E+01 volume  0.61931E-03 ppm1      9.134 ppm2      9.034 CV     1
 ASSI { 2157}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 6    and name H   ))
      3.400     1.500     1.500 peak  2157 spectrum    1 weight  0.10000E+01 volume  0.74318E-03 ppm1      9.133 ppm2      8.883 CV     1
 ASSI { 2158}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 7    and name H   ))
      3.200     3.200     2.800 peak  2158 spectrum    1 weight  0.10000E+01 volume  0.24391E-03 ppm1      9.136 ppm2      8.681 CV     1
 ASSI { 2159}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 16   and name H   ))
      4.800     2.800     1.200 peak  2159 spectrum    1 weight  0.10000E+01 volume  0.47640E-03 ppm1      9.132 ppm2      8.579 CV     1
 ASSI { 2161}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 16   and name HA  ))
      2.400     0.700     0.700 peak  2161 spectrum    1 weight  0.10000E+01 volume  0.42132E-02 ppm1      9.133 ppm2      4.958 CV     1
 ASSI { 2164}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 16   and name HA  ))
      2.900     1.000     1.000 peak  2164 spectrum    1 weight  0.10000E+01 volume  0.23477E-02 ppm1      8.581 ppm2      4.960 CV     1
 ASSI { 2165}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 15   and name HA  ))
      2.300     0.600     0.600 peak  2165 spectrum    1 weight  0.10000E+01 volume  0.61797E-02 ppm1      8.581 ppm2      4.673 CV     1
 ASSI { 2166}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 7    and name HA  ))
      4.600     2.700     1.400 peak  2166 spectrum    1 weight  0.10000E+01 volume  0.58310E-03 ppm1      8.583 ppm2      4.497 CV     1
 ASSI { 2167}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 16   and name HB  ))
      2.400     0.700     0.700 peak  2167 spectrum    1 weight  0.10000E+01 volume  0.63931E-02 ppm1      8.581 ppm2      3.865 CV     1
 ASSI { 2168}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 16   and name HB  ))
      4.500     2.500     1.500 peak  2168 spectrum    1 weight  0.10000E+01 volume  0.76222E-03 ppm1      9.133 ppm2      3.858 CV     1
 ASSI { 2169}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 17   and name HG3 ))
      4.500     2.600     1.500 peak  2169 spectrum    1 weight  0.10000E+01 volume  0.55452E-03 ppm1      8.582 ppm2      2.079 CV     1
 ASSI { 2170}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 17   and name HG3 ))
      4.400     2.400     1.600 peak  2170 spectrum    1 weight  0.10000E+01 volume  0.91085E-03 ppm1      9.135 ppm2      2.089 CV     1
 ASSI { 2171}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 17   and name HB2 ))
      2.700     0.900     0.900 peak  2171 spectrum    1 weight  0.10000E+01 volume  0.17131E-02 ppm1      9.133 ppm2      1.475 CV     1
 ASSI { 2172}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 6    and name HB2 ))
      3.800     1.900     1.900 peak  2172 spectrum    1 weight  0.10000E+01 volume  0.44970E-03 ppm1      9.134 ppm2      1.323 CV     1
 ASSI { 2173}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 15   and name HB3 ))
      2.700     0.900     0.900 peak  2173 spectrum    1 weight  0.10000E+01 volume  0.31345E-02 ppm1      8.581 ppm2      1.704 CV     1
 ASSI { 2174}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 15   and name HD2 ))
      4.300     2.300     1.700 peak  2174 spectrum    1 weight  0.10000E+01 volume  0.90514E-03 ppm1      8.581 ppm2      1.577 CV     1
 ASSI { 2175}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 15   and name HB2 ))
      3.600     1.700     1.700 peak  2175 spectrum    1 weight  0.10000E+01 volume  0.24525E-02 ppm1      8.581 ppm2      1.478 CV     1
 ASSI { 2177}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 15   and name HG3 ))
      4.800     2.900     1.200 peak  2177 spectrum    1 weight  0.10000E+01 volume  0.10919E-02 ppm1      8.580 ppm2      1.247 CV     1
 ASSI { 2179}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 8    and name HD1%)
      4.300     2.300     1.700 peak  2179 spectrum    1 weight  0.10000E+01 volume  0.83844E-03 ppm1      9.133 ppm2      0.717 CV     1
 ASSI { 2185}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 15   and name H   ))
      3.900     1.900     1.900 peak  2185 spectrum    1 weight  0.10000E+01 volume  0.96039E-03 ppm1      8.202 ppm2      8.891 CV     1
 ASSI { 2186}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 13   and name H   ))
      4.400     2.400     1.600 peak  2186 spectrum    1 weight  0.10000E+01 volume  0.10004E-02 ppm1      8.202 ppm2      8.086 CV     1
 ASSI { 2187}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 9    and name HA  ))
      4.700     2.700     1.300 peak  2187 spectrum    1 weight  0.10000E+01 volume  0.56023E-03 ppm1      8.202 ppm2      5.295 CV     1
 ASSI { 2189}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 14   and name HA  ))
      2.400     0.700     0.700 peak  2189 spectrum    1 weight  0.10000E+01 volume  0.33519E-02 ppm1      8.895 ppm2      4.995 CV     1
 ASSI { 2192}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 9    and name HA  ))
      2.400     0.700     0.700 peak  2192 spectrum    1 weight  0.10000E+01 volume  0.33480E-02 ppm1      8.885 ppm2      5.294 CV     1
 ASSI { 2194}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 9    and name HB3 ))
      4.300     2.300     1.700 peak  2194 spectrum    1 weight  0.10000E+01 volume  0.76222E-03 ppm1      8.887 ppm2      3.663 CV     1
 ASSI { 2195}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 13   and name HB  ))
      4.300     2.300     1.700 peak  2195 spectrum    1 weight  0.10000E+01 volume  0.16540E-02 ppm1      8.203 ppm2      2.181 CV     1
 ASSI { 2196}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 14   and name HB  ))
      2.700     0.900     0.900 peak  2196 spectrum    1 weight  0.10000E+01 volume  0.43065E-02 ppm1      8.203 ppm2      1.793 CV     1
 ASSI { 2197}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 15   and name HE2 ))
      5.200     3.400     0.800 peak  2197 spectrum    1 weight  0.10000E+01 volume  0.30299E-03 ppm1      8.208 ppm2      2.813 CV     1
 OR { 2197}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 15   and name HE3 ))
 ASSI { 2199}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 8    and name HB  ))
      3.600     1.600     1.600 peak  2199 spectrum    1 weight  0.10000E+01 volume  0.45161E-03 ppm1      8.889 ppm2      2.080 CV     1
 ASSI { 2211}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HD21))
      4.600     2.600     1.400 peak  2211 spectrum    1 weight  0.10000E+01 volume  0.31252E-03 ppm1      8.758 ppm2      7.499 CV     1
 ASSI { 2213}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 11   and name H   ))
      4.800     2.800     1.200 peak  2213 spectrum    1 weight  0.10000E+01 volume  0.10309E-02 ppm1      8.759 ppm2      9.096 CV     1
 ASSI { 2214}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HA  ))
      2.900     1.100     1.100 peak  2214 spectrum    1 weight  0.10000E+01 volume  0.27058E-02 ppm1      8.759 ppm2      4.648 CV     1
 ASSI { 2215}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 14   and name HA  ))
      4.400     2.400     1.600 peak  2215 spectrum    1 weight  0.10000E+01 volume  0.46306E-03 ppm1      8.075 ppm2      4.989 CV     1
 ASSI { 2216}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 9    and name HA  ))
      4.300     2.400     1.700 peak  2216 spectrum    1 weight  0.10000E+01 volume  0.69744E-03 ppm1      8.076 ppm2      5.294 CV     1
 ASSI { 2217}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
      5.400     3.600     0.600 peak  2217 spectrum    1 weight  0.10000E+01 volume  0.40398E-03 ppm1      8.758 ppm2      4.215 CV     1
 ASSI { 2218}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 11   and name HA2 ))
      3.700     1.700     1.700 peak  2218 spectrum    1 weight  0.10000E+01 volume  0.31746E-02 ppm1      8.759 ppm2      3.957 CV     1
 ASSI { 2219}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 11   and name HA3 ))
      2.500     0.800     0.800 peak  2219 spectrum    1 weight  0.10000E+01 volume  0.27611E-02 ppm1      8.759 ppm2      3.673 CV     1
 ASSI { 2220}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HB3 ))
      3.000     1.100     1.100 peak  2220 spectrum    1 weight  0.10000E+01 volume  0.26011E-02 ppm1      8.758 ppm2      2.842 CV     1
 OR { 2220}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HB2 ))
 ASSI { 2221}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 13   and name HB  ))
      4.900     2.900     1.100 peak  2221 spectrum    1 weight  0.10000E+01 volume  0.58119E-03 ppm1      8.758 ppm2      2.184 CV     1
 ASSI { 2223}
   (( segid "    " and resid 12   and name H   ))
   (  segid "    " and resid 13   and name HG2%)
      6.000     4.800     0.000 peak  2223 spectrum    1 weight  0.10000E+01 volume  0.45924E-03 ppm1      8.757 ppm2      0.818 CV     1
 ASSI { 2224}
   (( segid "    " and resid 11   and name H   ))
   (( segid "    " and resid 10   and name H   ))
      4.000     2.000     2.000 peak  2224 spectrum    1 weight  0.10000E+01 volume  0.88418E-03 ppm1      9.098 ppm2      8.885 CV     1
 ASSI { 2231}
   (( segid "    " and resid 6    and name H   ))
   (  segid "    " and resid 19   and name HE% )
      4.100     2.100     1.900 peak  2231 spectrum    1 weight  0.10000E+01 volume  0.45544E-03 ppm1      8.886 ppm2      7.125 CV     1
 ASSI { 2232}
   (( segid "    " and resid 6    and name H   ))
   (  segid "    " and resid 19   and name HD% )
      3.900     1.900     1.900 peak  2232 spectrum    1 weight  0.10000E+01 volume  0.53736E-03 ppm1      8.884 ppm2      7.063 CV     1
 ASSI { 2233}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 6    and name HA  ))
      3.000     1.200     1.200 peak  2233 spectrum    1 weight  0.10000E+01 volume  0.13530E-02 ppm1      8.883 ppm2      4.969 CV     1
 ASSI { 2234}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name HA  ))
      2.300     0.700     0.700 peak  2234 spectrum    1 weight  0.10000E+01 volume  0.34948E-02 ppm1      8.885 ppm2      4.890 CV     1
 ASSI { 2235}
   (( segid "    " and resid 11   and name H   ))
   (( segid "    " and resid 10   and name HA  ))
      2.300     0.600     0.600 peak  2235 spectrum    1 weight  0.10000E+01 volume  0.71460E-02 ppm1      9.098 ppm2      4.623 CV     1
 ASSI { 2236}
   (( segid "    " and resid 11   and name H   ))
   (( segid "    " and resid 11   and name HA2 ))
      2.500     0.800     0.800 peak  2236 spectrum    1 weight  0.10000E+01 volume  0.41523E-02 ppm1      9.098 ppm2      3.957 CV     1
 ASSI { 2237}
   (( segid "    " and resid 11   and name H   ))
   (( segid "    " and resid 11   and name HA3 ))
      2.900     1.000     1.000 peak  2237 spectrum    1 weight  0.10000E+01 volume  0.53852E-02 ppm1      9.098 ppm2      3.673 CV     1
 ASSI { 2238}
   (( segid "    " and resid 11   and name H   ))
   (( segid "    " and resid 10   and name HB  ))
      4.100     2.100     1.900 peak  2238 spectrum    1 weight  0.10000E+01 volume  0.11757E-02 ppm1      9.098 ppm2      1.820 CV     1
 ASSI { 2239}
   (( segid "    " and resid 11   and name H   ))
   (( segid "    " and resid 10   and name HG13))
      4.900     2.900     1.100 peak  2239 spectrum    1 weight  0.10000E+01 volume  0.88038E-03 ppm1      9.099 ppm2      1.583 CV     1
 ASSI { 2240}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 18   and name HG3 ))
      4.300     2.300     1.700 peak  2240 spectrum    1 weight  0.10000E+01 volume  0.81748E-03 ppm1      8.884 ppm2      2.029 CV     1
 ASSI { 2241}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 6    and name HB3 ))
      3.900     1.900     1.900 peak  2241 spectrum    1 weight  0.10000E+01 volume  0.10843E-02 ppm1      8.884 ppm2      1.636 CV     1
 ASSI { 2243}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 6    and name HB2 ))
      3.200     1.300     1.300 peak  2243 spectrum    1 weight  0.10000E+01 volume  0.90896E-03 ppm1      8.885 ppm2      1.311 CV     1
 ASSI { 2244}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 10   and name HG12))
      4.800     2.800     1.200 peak  2244 spectrum    1 weight  0.10000E+01 volume  0.39254E-03 ppm1      8.884 ppm2      1.195 CV     1
 ASSI { 2246}
   (( segid "    " and resid 11   and name H   ))
   (( segid "    " and resid 10   and name HG12))
      4.800     2.900     1.200 peak  2246 spectrum    1 weight  0.10000E+01 volume  0.79463E-03 ppm1      9.098 ppm2      1.186 CV     1
 ASSI { 2249}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 81   and name H   ))
      4.300     2.300     1.700 peak  2249 spectrum    1 weight  0.10000E+01 volume  0.60598E-03 ppm1      8.855 ppm2      8.546 CV     1
 ASSI { 2252}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 15   and name H   ))
      3.300     1.400     1.400 peak  2252 spectrum    1 weight  0.10000E+01 volume  0.88227E-03 ppm1      9.023 ppm2      8.886 CV     1
 ASSI { 2254}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 9    and name HA  ))
      3.300     1.400     1.400 peak  2254 spectrum    1 weight  0.10000E+01 volume  0.72602E-03 ppm1      8.854 ppm2      5.300 CV     1
 ASSI { 2256}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 8    and name HA  ))
      2.500     0.800     0.800 peak  2256 spectrum    1 weight  0.10000E+01 volume  0.25268E-02 ppm1      8.852 ppm2      4.922 CV     1
 ASSI { 2257}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 9    and name HA  ))
      4.400     2.400     1.600 peak  2257 spectrum    1 weight  0.10000E+01 volume  0.38111E-03 ppm1      9.026 ppm2      5.314 CV     1
 ASSI { 2258}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 16   and name HA  ))
      3.100     1.200     1.200 peak  2258 spectrum    1 weight  0.10000E+01 volume  0.18579E-02 ppm1      9.025 ppm2      4.950 CV     1
 ASSI { 2259}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 7    and name HA  ))
      2.600     0.800     0.800 peak  2259 spectrum    1 weight  0.10000E+01 volume  0.25554E-02 ppm1      9.024 ppm2      4.500 CV     1
 ASSI { 2260}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 9    and name HB3 ))
      3.400     1.500     1.500 peak  2260 spectrum    1 weight  0.10000E+01 volume  0.13015E-02 ppm1      8.854 ppm2      3.660 CV     1
 ASSI { 2263}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 8    and name HB  ))
      4.500     2.500     1.500 peak  2263 spectrum    1 weight  0.10000E+01 volume  0.56594E-03 ppm1      8.852 ppm2      2.062 CV     1
 ASSI { 2264}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 80   and name HG2 ))
      4.900     3.000     1.100 peak  2264 spectrum    1 weight  0.10000E+01 volume  0.58690E-03 ppm1      8.854 ppm2      1.989 CV     1
 ASSI { 2266}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 79   and name HB2 ))
      5.200     3.400     0.800 peak  2266 spectrum    1 weight  0.10000E+01 volume  0.40207E-03 ppm1      8.853 ppm2      1.693 CV     1
 ASSI { 2267}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 8    and name HB  ))
      2.800     1.000     1.000 peak  2267 spectrum    1 weight  0.10000E+01 volume  0.15130E-02 ppm1      9.025 ppm2      2.076 CV     1
 ASSI { 2268}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 7    and name HB2 ))
      4.600     2.600     1.400 peak  2268 spectrum    1 weight  0.10000E+01 volume  0.64598E-03 ppm1      9.023 ppm2      1.819 CV     1
 ASSI { 2271}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 7    and name HB3 ))
      3.600     1.600     1.600 peak  2271 spectrum    1 weight  0.10000E+01 volume  0.82701E-03 ppm1      9.022 ppm2      1.339 CV     1
 ASSI { 2275}
   (( segid "    " and resid 8    and name H   ))
   (  segid "    " and resid 16   and name HG2%)
      5.200     3.400     0.800 peak  2275 spectrum    1 weight  0.10000E+01 volume  0.48402E-03 ppm1      9.020 ppm2      0.924 CV     1
 ASSI { 2277}
   (( segid "    " and resid 9    and name H   ))
   (  segid "    " and resid 8    and name HG2%)
      3.200     1.300     1.300 peak  2277 spectrum    1 weight  0.10000E+01 volume  0.24906E-02 ppm1      8.853 ppm2      0.732 CV     1
 ASSI { 2280}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 6    and name H   ))
      3.900     1.900     1.900 peak  2280 spectrum    1 weight  0.10000E+01 volume  0.54307E-03 ppm1      8.657 ppm2      8.890 CV     1
 ASSI { 2281}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 19   and name H   ))
      3.400     1.400     1.400 peak  2281 spectrum    1 weight  0.10000E+01 volume  0.82322E-03 ppm1      8.727 ppm2      8.822 CV     1
 ASSI { 2285}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 75   and name HD21))
      3.000     1.100     1.100 peak  2285 spectrum    1 weight  0.10000E+01 volume  0.36015E-03 ppm1      8.650 ppm2      7.527 CV     1
 ASSI { 2286}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 18   and name HA  ))
      4.600     2.700     1.400 peak  2286 spectrum    1 weight  0.10000E+01 volume  0.43257E-03 ppm1      8.732 ppm2      5.269 CV     1
 ASSI { 2287}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 19   and name HA  ))
      4.900     3.000     1.100 peak  2287 spectrum    1 weight  0.10000E+01 volume  0.26678E-03 ppm1      8.724 ppm2      4.850 CV     1
 ASSI { 2288}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HA  ))
      3.200     1.300     1.300 peak  2288 spectrum    1 weight  0.10000E+01 volume  0.61549E-03 ppm1      8.724 ppm2      4.714 CV     1
 ASSI { 2289}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 20   and name HA  ))
      4.200     2.200     1.800 peak  2289 spectrum    1 weight  0.10000E+01 volume  0.79272E-03 ppm1      8.729 ppm2      4.655 CV     1
 ASSI { 2290}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 5    and name HA  ))
      2.800     1.000     1.000 peak  2290 spectrum    1 weight  0.10000E+01 volume  0.11052E-02 ppm1      8.655 ppm2      4.889 CV     1
 ASSI { 2291}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 18   and name HA  ))
      4.500     2.500     1.500 peak  2291 spectrum    1 weight  0.10000E+01 volume  0.36207E-03 ppm1      8.657 ppm2      5.266 CV     1
 ASSI { 2294}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      4.400     2.400     1.600 peak  2294 spectrum    1 weight  0.10000E+01 volume  0.35824E-03 ppm1      8.724 ppm2      4.110 CV     1
 ASSI { 2299}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 75   and name HB2 ))
      5.400     3.600     0.600 peak  2299 spectrum    1 weight  0.10000E+01 volume  0.37158E-03 ppm1      8.652 ppm2      2.618 CV     1
 ASSI { 2302}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 20   and name HB3 ))
      5.900     4.300     0.100 peak  2302 spectrum    1 weight  0.10000E+01 volume  0.41161E-03 ppm1      8.727 ppm2      2.131 CV     1
 ASSI { 2303}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HB2 ))
      3.900     1.900     1.900 peak  2303 spectrum    1 weight  0.10000E+01 volume  0.12520E-02 ppm1      8.655 ppm2      1.573 CV     1
 ASSI { 2304}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HG  ))
      4.400     2.400     1.600 peak  2304 spectrum    1 weight  0.10000E+01 volume  0.78510E-03 ppm1      8.654 ppm2      1.479 CV     1
 ASSI { 2305}
   (( segid "    " and resid 5    and name H   ))
   (  segid "    " and resid 3    and name HB% )
      4.700     2.700     1.300 peak  2305 spectrum    1 weight  0.10000E+01 volume  0.39636E-03 ppm1      8.655 ppm2      1.113 CV     1
 ASSI { 2306}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HB3 ))
      2.800     1.000     1.000 peak  2306 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      8.653 ppm2      1.288 CV     1
 ASSI { 2307}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HB2 ))
      2.600     0.800     0.800 peak  2307 spectrum    1 weight  0.10000E+01 volume  0.23115E-02 ppm1      8.726 ppm2      1.578 CV     1
 ASSI { 2309}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HB3 ))
      3.700     1.700     1.700 peak  2309 spectrum    1 weight  0.10000E+01 volume  0.14863E-02 ppm1      8.729 ppm2      1.288 CV     1
 ASSI { 2311}
   (( segid "    " and resid 5    and name H   ))
   (  segid "    " and resid 6    and name HD2%)
      3.500     1.500     1.500 peak  2311 spectrum    1 weight  0.10000E+01 volume  0.66314E-03 ppm1      8.658 ppm2      0.882 CV     1
 ASSI { 2315}
   (( segid "    " and resid 4    and name H   ))
   (  segid "    " and resid 68   and name HD1%)
      4.900     3.100     1.100 peak  2315 spectrum    1 weight  0.10000E+01 volume  0.32012E-03 ppm1      8.723 ppm2      0.317 CV     1
 ASSI { 2316}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 4    and name H   ))
      3.300     1.400     1.400 peak  2316 spectrum    1 weight  0.10000E+01 volume  0.17055E-02 ppm1      7.852 ppm2      8.726 CV     1
 ASSI { 2318}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 20   and name HA  ))
      4.700     2.800     1.300 peak  2318 spectrum    1 weight  0.10000E+01 volume  0.77938E-03 ppm1      7.852 ppm2      4.663 CV     1
 ASSI { 2319}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 1    and name HA  ))
      3.700     1.700     1.700 peak  2319 spectrum    1 weight  0.10000E+01 volume  0.12539E-02 ppm1      7.851 ppm2      4.399 CV     1
 ASSI { 2320}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 3    and name HA  ))
      2.500     0.800     0.800 peak  2320 spectrum    1 weight  0.10000E+01 volume  0.46420E-02 ppm1      7.851 ppm2      4.278 CV     1
 ASSI { 2322}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 21   and name HD2 ))
      4.900     3.000     1.100 peak  2322 spectrum    1 weight  0.10000E+01 volume  0.43828E-03 ppm1      7.853 ppm2      3.881 CV     1
 ASSI { 2323}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 21   and name HD3 ))
      3.700     1.700     1.700 peak  2323 spectrum    1 weight  0.10000E+01 volume  0.59644E-03 ppm1      7.850 ppm2      3.812 CV     1
 ASSI { 2324}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
      3.500     1.600     1.600 peak  2324 spectrum    1 weight  0.10000E+01 volume  0.64981E-03 ppm1      7.978 ppm2      3.231 CV     1
 ASSI { 2326}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 2    and name HB  ))
      3.500     1.500     1.500 peak  2326 spectrum    1 weight  0.10000E+01 volume  0.37998E-02 ppm1      7.851 ppm2      2.061 CV     1
 ASSI { 2327}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 21   and name HG3 ))
      4.100     2.100     1.900 peak  2327 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1      7.850 ppm2      1.946 CV     1
 ASSI { 2328}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 4    and name HB2 ))
      4.800     2.800     1.200 peak  2328 spectrum    1 weight  0.10000E+01 volume  0.48211E-03 ppm1      7.850 ppm2      1.576 CV     1
 ASSI { 2329}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 18   and name HB3 ))
      4.900     3.000     1.100 peak  2329 spectrum    1 weight  0.10000E+01 volume  0.49927E-03 ppm1      7.853 ppm2      1.458 CV     1
 ASSI { 2331}
   (( segid "    " and resid 3    and name H   ))
   (  segid "    " and resid 4    and name HD1%)
      4.400     2.400     1.600 peak  2331 spectrum    1 weight  0.10000E+01 volume  0.47069E-03 ppm1      7.852 ppm2      0.701 CV     1
 ASSI { 2332}
   (( segid "    " and resid 0    and name H   ))
   (( segid "    " and resid -1   and name H   ))
      2.600     0.900     0.900 peak  2332 spectrum    1 weight  0.10000E+01 volume  0.60349E-02 ppm1      8.044 ppm2      8.152 CV     1
 ASSI { 2333}
   (( segid "    " and resid 0    and name H   ))
   (  segid "    " and resid -1   and name HD% )
      4.300     2.400     1.700 peak  2333 spectrum    1 weight  0.10000E+01 volume  0.12177E-02 ppm1      8.043 ppm2      7.218 CV     1
 ASSI { 2335}
   (( segid "    " and resid 0    and name H   ))
   (( segid "    " and resid 0    and name HA  ))
      2.600     0.900     0.900 peak  2335 spectrum    1 weight  0.10000E+01 volume  0.52175E-02 ppm1      8.044 ppm2      4.202 CV     1
 ASSI { 2336}
   (( segid "    " and resid 0    and name H   ))
   (( segid "    " and resid 0    and name HB  ))
      3.300     1.400     1.400 peak  2336 spectrum    1 weight  0.10000E+01 volume  0.33366E-02 ppm1      8.044 ppm2      4.139 CV     1
 ASSI { 2337}
   (( segid "    " and resid 0    and name H   ))
   (( segid "    " and resid -1   and name HB2 ))
      3.500     1.500     1.500 peak  2337 spectrum    1 weight  0.10000E+01 volume  0.35654E-02 ppm1      8.044 ppm2      3.103 CV     1
 ASSI { 2338}
   (( segid "    " and resid 0    and name H   ))
   (( segid "    " and resid -1   and name HB3 ))
      3.800     1.800     1.800 peak  2338 spectrum    1 weight  0.10000E+01 volume  0.20485E-02 ppm1      8.044 ppm2      2.983 CV     1
 ASSI { 2340}
   (( segid "    " and resid -1   and name H   ))
   (  segid "    " and resid -1   and name HD% )
      2.900     1.100     1.100 peak  2340 spectrum    1 weight  0.10000E+01 volume  0.40703E-02 ppm1      8.154 ppm2      7.217 CV     1
 ASSI { 2341}
   (( segid "    " and resid -1   and name H   ))
   (( segid "    " and resid -1   and name HA  ))
      2.400     0.700     0.700 peak  2341 spectrum    1 weight  0.10000E+01 volume  0.10078E-01 ppm1      8.153 ppm2      4.532 CV     1
 ASSI { 2342}
   (( segid "    " and resid -1   and name H   ))
   (( segid "    " and resid -2   and name HA  ))
      2.100     0.500     0.500 peak  2342 spectrum    1 weight  0.10000E+01 volume  0.17489E-01 ppm1      8.153 ppm2      4.254 CV     1
 ASSI { 2344}
   (( segid "    " and resid -1   and name H   ))
   (( segid "    " and resid -1   and name HB2 ))
      2.300     0.700     0.700 peak  2344 spectrum    1 weight  0.10000E+01 volume  0.79996E-02 ppm1      8.152 ppm2      3.103 CV     1
 ASSI { 2345}
   (( segid "    " and resid -1   and name H   ))
   (( segid "    " and resid -1   and name HB3 ))
      2.700     0.900     0.900 peak  2345 spectrum    1 weight  0.10000E+01 volume  0.15050E-01 ppm1      8.153 ppm2      2.983 CV     1
 ASSI { 2346}
   (( segid "    " and resid -1   and name H   ))
   (( segid "    " and resid -2   and name HG2 ))
      2.200     2.200     3.800 peak  2346 spectrum    1 weight  0.10000E+01 volume  0.20752E-02 ppm1      8.151 ppm2      1.705 CV     1
 ASSI { 2347}
   (( segid "    " and resid -1   and name H   ))
   (( segid "    " and resid -2   and name HB2 ))
      3.100     1.200     1.200 peak  2347 spectrum    1 weight  0.10000E+01 volume  0.33023E-02 ppm1      8.152 ppm2      1.600 CV     1
 ASSI { 2348}
   (( segid "    " and resid -1   and name H   ))
   (( segid "    " and resid -2   and name HB3 ))
      3.600     1.700     1.700 peak  2348 spectrum    1 weight  0.10000E+01 volume  0.21171E-02 ppm1      8.153 ppm2      2.099 CV     1
 ASSI { 2349}
   (( segid "    " and resid -1   and name H   ))
   (  segid "    " and resid 0    and name HG2%)
      3.900     1.900     1.900 peak  2349 spectrum    1 weight  0.10000E+01 volume  0.11815E-02 ppm1      8.153 ppm2      1.124 CV     1
 ASSI { 2350}
   (( segid "    " and resid -3   and name H   ))
   (( segid "    " and resid -3   and name HA  ))
      2.700     0.900     0.900 peak  2350 spectrum    1 weight  0.10000E+01 volume  0.38644E-02 ppm1      8.372 ppm2      4.793 CV     1
 ASSI { 2351}
   (( segid "    " and resid -3   and name H   ))
   (( segid "    " and resid -4   and name HA  ))
      2.000     0.500     0.500 peak  2351 spectrum    1 weight  0.10000E+01 volume  0.18204E-01 ppm1      8.372 ppm2      4.121 CV     1
 ASSI { 2352}
   (( segid "    " and resid -3   and name H   ))
   (( segid "    " and resid -2   and name HD3 ))
      4.500     2.500     1.500 peak  2352 spectrum    1 weight  0.10000E+01 volume  0.81559E-03 ppm1      8.371 ppm2      3.785 CV     1
 ASSI { 2353}
   (( segid "    " and resid -3   and name H   ))
   (( segid "    " and resid -3   and name HB3 ))
      2.900     1.000     1.000 peak  2353 spectrum    1 weight  0.10000E+01 volume  0.56176E-02 ppm1      8.372 ppm2      2.668 CV     1
 ASSI { 2354}
   (( segid "    " and resid -3   and name H   ))
   (( segid "    " and resid -3   and name HB2 ))
      2.500     0.800     0.800 peak  2354 spectrum    1 weight  0.10000E+01 volume  0.82378E-02 ppm1      8.372 ppm2      2.476 CV     1
 ASSI { 2355}
   (( segid "    " and resid -3   and name H   ))
   (( segid "    " and resid -4   and name HB  ))
      3.700     1.700     1.700 peak  2355 spectrum    1 weight  0.10000E+01 volume  0.17989E-02 ppm1      8.372 ppm2      1.732 CV     1
 ASSI { 2356}
   (( segid "    " and resid -3   and name H   ))
   (  segid "    " and resid -4   and name HG2%)
      3.500     1.500     1.500 peak  2356 spectrum    1 weight  0.10000E+01 volume  0.20351E-02 ppm1      8.373 ppm2      0.787 CV     1
 ASSI { 2359}
   (( segid "    " and resid 188  and name H   ))
   (( segid "    " and resid 187  and name HA  ))
      4.100     2.100     1.900 peak  2359 spectrum    1 weight  0.10000E+01 volume  0.26487E-03 ppm1      7.781 ppm2      3.833 CV     1
 ASSI { 2361}
   (( segid "    " and resid 188  and name H   ))
   (( segid "    " and resid 188  and name HB3 ))
      3.800     1.800     1.800 peak  2361 spectrum    1 weight  0.10000E+01 volume  0.48591E-03 ppm1      7.780 ppm2      3.052 CV     1
 ASSI { 2362}
   (( segid "    " and resid 188  and name H   ))
   (( segid "    " and resid 186  and name HB2 ))
      3.700     1.700     1.700 peak  2362 spectrum    1 weight  0.10000E+01 volume  0.44590E-03 ppm1      7.785 ppm2      2.177 CV     1
 ASSI { 2364}
   (( segid "    " and resid 45   and name HD21))
   (( segid "    " and resid 45   and name H   ))
      3.500     1.500     1.500 peak  2364 spectrum    1 weight  0.10000E+01 volume  0.67456E-03 ppm1      7.559 ppm2      8.555 CV     1
 ASSI { 2365}
   (( segid "    " and resid 45   and name HD22))
   (( segid "    " and resid 45   and name H   ))
      4.700     2.700     1.300 peak  2365 spectrum    1 weight  0.10000E+01 volume  0.63265E-03 ppm1      6.886 ppm2      8.554 CV     1
 ASSI { 2366}
   (( segid "    " and resid 45   and name HD22))
   (( segid "    " and resid 45   and name HD21))
      1.500     0.300     0.700 peak  2366 spectrum    1 weight  0.10000E+01 volume  0.47342E-01 ppm1      6.886 ppm2      7.557 CV     1
 ASSI { 2368}
   (( segid "    " and resid 45   and name HD22))
   (( segid "    " and resid 43   and name HA  ))
      4.200     2.200     1.800 peak  2368 spectrum    1 weight  0.10000E+01 volume  0.12977E-02 ppm1      6.887 ppm2      4.702 CV     1
 ASSI { 2369}
   (( segid "    " and resid 45   and name HD22))
   (( segid "    " and resid 45   and name HA  ))
      4.600     2.600     1.400 peak  2369 spectrum    1 weight  0.10000E+01 volume  0.95851E-03 ppm1      6.887 ppm2      4.630 CV     1
 ASSI { 2370}
   (( segid "    " and resid 45   and name HD21))
   (( segid "    " and resid 43   and name HA  ))
      3.600     1.700     1.700 peak  2370 spectrum    1 weight  0.10000E+01 volume  0.10862E-02 ppm1      7.556 ppm2      4.703 CV     1
 ASSI { 2371}
   (( segid "    " and resid 45   and name HD21))
   (( segid "    " and resid 45   and name HA  ))
      4.300     2.300     1.700 peak  2371 spectrum    1 weight  0.10000E+01 volume  0.99089E-03 ppm1      7.556 ppm2      4.624 CV     1
 ASSI { 2372}
   (( segid "    " and resid 45   and name HD21))
   (( segid "    " and resid 45   and name HB2 ))
      2.400     0.700     0.700 peak  2372 spectrum    1 weight  0.10000E+01 volume  0.38644E-02 ppm1      7.557 ppm2      2.752 CV     1
 ASSI { 2373}
   (( segid "    " and resid 45   and name HD22))
   (( segid "    " and resid 45   and name HB2 ))
      3.700     1.700     1.700 peak  2373 spectrum    1 weight  0.10000E+01 volume  0.34509E-02 ppm1      6.886 ppm2      2.752 CV     1
 ASSI { 2374}
   (( segid "    " and resid 45   and name HD21))
   (( segid "    " and resid 44   and name HG2 ))
      4.200     2.200     1.800 peak  2374 spectrum    1 weight  0.10000E+01 volume  0.36586E-03 ppm1      7.558 ppm2      2.081 CV     1
 ASSI { 2375}
   (( segid "    " and resid 45   and name HD21))
   (( segid "    " and resid 43   and name HB2 ))
      3.700     1.700     1.700 peak  2375 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      7.556 ppm2      1.988 CV     1
 ASSI { 2376}
   (( segid "    " and resid 45   and name HD22))
   (( segid "    " and resid 44   and name HG2 ))
      3.600     1.700     1.700 peak  2376 spectrum    1 weight  0.10000E+01 volume  0.48973E-03 ppm1      6.885 ppm2      2.060 CV     1
 ASSI { 2377}
   (( segid "    " and resid 45   and name HD22))
   (( segid "    " and resid 43   and name HB2 ))
      2.900     2.900     3.100 peak  2377 spectrum    1 weight  0.10000E+01 volume  0.43828E-03 ppm1      6.886 ppm2      1.975 CV     1
 ASSI { 2378}
   (( segid "    " and resid 45   and name HD21))
   (( segid "    " and resid 43   and name HB3 ))
      4.200     2.200     1.800 peak  2378 spectrum    1 weight  0.10000E+01 volume  0.40398E-03 ppm1      7.558 ppm2      2.341 CV     1
 ASSI { 2379}
   (( segid "    " and resid 45   and name HD22))
   (( segid "    " and resid 43   and name HB3 ))
      3.000     3.000     3.000 peak  2379 spectrum    1 weight  0.10000E+01 volume  0.32775E-03 ppm1      6.891 ppm2      2.322 CV     1
 ASSI { 2380}
   (( segid "    " and resid 183  and name HE21))
   (( segid "    " and resid 183  and name HE22))
      2.800     1.000     1.000 peak  2380 spectrum    1 weight  0.10000E+01 volume  0.47831E-03 ppm1      6.507 ppm2      7.271 CV     1
 ASSI { 2384}
   (( segid "    " and resid 183  and name HE22))
   (( segid "    " and resid 183  and name HG3 ))
      4.800     2.800     1.200 peak  2384 spectrum    1 weight  0.10000E+01 volume  0.34682E-03 ppm1      7.261 ppm2      2.567 CV     1
 ASSI { 2385}
   (( segid "    " and resid 183  and name HE22))
   (( segid "    " and resid 183  and name HG2 ))
      5.200     3.300     0.800 peak  2385 spectrum    1 weight  0.10000E+01 volume  0.25535E-03 ppm1      7.273 ppm2      2.241 CV     1
 ASSI { 2387}
   (( segid "    " and resid 183  and name HE21))
   (  segid "    " and resid 174  and name HD2%)
      4.700     2.800     1.300 peak  2387 spectrum    1 weight  0.10000E+01 volume  0.28965E-03 ppm1      6.499 ppm2      0.678 CV     1
 OR { 2387}
   (( segid "    " and resid 183  and name HE21))
   (  segid "    " and resid 174  and name HD1%)
 ASSI { 2389}
   (( segid "    " and resid 183  and name HE22))
   (  segid "    " and resid 174  and name HD2%)
      3.700     1.700     1.700 peak  2389 spectrum    1 weight  0.10000E+01 volume  0.25725E-03 ppm1      7.267 ppm2      0.679 CV     1
 OR { 2389}
   (( segid "    " and resid 183  and name HE22))
   (  segid "    " and resid 174  and name HD1%)
 ASSI { 2390}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 75   and name HB3 ))
      3.300     1.400     1.400 peak  2390 spectrum    1 weight  0.10000E+01 volume  0.21895E-02 ppm1      7.532 ppm2      2.686 CV     1
 ASSI { 2391}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 75   and name HB2 ))
      2.800     0.900     0.900 peak  2391 spectrum    1 weight  0.10000E+01 volume  0.27001E-02 ppm1      7.532 ppm2      2.615 CV     1
 ASSI { 2392}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 75   and name HB3 ))
      3.700     1.700     1.700 peak  2392 spectrum    1 weight  0.10000E+01 volume  0.20142E-02 ppm1      7.085 ppm2      2.684 CV     1
 ASSI { 2393}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 75   and name HB2 ))
      3.400     1.400     1.400 peak  2393 spectrum    1 weight  0.10000E+01 volume  0.25916E-02 ppm1      7.086 ppm2      2.616 CV     1
 ASSI { 2394}
   (( segid "    " and resid 75   and name HD22))
   (  segid "    " and resid 6    and name HD2%)
      2.800     2.800     3.200 peak  2394 spectrum    1 weight  0.10000E+01 volume  0.47831E-03 ppm1      7.091 ppm2      0.874 CV     1
 ASSI { 2395}
   (( segid "    " and resid 75   and name HD22))
   (  segid "    " and resid 4    and name HD1%)
      4.400     2.500     1.600 peak  2395 spectrum    1 weight  0.10000E+01 volume  0.68410E-03 ppm1      7.086 ppm2      0.708 CV     1
 ASSI { 2397}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 5    and name HB2 ))
      4.800     2.900     1.200 peak  2397 spectrum    1 weight  0.10000E+01 volume  0.32966E-03 ppm1      7.086 ppm2      3.555 CV     1
 ASSI { 2398}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 5    and name HB2 ))
      4.900     2.900     1.100 peak  2398 spectrum    1 weight  0.10000E+01 volume  0.33157E-03 ppm1      7.533 ppm2      3.547 CV     1
 ASSI { 2399}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 74   and name HA  ))
      4.200     2.200     1.800 peak  2399 spectrum    1 weight  0.10000E+01 volume  0.32203E-03 ppm1      7.533 ppm2      4.460 CV     1
 ASSI { 2400}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 75   and name HD22))
      1.500     0.300     0.700 peak  2400 spectrum    1 weight  0.10000E+01 volume  0.14524E-01 ppm1      7.531 ppm2      7.085 CV     1
 ASSI { 2402}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 5    and name H   ))
      3.200     1.300     1.300 peak  2402 spectrum    1 weight  0.10000E+01 volume  0.49544E-03 ppm1      7.090 ppm2      8.665 CV     1
 ASSI { 2407}
   (( segid "    " and resid 202  and name HE22))
   (( segid "    " and resid 202  and name HG3 ))
      3.500     1.500     1.500 peak  2407 spectrum    1 weight  0.10000E+01 volume  0.38892E-02 ppm1      7.436 ppm2      2.210 CV     1
 OR { 2407}
   (( segid "    " and resid 202  and name HE22))
   (( segid "    " and resid 202  and name HG2 ))
 ASSI { 2408}
   (( segid "    " and resid 202  and name HE21))
   (( segid "    " and resid 202  and name HG3 ))
      3.200     1.300     1.300 peak  2408 spectrum    1 weight  0.10000E+01 volume  0.16674E-02 ppm1      6.684 ppm2      2.215 CV     1
 OR { 2408}
   (( segid "    " and resid 202  and name HE21))
   (( segid "    " and resid 202  and name HG2 ))
 ASSI { 2409}
   (( segid "    " and resid 172  and name HD22))
   (  segid "    " and resid 133  and name HD1%)
      3.300     1.400     1.400 peak  2409 spectrum    1 weight  0.10000E+01 volume  0.10728E-02 ppm1      6.982 ppm2      0.813 CV     1
 OR { 2409}
   (( segid "    " and resid 172  and name HD22))
   (  segid "    " and resid 133  and name HD2%)
 ASSI { 2411}
   (( segid "    " and resid 172  and name HD21))
   (  segid "    " and resid 133  and name HD1%)
      3.500     1.500     1.500 peak  2411 spectrum    1 weight  0.10000E+01 volume  0.82510E-03 ppm1      7.389 ppm2      0.813 CV     1
 OR { 2411}
   (( segid "    " and resid 172  and name HD21))
   (  segid "    " and resid 133  and name HD2%)
 ASSI { 2413}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 133  and name HG  ))
      2.800     1.000     1.000 peak  2413 spectrum    1 weight  0.10000E+01 volume  0.10023E-02 ppm1      6.981 ppm2      1.498 CV     1
 ASSI { 2414}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 135  and name HB3 ))
      2.400     2.400     3.600 peak  2414 spectrum    1 weight  0.10000E+01 volume  0.12481E-02 ppm1      6.981 ppm2      1.992 CV     1
 ASSI { 2415}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 135  and name HB2 ))
      3.400     1.400     1.400 peak  2415 spectrum    1 weight  0.10000E+01 volume  0.12863E-02 ppm1      6.983 ppm2      1.912 CV     1
 ASSI { 2416}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 135  and name HB2 ))
      4.400     2.500     1.600 peak  2416 spectrum    1 weight  0.10000E+01 volume  0.10004E-02 ppm1      7.390 ppm2      1.912 CV     1
 ASSI { 2417}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 135  and name HG3 ))
      4.700     2.700     1.300 peak  2417 spectrum    1 weight  0.10000E+01 volume  0.77365E-03 ppm1      7.390 ppm2      2.146 CV     1
 ASSI { 2418}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 135  and name HG3 ))
      3.900     1.900     1.900 peak  2418 spectrum    1 weight  0.10000E+01 volume  0.94897E-03 ppm1      6.982 ppm2      2.143 CV     1
 ASSI { 2419}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 172  and name HB3 ))
      3.400     1.500     1.500 peak  2419 spectrum    1 weight  0.10000E+01 volume  0.37693E-02 ppm1      6.982 ppm2      2.629 CV     1
 ASSI { 2420}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 172  and name HB3 ))
      2.900     1.000     1.000 peak  2420 spectrum    1 weight  0.10000E+01 volume  0.40168E-02 ppm1      7.390 ppm2      2.629 CV     1
 ASSI { 2421}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 172  and name HB2 ))
      3.300     1.400     1.400 peak  2421 spectrum    1 weight  0.10000E+01 volume  0.27973E-02 ppm1      6.982 ppm2      2.822 CV     1
 ASSI { 2424}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 169  and name HA  ))
      4.700     2.700     1.300 peak  2424 spectrum    1 weight  0.10000E+01 volume  0.94517E-03 ppm1      7.389 ppm2      4.449 CV     1
 ASSI { 2425}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 132  and name HA  ))
      3.600     1.600     1.600 peak  2425 spectrum    1 weight  0.10000E+01 volume  0.11681E-02 ppm1      7.389 ppm2      4.137 CV     1
 ASSI { 2426}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 172  and name HA  ))
      4.100     2.100     1.900 peak  2426 spectrum    1 weight  0.10000E+01 volume  0.10976E-02 ppm1      6.982 ppm2      4.763 CV     1
 ASSI { 2428}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 172  and name HD22))
      1.300     0.200     0.900 peak  2428 spectrum    1 weight  0.10000E+01 volume  0.34863E-01 ppm1      7.390 ppm2      6.981 CV     1
 ASSI { 2430}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 169  and name H   ))
      3.400     1.400     1.400 peak  2430 spectrum    1 weight  0.10000E+01 volume  0.10481E-02 ppm1      6.982 ppm2      8.336 CV     1
 ASSI { 2431}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 133  and name H   ))
      4.200     2.200     1.800 peak  2431 spectrum    1 weight  0.10000E+01 volume  0.88038E-03 ppm1      6.981 ppm2      8.197 CV     1
 ASSI { 2432}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 172  and name H   ))
      3.400     1.500     1.500 peak  2432 spectrum    1 weight  0.10000E+01 volume  0.12691E-02 ppm1      7.390 ppm2      8.338 CV     1
 ASSI { 2433}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 133  and name H   ))
      4.000     2.000     2.000 peak  2433 spectrum    1 weight  0.10000E+01 volume  0.77176E-03 ppm1      7.388 ppm2      8.190 CV     1
 ASSI { 2434}
   (( segid "    " and resid 12   and name HD22))
   (( segid "    " and resid 12   and name HD21))
      1.400     0.300     0.800 peak  2434 spectrum    1 weight  0.10000E+01 volume  0.63613E-01 ppm1      6.814 ppm2      7.499 CV     1
 ASSI { 2436}
   (( segid "    " and resid 12   and name HD22))
   (( segid "    " and resid 12   and name HA  ))
      4.800     2.900     1.200 peak  2436 spectrum    1 weight  0.10000E+01 volume  0.11681E-02 ppm1      6.813 ppm2      4.648 CV     1
 ASSI { 2438}
   (( segid "    " and resid 12   and name HD22))
   (( segid "    " and resid 12   and name HB2 ))
      3.400     1.400     1.400 peak  2438 spectrum    1 weight  0.10000E+01 volume  0.52956E-02 ppm1      6.814 ppm2      2.842 CV     1
 ASSI { 2439}
   (( segid "    " and resid 12   and name HD21))
   (( segid "    " and resid 12   and name HB2 ))
      2.400     0.700     0.700 peak  2439 spectrum    1 weight  0.10000E+01 volume  0.66084E-02 ppm1      7.498 ppm2      2.843 CV     1
 ASSI { 2440}
   (( segid "    " and resid 12   and name HD22))
   (  segid "    " and resid 13   and name HG1%)
      5.000     3.100     1.000 peak  2440 spectrum    1 weight  0.10000E+01 volume  0.52594E-03 ppm1      6.813 ppm2      0.906 CV     1
 ASSI { 2441}
   (( segid "    " and resid 12   and name HD21))
   (  segid "    " and resid 13   and name HG1%)
      5.000     3.100     1.000 peak  2441 spectrum    1 weight  0.10000E+01 volume  0.48020E-03 ppm1      7.504 ppm2      0.913 CV     1
 ASSI { 2442}
   (( segid "    " and resid 123  and name HD21))
   (( segid "    " and resid 123  and name HD22))
      1.800     0.400     0.400 peak  2442 spectrum    1 weight  0.10000E+01 volume  0.12761E-01 ppm1      7.676 ppm2      6.688 CV     1
 ASSI { 2444}
   (( segid "    " and resid 123  and name HD21))
   (( segid "    " and resid 123  and name HA  ))
      3.900     1.900     1.900 peak  2444 spectrum    1 weight  0.10000E+01 volume  0.88227E-03 ppm1      7.676 ppm2      4.897 CV     1
 ASSI { 2446}
   (( segid "    " and resid 123  and name HD21))
   (( segid "    " and resid 126  and name HA  ))
      4.900     3.100     1.100 peak  2446 spectrum    1 weight  0.10000E+01 volume  0.40778E-03 ppm1      7.675 ppm2      4.184 CV     1
 ASSI { 2447}
   (( segid "    " and resid 123  and name HD21))
   (( segid "    " and resid 123  and name HB2 ))
      2.900     1.000     1.000 peak  2447 spectrum    1 weight  0.10000E+01 volume  0.23153E-02 ppm1      7.676 ppm2      2.781 CV     1
 ASSI { 2449}
   (( segid "    " and resid 123  and name HD21))
   (( segid "    " and resid 126  and name HG3 ))
      4.100     2.100     1.900 peak  2449 spectrum    1 weight  0.10000E+01 volume  0.56023E-03 ppm1      7.676 ppm2      2.108 CV     1
 OR { 2449}
   (( segid "    " and resid 123  and name HD21))
   (( segid "    " and resid 126  and name HB3 ))
 ASSI { 2450}
   (( segid "    " and resid 123  and name HD22))
   (( segid "    " and resid 123  and name HB2 ))
      3.800     1.800     1.800 peak  2450 spectrum    1 weight  0.10000E+01 volume  0.21457E-02 ppm1      6.690 ppm2      2.782 CV     1
 ASSI { 2451}
   (( segid "    " and resid 123  and name HD22))
   (( segid "    " and resid 123  and name HB3 ))
      4.300     2.300     1.700 peak  2451 spectrum    1 weight  0.10000E+01 volume  0.11510E-02 ppm1      6.694 ppm2      2.725 CV     1
 ASSI { 2452}
   (( segid "    " and resid 123  and name HD21))
   (( segid "    " and resid 126  and name HG2 ))
      3.200     1.300     1.300 peak  2452 spectrum    1 weight  0.10000E+01 volume  0.90514E-03 ppm1      7.675 ppm2      1.827 CV     1
 ASSI { 2453}
   (( segid "    " and resid 123  and name HD22))
   (( segid "    " and resid 126  and name HG2 ))
      4.100     2.100     1.900 peak  2453 spectrum    1 weight  0.10000E+01 volume  0.84797E-03 ppm1      6.690 ppm2      1.831 CV     1
 ASSI { 2454}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 18   and name HE22))
      1.300     0.200     0.900 peak  2454 spectrum    1 weight  0.10000E+01 volume  0.83996E-01 ppm1      7.203 ppm2      6.674 CV     1
 ASSI { 2456}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 18   and name HA  ))
      4.600     2.700     1.400 peak  2456 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1      7.205 ppm2      5.275 CV     1
 ASSI { 2457}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 5    and name HA  ))
      3.900     1.900     1.900 peak  2457 spectrum    1 weight  0.10000E+01 volume  0.87847E-03 ppm1      7.201 ppm2      4.889 CV     1
 ASSI { 2458}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 17   and name HA  ))
      3.900     1.900     1.900 peak  2458 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      7.201 ppm2      4.377 CV     1
 ASSI { 2459}
   (( segid "    " and resid 18   and name HE22))
   (( segid "    " and resid 17   and name HA  ))
      2.800     2.800     3.200 peak  2459 spectrum    1 weight  0.10000E+01 volume  0.54690E-03 ppm1      6.673 ppm2      4.378 CV     1
 ASSI { 2460}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 5    and name HB2 ))
      4.100     2.100     1.900 peak  2460 spectrum    1 weight  0.10000E+01 volume  0.10728E-02 ppm1      7.202 ppm2      3.564 CV     1
 ASSI { 2461}
   (( segid "    " and resid 18   and name HE22))
   (( segid "    " and resid 5    and name HB3 ))
      4.800     2.800     1.200 peak  2461 spectrum    1 weight  0.10000E+01 volume  0.56215E-03 ppm1      6.680 ppm2      3.590 CV     1
 ASSI { 2462}
   (( segid "    " and resid 18   and name HE22))
   (( segid "    " and resid 5    and name HB2 ))
      2.600     2.600     3.400 peak  2462 spectrum    1 weight  0.10000E+01 volume  0.74698E-03 ppm1      6.680 ppm2      3.534 CV     1
 ASSI { 2463}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 5    and name HB3 ))
      3.400     1.500     1.500 peak  2463 spectrum    1 weight  0.10000E+01 volume  0.77747E-03 ppm1      7.203 ppm2      3.592 CV     1
 ASSI { 2464}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 18   and name HG3 ))
      2.000     0.500     0.500 peak  2464 spectrum    1 weight  0.10000E+01 volume  0.74680E-02 ppm1      7.203 ppm2      2.025 CV     1
 ASSI { 2465}
   (( segid "    " and resid 18   and name HE22))
   (( segid "    " and resid 18   and name HG3 ))
      3.200     1.300     1.300 peak  2465 spectrum    1 weight  0.10000E+01 volume  0.58711E-02 ppm1      6.674 ppm2      2.024 CV     1
 ASSI { 2466}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 18   and name HB2 ))
      3.700     1.700     1.700 peak  2466 spectrum    1 weight  0.10000E+01 volume  0.10519E-02 ppm1      7.203 ppm2      1.589 CV     1
 ASSI { 2467}
   (( segid "    " and resid 18   and name HE21))
   (( segid "    " and resid 18   and name HB3 ))
      4.400     2.400     1.600 peak  2467 spectrum    1 weight  0.10000E+01 volume  0.11548E-02 ppm1      7.203 ppm2      1.449 CV     1
 ASSI { 2468}
   (( segid "    " and resid 18   and name HE22))
   (( segid "    " and resid 18   and name HB3 ))
      2.400     2.400     3.600 peak  2468 spectrum    1 weight  0.10000E+01 volume  0.12805E-02 ppm1      6.675 ppm2      1.454 CV     1
 ASSI { 2469}
   (( segid "    " and resid 18   and name HE22))
   (( segid "    " and resid 18   and name HB2 ))
      3.900     1.900     1.900 peak  2469 spectrum    1 weight  0.10000E+01 volume  0.10500E-02 ppm1      6.674 ppm2      1.590 CV     1
 ASSI { 2472}
   (( segid "    " and resid 18   and name HE21))
   (  segid "    " and resid 16   and name HG2%)
      3.100     1.200     1.200 peak  2472 spectrum    1 weight  0.10000E+01 volume  0.17855E-02 ppm1      7.202 ppm2      0.929 CV     1
 ASSI { 2473}
   (( segid "    " and resid 18   and name HE22))
   (  segid "    " and resid 16   and name HG2%)
      3.600     1.600     1.600 peak  2473 spectrum    1 weight  0.10000E+01 volume  0.17512E-02 ppm1      6.674 ppm2      0.929 CV     1
 ASSI { 2474}
   (( segid "    " and resid 85   and name HE22))
   (  segid "    " and resid 102  and name HG1%)
      4.800     2.800     1.200 peak  2474 spectrum    1 weight  0.10000E+01 volume  0.60215E-03 ppm1      7.283 ppm2      0.736 CV     1
 ASSI { 2475}
   (( segid "    " and resid 85   and name HE21))
   (  segid "    " and resid 102  and name HG1%)
      4.900     3.000     1.100 peak  2475 spectrum    1 weight  0.10000E+01 volume  0.62502E-03 ppm1      6.456 ppm2      0.738 CV     1
 ASSI { 2476}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 83   and name HG2 ))
      5.500     3.800     0.500 peak  2476 spectrum    1 weight  0.10000E+01 volume  0.38682E-03 ppm1      6.459 ppm2      0.932 CV     1
 ASSI { 2478}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 84   and name HB2 ))
      4.100     2.100     1.900 peak  2478 spectrum    1 weight  0.10000E+01 volume  0.66505E-03 ppm1      6.459 ppm2      1.156 CV     1
 ASSI { 2479}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 85   and name HB2 ))
      4.000     2.000     2.000 peak  2479 spectrum    1 weight  0.10000E+01 volume  0.10728E-02 ppm1      6.457 ppm2      1.560 CV     1
 ASSI { 2480}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HB3 ))
      3.700     1.700     1.700 peak  2480 spectrum    1 weight  0.10000E+01 volume  0.11262E-02 ppm1      7.283 ppm2      1.611 CV     1
 ASSI { 2481}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 85   and name HB3 ))
      3.100     1.200     1.200 peak  2481 spectrum    1 weight  0.10000E+01 volume  0.85751E-03 ppm1      6.457 ppm2      1.605 CV     1
 ASSI { 2484}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 85   and name HG2 ))
      2.200     0.600     0.600 peak  2484 spectrum    1 weight  0.10000E+01 volume  0.34547E-02 ppm1      6.457 ppm2      1.885 CV     1
 ASSI { 2485}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HG2 ))
      3.100     1.200     1.200 peak  2485 spectrum    1 weight  0.10000E+01 volume  0.50041E-02 ppm1      7.283 ppm2      1.886 CV     1
 ASSI { 2486}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HG3 ))
      3.700     1.700     1.700 peak  2486 spectrum    1 weight  0.10000E+01 volume  0.25973E-02 ppm1      7.283 ppm2      2.071 CV     1
 ASSI { 2487}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 85   and name HG3 ))
      3.400     1.500     1.500 peak  2487 spectrum    1 weight  0.10000E+01 volume  0.18674E-02 ppm1      6.456 ppm2      2.071 CV     1
 ASSI { 2488}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 103  and name HB2 ))
      4.300     2.300     1.700 peak  2488 spectrum    1 weight  0.10000E+01 volume  0.12272E-02 ppm1      7.283 ppm2      2.248 CV     1
 ASSI { 2489}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 103  and name HB2 ))
      3.500     1.500     1.500 peak  2489 spectrum    1 weight  0.10000E+01 volume  0.12634E-02 ppm1      6.456 ppm2      2.249 CV     1
 ASSI { 2490}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 103  and name HB3 ))
      4.700     2.700     1.300 peak  2490 spectrum    1 weight  0.10000E+01 volume  0.10690E-02 ppm1      7.283 ppm2      2.625 CV     1
 ASSI { 2491}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 103  and name HB3 ))
      3.700     1.700     1.700 peak  2491 spectrum    1 weight  0.10000E+01 volume  0.11052E-02 ppm1      6.457 ppm2      2.611 CV     1
 ASSI { 2492}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 103  and name HA  ))
      4.800     2.900     1.200 peak  2492 spectrum    1 weight  0.10000E+01 volume  0.79652E-03 ppm1      7.281 ppm2      4.186 CV     1
 ASSI { 2493}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 103  and name HA  ))
      3.200     1.200     1.200 peak  2493 spectrum    1 weight  0.10000E+01 volume  0.79463E-03 ppm1      6.458 ppm2      4.194 CV     1
 ASSI { 2494}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 46   and name HA  ))
      3.700     1.700     1.700 peak  2494 spectrum    1 weight  0.10000E+01 volume  0.90514E-03 ppm1      6.457 ppm2      4.474 CV     1
 ASSI { 2495}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 46   and name HA  ))
      2.500     2.500     3.500 peak  2495 spectrum    1 weight  0.10000E+01 volume  0.11472E-02 ppm1      7.282 ppm2      4.476 CV     1
 ASSI { 2497}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 102  and name HA  ))
      3.700     1.700     1.700 peak  2497 spectrum    1 weight  0.10000E+01 volume  0.93755E-03 ppm1      6.457 ppm2      4.643 CV     1
 ASSI { 2498}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HE21))
      1.300     0.200     0.900 peak  2498 spectrum    1 weight  0.10000E+01 volume  0.72294E-01 ppm1      7.282 ppm2      6.457 CV     1
 ASSI { 2500}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 103  and name H   ))
      3.100     1.200     1.200 peak  2500 spectrum    1 weight  0.10000E+01 volume  0.74127E-03 ppm1      6.456 ppm2      8.024 CV     1
 ASSI { 2501}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 103  and name H   ))
      4.300     2.300     1.700 peak  2501 spectrum    1 weight  0.10000E+01 volume  0.56786E-03 ppm1      7.280 ppm2      8.022 CV     1
 ASSI { 2502}
   (( segid "    " and resid 91   and name HE  ))
   (  segid "    " and resid 190  and name HG2%)
      3.200     1.300     1.300 peak  2502 spectrum    1 weight  0.10000E+01 volume  0.15873E-02 ppm1      7.935 ppm2      0.930 CV     1
 ASSI { 2505}
   (( segid "    " and resid 91   and name HE  ))
   (( segid "    " and resid 91   and name HB2 ))
      2.600     0.800     0.800 peak  2505 spectrum    1 weight  0.10000E+01 volume  0.21990E-02 ppm1      7.934 ppm2      1.371 CV     1
 OR { 2505}
   (( segid "    " and resid 91   and name HE  ))
   (( segid "    " and resid 91   and name HG3 ))
 ASSI { 2506}
   (( segid "    " and resid 91   and name HE  ))
   (( segid "    " and resid 91   and name HB3 ))
      4.000     2.000     2.000 peak  2506 spectrum    1 weight  0.10000E+01 volume  0.12596E-02 ppm1      7.934 ppm2      1.697 CV     1
 ASSI { 2507}
   (( segid "    " and resid 91   and name HE  ))
   (( segid "    " and resid 91   and name HD3 ))
      2.900     1.000     1.000 peak  2507 spectrum    1 weight  0.10000E+01 volume  0.22200E-02 ppm1      7.934 ppm2      3.167 CV     1
 ASSI { 2508}
   (( segid "    " and resid 91   and name HE  ))
   (( segid "    " and resid 91   and name HD2 ))
      2.700     0.900     0.900 peak  2508 spectrum    1 weight  0.10000E+01 volume  0.31405E-02 ppm1      7.934 ppm2      2.988 CV     1
 ASSI { 2509}
   (( segid "    " and resid 91   and name HE  ))
   (( segid "    " and resid 91   and name HA  ))
      4.600     2.600     1.400 peak  2509 spectrum    1 weight  0.10000E+01 volume  0.54307E-03 ppm1      7.934 ppm2      4.807 CV     1
 ASSI { 2510}
   (( segid "    " and resid 91   and name HE  ))
   (( segid "    " and resid 91   and name HH21))
      3.800     1.800     1.800 peak  2510 spectrum    1 weight  0.10000E+01 volume  0.23477E-02 ppm1      7.934 ppm2      6.797 CV     1
 ASSI { 2511}
   (( segid "    " and resid 91   and name HE  ))
   (( segid "    " and resid 91   and name H   ))
      5.500     3.800     0.500 peak  2511 spectrum    1 weight  0.10000E+01 volume  0.32395E-03 ppm1      7.933 ppm2      9.222 CV     1
 ASSI { 2514}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name HA  ))
      5.500     3.800     0.500 peak  2514 spectrum    1 weight  0.10000E+01 volume  0.27058E-03 ppm1      7.665 ppm2      3.553 CV     1
 ASSI { 2515}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name HD3 ))
      3.400     1.500     1.500 peak  2515 spectrum    1 weight  0.10000E+01 volume  0.70886E-03 ppm1      7.674 ppm2      3.036 CV     1
 OR { 2515}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name HD2 ))
 ASSI { 2516}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name HB2 ))
      3.200     1.300     1.300 peak  2516 spectrum    1 weight  0.10000E+01 volume  0.11376E-02 ppm1      7.668 ppm2      1.714 CV     1
 OR { 2516}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name HB3 ))
 ASSI { 2517}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 44   and name HG3 ))
      4.800     2.900     1.200 peak  2517 spectrum    1 weight  0.10000E+01 volume  0.38491E-03 ppm1      7.674 ppm2      1.900 CV     1
 ASSI { 2518}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 30   and name HB2 ))
      5.500     3.700     0.500 peak  2518 spectrum    1 weight  0.10000E+01 volume  0.23820E-03 ppm1      7.665 ppm2      2.089 CV     1
 ASSI { 2519}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 44   and name HB2 ))
      4.400     2.400     1.600 peak  2519 spectrum    1 weight  0.10000E+01 volume  0.31061E-03 ppm1      7.667 ppm2      2.157 CV     1
 ASSI { 2520}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 44   and name HB3 ))
      4.300     2.300     1.700 peak  2520 spectrum    1 weight  0.10000E+01 volume  0.27441E-03 ppm1      7.671 ppm2      2.002 CV     1
 ASSI { 2521}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name HG3 ))
      4.000     2.000     2.000 peak  2521 spectrum    1 weight  0.10000E+01 volume  0.46877E-03 ppm1      7.668 ppm2      1.147 CV     1
 OR { 2521}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name HG2 ))
 ASSI { 2522}
   (( segid "    " and resid 33   and name HE  ))
   (  segid "    " and resid 40   and name HD1%)
      5.200     3.400     0.800 peak  2522 spectrum    1 weight  0.10000E+01 volume  0.30490E-03 ppm1      7.663 ppm2      0.843 CV     1
 ASSI { 2523}
   (( segid "    " and resid 33   and name HE  ))
   (  segid "    " and resid 32   and name HG2%)
      4.100     2.100     1.900 peak  2523 spectrum    1 weight  0.10000E+01 volume  0.70506E-03 ppm1      7.669 ppm2      0.736 CV     1
 ASSI { 2524}
   (( segid "    " and resid 86   and name HE  ))
   (  segid "    " and resid 102  and name HG2%)
      3.700     1.700     1.700 peak  2524 spectrum    1 weight  0.10000E+01 volume  0.17969E-02 ppm1      7.406 ppm2      0.735 CV     1
 ASSI { 2525}
   (( segid "    " and resid 178  and name HE  ))
   (  segid "    " and resid 179  and name HG2%)
      5.200     3.400     0.800 peak  2525 spectrum    1 weight  0.10000E+01 volume  0.62122E-03 ppm1      7.409 ppm2      1.182 CV     1
 ASSI { 2526}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 178  and name HG2 ))
      3.000     1.100     1.100 peak  2526 spectrum    1 weight  0.10000E+01 volume  0.17836E-02 ppm1      7.407 ppm2      1.629 CV     1
 ASSI { 2530}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 187  and name HG3 ))
      3.200     1.300     1.300 peak  2530 spectrum    1 weight  0.10000E+01 volume  0.86702E-03 ppm1      7.408 ppm2      2.225 CV     1
 ASSI { 2531}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 178  and name HD2 ))
      2.500     0.800     0.800 peak  2531 spectrum    1 weight  0.10000E+01 volume  0.58292E-02 ppm1      7.408 ppm2      3.066 CV     1
 OR { 2531}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 178  and name HD3 ))
 ASSI { 2532}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 86   and name HD3 ))
      2.700     0.900     0.900 peak  2532 spectrum    1 weight  0.10000E+01 volume  0.15969E-02 ppm1      7.407 ppm2      2.899 CV     1
 ASSI { 2533}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 86   and name HD2 ))
      3.100     1.200     1.200 peak  2533 spectrum    1 weight  0.10000E+01 volume  0.14692E-02 ppm1      7.407 ppm2      2.974 CV     1
 ASSI { 2534}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 178  and name HA  ))
      4.200     2.200     1.800 peak  2534 spectrum    1 weight  0.10000E+01 volume  0.10766E-02 ppm1      7.407 ppm2      4.876 CV     1
 ASSI { 2535}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 175  and name H   ))
      2.700     2.700     3.300 peak  2535 spectrum    1 weight  0.10000E+01 volume  0.61740E-03 ppm1      7.408 ppm2      9.115 CV     1
 ASSI { 2536}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 86   and name H   ))
      4.900     3.100     1.100 peak  2536 spectrum    1 weight  0.10000E+01 volume  0.55070E-03 ppm1      7.399 ppm2      9.316 CV     1
 ASSI { 2537}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 179  and name H   ))
      5.000     3.100     1.000 peak  2537 spectrum    1 weight  0.10000E+01 volume  0.48402E-03 ppm1      7.409 ppm2      9.365 CV     1
 ASSI { 2538}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name H   ))
      3.300     1.300     1.300 peak  2538 spectrum    1 weight  0.10000E+01 volume  0.10500E-02 ppm1      7.403 ppm2      8.908 CV     1
 ASSI { 2539}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 75   and name H   ))
      4.800     2.800     1.200 peak  2539 spectrum    1 weight  0.10000E+01 volume  0.57168E-03 ppm1      7.404 ppm2      8.366 CV     1
 ASSI { 2540}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HA  ))
      4.000     2.000     2.000 peak  2540 spectrum    1 weight  0.10000E+01 volume  0.87084E-03 ppm1      7.401 ppm2      4.453 CV     1
 ASSI { 2541}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 73   and name HA  ))
      3.700     1.800     1.800 peak  2541 spectrum    1 weight  0.10000E+01 volume  0.57928E-03 ppm1      7.400 ppm2      4.213 CV     1
 ASSI { 2542}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HD2 ))
      2.600     0.900     0.900 peak  2542 spectrum    1 weight  0.10000E+01 volume  0.40817E-02 ppm1      7.402 ppm2      3.181 CV     1
 ASSI { 2543}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HD3 ))
      2.800     1.000     1.000 peak  2543 spectrum    1 weight  0.10000E+01 volume  0.33728E-02 ppm1      7.402 ppm2      3.117 CV     1
 ASSI { 2544}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HB2 ))
      3.400     1.400     1.400 peak  2544 spectrum    1 weight  0.10000E+01 volume  0.17779E-02 ppm1      7.403 ppm2      1.724 CV     1
 ASSI { 2545}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HG3 ))
      2.700     0.900     0.900 peak  2545 spectrum    1 weight  0.10000E+01 volume  0.38398E-02 ppm1      7.403 ppm2      1.630 CV     1
 ASSI { 2546}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HG2 ))
      2.900     1.000     1.000 peak  2546 spectrum    1 weight  0.10000E+01 volume  0.34700E-02 ppm1      7.404 ppm2      1.575 CV     1
 ASSI { 2547}
   (( segid "    " and resid 74   and name HE  ))
   (  segid "    " and resid 73   and name HD2%)
      4.500     2.500     1.500 peak  2547 spectrum    1 weight  0.10000E+01 volume  0.60977E-03 ppm1      7.404 ppm2      0.826 CV     1
 ASSI { 2548}
   (( segid "    " and resid 74   and name HE  ))
   (  segid "    " and resid 4    and name HD2%)
      4.800     2.900     1.200 peak  2548 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      7.407 ppm2      0.718 CV     1
 OR { 2548}
   (( segid "    " and resid 74   and name HE  ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 2549}
   (( segid "    " and resid 194  and name HE  ))
   (  segid "    " and resid 130  and name HG1%)
      2.800     2.800     3.200 peak  2549 spectrum    1 weight  0.10000E+01 volume  0.55832E-03 ppm1      7.329 ppm2      0.226 CV     1
 ASSI { 2550}
   (( segid "    " and resid 194  and name HE  ))
   (  segid "    " and resid 130  and name HG2%)
      2.900     2.900     3.100 peak  2550 spectrum    1 weight  0.10000E+01 volume  0.45924E-03 ppm1      7.329 ppm2      0.479 CV     1
 ASSI { 2551}
   (( segid "    " and resid 194  and name HE  ))
   (  segid "    " and resid 192  and name HD1%)
      4.100     2.100     1.900 peak  2551 spectrum    1 weight  0.10000E+01 volume  0.13187E-02 ppm1      7.330 ppm2      0.704 CV     1
 ASSI { 2552}
   (( segid "    " and resid 194  and name HE  ))
   (  segid "    " and resid 93   and name HD1%)
      4.700     2.700     1.300 peak  2552 spectrum    1 weight  0.10000E+01 volume  0.45732E-03 ppm1      7.330 ppm2      0.953 CV     1
 ASSI { 2553}
   (( segid "    " and resid 194  and name HE  ))
   (( segid "    " and resid 194  and name HG3 ))
      3.000     1.100     1.100 peak  2553 spectrum    1 weight  0.10000E+01 volume  0.20371E-02 ppm1      7.330 ppm2      1.424 CV     1
 OR { 2553}
   (( segid "    " and resid 194  and name HE  ))
   (( segid "    " and resid 194  and name HG2 ))
 ASSI { 2554}
   (( segid "    " and resid 194  and name HE  ))
   (( segid "    " and resid 194  and name HB2 ))
      4.600     2.700     1.400 peak  2554 spectrum    1 weight  0.10000E+01 volume  0.72411E-03 ppm1      7.331 ppm2      1.491 CV     1
 ASSI { 2555}
   (( segid "    " and resid 194  and name HE  ))
   (( segid "    " and resid 194  and name HB3 ))
      2.700     0.900     0.900 peak  2555 spectrum    1 weight  0.10000E+01 volume  0.62311E-03 ppm1      7.329 ppm2      1.726 CV     1
 ASSI { 2556}
   (( segid "    " and resid 194  and name HE  ))
   (( segid "    " and resid 194  and name HD2 ))
      2.800     1.000     1.000 peak  2556 spectrum    1 weight  0.10000E+01 volume  0.21114E-02 ppm1      7.331 ppm2      2.993 CV     1
 OR { 2556}
   (( segid "    " and resid 194  and name HE  ))
   (( segid "    " and resid 194  and name HD3 ))
 ASSI { 2557}
   (( segid "    " and resid 194  and name HE  ))
   (( segid "    " and resid 173  and name HZ3 ))
      4.500     2.600     1.500 peak  2557 spectrum    1 weight  0.10000E+01 volume  0.65169E-03 ppm1      7.329 ppm2      6.704 CV     1
 ASSI { 2558}
   (( segid "    " and resid 194  and name HE  ))
   (( segid "    " and resid 173  and name HH2 ))
      3.400     1.400     1.400 peak  2558 spectrum    1 weight  0.10000E+01 volume  0.48782E-03 ppm1      7.332 ppm2      6.845 CV     1
 ASSI { 2560}
   (( segid "    " and resid 195  and name HE  ))
   (  segid "    " and resid 198  and name HE% )
      4.900     3.000     1.100 peak  2560 spectrum    1 weight  0.10000E+01 volume  0.39065E-03 ppm1      6.730 ppm2      7.107 CV     1
 ASSI { 2561}
   (( segid "    " and resid 195  and name HE  ))
   (  segid "    " and resid 198  and name HD% )
      4.200     2.200     1.800 peak  2561 spectrum    1 weight  0.10000E+01 volume  0.59835E-03 ppm1      6.728 ppm2      6.969 CV     1
 ASSI { 2562}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 198  and name HA  ))
      3.100     1.200     1.200 peak  2562 spectrum    1 weight  0.10000E+01 volume  0.14292E-02 ppm1      6.730 ppm2      4.408 CV     1
 ASSI { 2563}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 195  and name HA  ))
      5.100     3.300     0.900 peak  2563 spectrum    1 weight  0.10000E+01 volume  0.29728E-03 ppm1      6.724 ppm2      3.613 CV     1
 ASSI { 2564}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 198  and name HB3 ))
      5.500     3.700     0.500 peak  2564 spectrum    1 weight  0.10000E+01 volume  0.28012E-03 ppm1      6.729 ppm2      2.959 CV     1
 ASSI { 2565}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 195  and name HD2 ))
      2.800     1.000     1.000 peak  2565 spectrum    1 weight  0.10000E+01 volume  0.26753E-02 ppm1      6.728 ppm2      2.692 CV     1
 OR { 2565}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 195  and name HD3 ))
 ASSI { 2566}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 126  and name HB3 ))
      3.800     1.800     1.800 peak  2566 spectrum    1 weight  0.10000E+01 volume  0.78890E-03 ppm1      6.729 ppm2      2.081 CV     1
 ASSI { 2567}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 126  and name HB2 ))
      3.300     1.400     1.400 peak  2567 spectrum    1 weight  0.10000E+01 volume  0.78510E-03 ppm1      6.728 ppm2      1.824 CV     1
 ASSI { 2568}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 195  and name HB3 ))
      4.600     2.700     1.400 peak  2568 spectrum    1 weight  0.10000E+01 volume  0.59264E-03 ppm1      6.728 ppm2      1.509 CV     1
 ASSI { 2569}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 195  and name HB2 ))
      4.300     2.300     1.700 peak  2569 spectrum    1 weight  0.10000E+01 volume  0.61740E-03 ppm1      6.729 ppm2      1.198 CV     1
 ASSI { 2570}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 195  and name HG3 ))
      2.800     1.000     1.000 peak  2570 spectrum    1 weight  0.10000E+01 volume  0.24544E-02 ppm1      6.729 ppm2      0.810 CV     1
 OR { 2570}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 195  and name HG2 ))
 ASSI { 2571}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 82   and name HB2 ))
      2.200     0.600     0.600 peak  2571 spectrum    1 weight  0.10000E+01 volume  0.29480E-02 ppm1      6.676 ppm2      1.454 CV     1
 ASSI { 2572}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 82   and name HG3 ))
      2.600     0.900     0.900 peak  2572 spectrum    1 weight  0.10000E+01 volume  0.21171E-02 ppm1      6.676 ppm2      1.536 CV     1
 ASSI { 2574}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 80   and name HB3 ))
      2.300     2.300     3.700 peak  2574 spectrum    1 weight  0.10000E+01 volume  0.16521E-02 ppm1      6.675 ppm2      1.985 CV     1
 OR { 2574}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 80   and name HG2 ))
 ASSI { 2575}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 82   and name HD3 ))
      2.500     0.800     0.800 peak  2575 spectrum    1 weight  0.10000E+01 volume  0.36225E-02 ppm1      6.676 ppm2      2.130 CV     1
 ASSI { 2576}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 82   and name HD2 ))
      2.600     0.900     0.900 peak  2576 spectrum    1 weight  0.10000E+01 volume  0.32452E-02 ppm1      6.676 ppm2      2.418 CV     1
 ASSI { 2578}
   (( segid "    " and resid 82   and name HE  ))
   (  segid "    " and resid 50   and name HD% )
      4.500     2.600     1.500 peak  2578 spectrum    1 weight  0.10000E+01 volume  0.91276E-03 ppm1      6.675 ppm2      5.500 CV     1
 ASSI { 2579}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 61   and name HH2 ))
      2.600     0.800     0.800 peak  2579 spectrum    1 weight  0.10000E+01 volume  0.15092E-02 ppm1      6.676 ppm2      6.493 CV     1
 ASSI { 2580}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 61   and name HZ2 ))
      3.300     1.400     1.400 peak  2580 spectrum    1 weight  0.10000E+01 volume  0.13301E-02 ppm1      6.675 ppm2      7.159 CV     1
 ASSI { 2581}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 83   and name H   ))
      4.400     2.500     1.600 peak  2581 spectrum    1 weight  0.10000E+01 volume  0.51640E-03 ppm1      6.678 ppm2      8.422 CV     1
 ASSI { 2583}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 118  and name HG2 ))
      4.100     2.100     1.900 peak  2583 spectrum    1 weight  0.10000E+01 volume  0.50878E-03 ppm1      7.749 ppm2      1.627 CV     1
 ASSI { 2584}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 118  and name HD3 ))
      4.900     3.000     1.100 peak  2584 spectrum    1 weight  0.10000E+01 volume  0.37731E-03 ppm1      7.755 ppm2      3.144 CV     1
 OR { 2584}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 118  and name HD2 ))
 ASSI { 2585}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 196  and name H   ))
      4.600     2.700     1.400 peak  2585 spectrum    1 weight  0.10000E+01 volume  0.36207E-03 ppm1      7.806 ppm2      8.349 CV     1
 ASSI { 2586}
   (( segid "    " and resid 195  and name HE  ))
   (( segid "    " and resid 126  and name HA  ))
      5.000     3.100     1.000 peak  2586 spectrum    1 weight  0.10000E+01 volume  0.31824E-03 ppm1      6.727 ppm2      4.189 CV     1
 ASSI { 2587}
   (( segid "    " and resid 186  and name H   ))
   (  segid "    " and resid 185  and name HG1%)
      4.400     2.400     1.600 peak  2587 spectrum    1 weight  0.10000E+01 volume  0.10824E-02 ppm1      8.813 ppm2      0.695 CV     1
 ASSI { 2589}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 98   and name H   ))
      5.200     3.400     0.800 peak  2589 spectrum    1 weight  0.10000E+01 volume  0.50115E-03 ppm1      8.936 ppm2      9.138 CV     1
 ASSI { 2591}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 133  and name HB2 ))
      3.900     1.900     1.900 peak  2591 spectrum    1 weight  0.10000E+01 volume  0.84417E-03 ppm1      6.981 ppm2      1.562 CV     1
 ASSI { 2592}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 91   and name HB3 ))
      4.700     2.800     1.300 peak  2592 spectrum    1 weight  0.10000E+01 volume  0.52594E-03 ppm1      8.052 ppm2      1.631 CV     1
 ASSI { 2593}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      4.000     2.000     2.000 peak  2593 spectrum    1 weight  0.10000E+01 volume  0.41923E-03 ppm1      7.882 ppm2      4.576 CV     1
 ASSI { 2594}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 190  and name HB  ))
      4.900     3.000     1.100 peak  2594 spectrum    1 weight  0.10000E+01 volume  0.39827E-03 ppm1      8.420 ppm2      3.891 CV     1
 ASSI { 2596}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 82   and name HA  ))
      4.900     3.100     1.100 peak  2596 spectrum    1 weight  0.10000E+01 volume  0.86131E-03 ppm1      6.679 ppm2      4.704 CV     1
 ASSI { 2598}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 187  and name HB3 ))
      5.000     3.100     1.000 peak  2598 spectrum    1 weight  0.10000E+01 volume  0.60598E-03 ppm1      7.409 ppm2      1.908 CV     1
 OR { 2598}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 187  and name HB2 ))
 ASSI { 2599}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 33   and name H   ))
      4.400     2.400     1.600 peak  2599 spectrum    1 weight  0.10000E+01 volume  0.28583E-03 ppm1      7.669 ppm2      7.456 CV     1
 ASSI { 2600}
   (( segid "    " and resid 33   and name HE  ))
   (  segid "    " and resid 81   and name HE% )
      4.700     2.800     1.300 peak  2600 spectrum    1 weight  0.10000E+01 volume  0.27441E-03 ppm1      7.671 ppm2      6.315 CV     1
 ASSI { 2601}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 104  and name HA  ))
      4.700     2.700     1.300 peak  2601 spectrum    1 weight  0.10000E+01 volume  0.88227E-03 ppm1      7.410 ppm2      4.258 CV     1
 ASSI { 2603}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 172  and name H   ))
      2.700     0.900     0.900 peak  2603 spectrum    1 weight  0.10000E+01 volume  0.21285E-02 ppm1      8.188 ppm2      8.338 CV     1
 ASSI { 2605}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 61   and name HB2 ))
      5.400     3.600     0.600 peak  2605 spectrum    1 weight  0.10000E+01 volume  0.17531E-03 ppm1      8.598 ppm2      3.013 CV     1
 ASSI { 2606}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 61   and name HE3 ))
      3.300     3.300     2.700 peak  2606 spectrum    1 weight  0.10000E+01 volume  0.20961E-03 ppm1      8.600 ppm2      7.512 CV     1
 ASSI { 2607}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 103  and name H   ))
      5.800     4.200     0.200 peak  2607 spectrum    1 weight  0.10000E+01 volume  0.24391E-03 ppm1      8.596 ppm2      8.023 CV     1
 ASSI { 2608}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 84   and name HG3 ))
      3.200     3.200     2.800 peak  2608 spectrum    1 weight  0.10000E+01 volume  0.21914E-03 ppm1      8.594 ppm2      0.039 CV     1
 ASSI { 2609}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 105  and name HA  ))
      5.100     3.200     0.900 peak  2609 spectrum    1 weight  0.10000E+01 volume  0.32586E-03 ppm1      8.464 ppm2      4.153 CV     1
 ASSI { 2612}
   (( segid "    " and resid 3    and name H   ))
   (  segid "    " and resid 2    and name HG2%)
      3.200     1.300     1.300 peak  2612 spectrum    1 weight  0.10000E+01 volume  0.63017E-02 ppm1      7.851 ppm2      0.867 CV     1
 ASSI { 2613}
   (( segid "    " and resid 92   and name H   ))
   (  segid "    " and resid 96   and name HG2%)
      4.900     3.000     1.100 peak  2613 spectrum    1 weight  0.10000E+01 volume  0.31441E-03 ppm1      8.937 ppm2      1.067 CV     1
 ASSI { 2615}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 171  and name HG  ))
      4.500     2.600     1.500 peak  2615 spectrum    1 weight  0.10000E+01 volume  0.94706E-03 ppm1     10.155 ppm2      1.428 CV     1
 ASSI { 2618}
   (( segid "    " and resid 192  and name H   ))
   (  segid "    " and resid 130  and name HG2%)
      4.500     2.600     1.500 peak  2618 spectrum    1 weight  0.10000E+01 volume  0.36969E-03 ppm1      9.075 ppm2      0.483 CV     1
 ASSI { 2619}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 187  and name HA  ))
      3.600     1.600     1.600 peak  2619 spectrum    1 weight  0.10000E+01 volume  0.11395E-02 ppm1      7.021 ppm2      3.828 CV     1
 ASSI { 2620}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 57   and name HG2 ))
      5.000     3.100     1.000 peak  2620 spectrum    1 weight  0.10000E+01 volume  0.71460E-03 ppm1      7.698 ppm2      1.425 CV     1
 ASSI { 2622}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 176  and name HB3 ))
      3.300     1.400     1.400 peak  2622 spectrum    1 weight  0.10000E+01 volume  0.83273E-03 ppm1      8.777 ppm2      3.509 CV     1
 ASSI { 2623}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 176  and name HD2 ))
      5.300     3.500     0.700 peak  2623 spectrum    1 weight  0.10000E+01 volume  0.46306E-03 ppm1      8.778 ppm2      6.955 CV     1
 ASSI { 2624}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 85   and name HB3 ))
      3.200     1.300     1.300 peak  2624 spectrum    1 weight  0.10000E+01 volume  0.24677E-02 ppm1      7.129 ppm2      1.620 CV     1
 ASSI { 2626}
   (( segid "    " and resid 173  and name H   ))
   (( segid "    " and resid 173  and name HE1 ))
      5.000     3.100     1.000 peak  2626 spectrum    1 weight  0.10000E+01 volume  0.57928E-03 ppm1      7.716 ppm2     10.154 CV     1
 ASSI { 2628}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name H   ))
      2.100     0.600     0.600 peak  2628 spectrum    1 weight  0.10000E+01 volume  0.37941E-02 ppm1      8.267 ppm2      8.187 CV     1
 ASSI { 2630}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 15   and name HA  ))
      4.300     2.300     1.700 peak  2630 spectrum    1 weight  0.10000E+01 volume  0.34491E-03 ppm1      8.200 ppm2      4.658 CV     1
 ASSI { 2631}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 7    and name HA  ))
      5.000     3.100     1.000 peak  2631 spectrum    1 weight  0.10000E+01 volume  0.31252E-03 ppm1      8.896 ppm2      4.497 CV     1
 ASSI { 2632}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 19   and name HE% )
      4.500     2.500     1.500 peak  2632 spectrum    1 weight  0.10000E+01 volume  0.32586E-03 ppm1      9.128 ppm2      7.121 CV     1
 ASSI { 2635}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 31   and name HB3 ))
      4.000     2.000     2.000 peak  2635 spectrum    1 weight  0.10000E+01 volume  0.79272E-03 ppm1      8.090 ppm2      2.320 CV     1
 ASSI { 2636}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 96   and name H   ))
      3.900     1.900     1.900 peak  2636 spectrum    1 weight  0.10000E+01 volume  0.10824E-02 ppm1      7.667 ppm2      8.041 CV     1
 ASSI { 2637}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 35   and name HA  ))
      4.800     2.900     1.200 peak  2637 spectrum    1 weight  0.10000E+01 volume  0.62502E-03 ppm1      7.628 ppm2      4.331 CV     1
 ASSI { 2638}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 92   and name HG2 ))
      4.400     2.500     1.600 peak  2638 spectrum    1 weight  0.10000E+01 volume  0.10023E-02 ppm1      7.668 ppm2      2.451 CV     1
 ASSI { 2640}
   (( segid "    " and resid 94   and name H   ))
   (  segid "    " and resid 96   and name HG2%)
      5.500     3.800     0.500 peak  2640 spectrum    1 weight  0.10000E+01 volume  0.47640E-03 ppm1      7.663 ppm2      1.070 CV     1
 ASSI { 2642}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 44   and name HD3 ))
      4.100     2.100     1.900 peak  2642 spectrum    1 weight  0.10000E+01 volume  0.93181E-03 ppm1      8.556 ppm2      3.743 CV     1
 ASSI { 2643}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 57   and name HG2 ))
      4.700     2.800     1.300 peak  2643 spectrum    1 weight  0.10000E+01 volume  0.64407E-03 ppm1      8.023 ppm2      1.434 CV     1
 OR { 2643}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI { 2645}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 30   and name HA  ))
      3.600     1.600     1.600 peak  2645 spectrum    1 weight  0.10000E+01 volume  0.84989E-03 ppm1      8.330 ppm2      3.823 CV     1
 ASSI { 2646}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 77   and name H   ))
      4.400     2.400     1.600 peak  2646 spectrum    1 weight  0.10000E+01 volume  0.11243E-02 ppm1      8.160 ppm2      8.075 CV     1
 ASSI { 2647}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 82   and name HG3 ))
      3.400     1.400     1.400 peak  2647 spectrum    1 weight  0.10000E+01 volume  0.55070E-03 ppm1      8.677 ppm2      1.518 CV     1
 ASSI { 2648}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 85   and name HB3 ))
      3.300     1.300     1.300 peak  2648 spectrum    1 weight  0.10000E+01 volume  0.97564E-03 ppm1      9.305 ppm2      1.614 CV     1
 ASSI { 2649}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 90   and name HG13))
      4.500     2.500     1.500 peak  2649 spectrum    1 weight  0.10000E+01 volume  0.64027E-03 ppm1      8.806 ppm2      1.212 CV     1
 ASSI { 2650}
   (( segid "    " and resid 90   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
      3.300     1.300     1.300 peak  2650 spectrum    1 weight  0.10000E+01 volume  0.15740E-02 ppm1      8.807 ppm2      0.690 CV     1
 ASSI { 2651}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 96   and name H   ))
      2.500     0.800     0.800 peak  2651 spectrum    1 weight  0.10000E+01 volume  0.33310E-02 ppm1      7.985 ppm2      8.042 CV     1
 ASSI { 2652}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 94   and name HA  ))
      4.800     2.900     1.200 peak  2652 spectrum    1 weight  0.10000E+01 volume  0.51260E-03 ppm1      8.050 ppm2      4.439 CV     1
 ASSI { 2653}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 61   and name HZ2 ))
      4.700     2.800     1.300 peak  2653 spectrum    1 weight  0.10000E+01 volume  0.39827E-03 ppm1      8.394 ppm2      7.160 CV     1
 ASSI { 2655}
   (( segid "    " and resid 109  and name H   ))
   (  segid "    " and resid 112  and name HD1%)
      5.300     3.500     0.700 peak  2655 spectrum    1 weight  0.10000E+01 volume  0.51449E-03 ppm1      8.773 ppm2      0.748 CV     1
 ASSI { 2656}
   (( segid "    " and resid 109  and name H   ))
   (  segid "    " and resid 112  and name HD2%)
      5.800     4.200     0.200 peak  2656 spectrum    1 weight  0.10000E+01 volume  0.50689E-03 ppm1      8.778 ppm2      0.681 CV     1
 ASSI { 2658}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 109  and name HA  ))
      3.400     1.400     1.400 peak  2658 spectrum    1 weight  0.10000E+01 volume  0.91847E-03 ppm1      8.749 ppm2      3.788 CV     1
 ASSI { 2660}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 118  and name HG2 ))
      1.800     0.400     0.400 peak  2660 spectrum    1 weight  0.10000E+01 volume  0.16636E-02 ppm1      7.688 ppm2      1.631 CV     1
 ASSI { 2664}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 122  and name HA  ))
      2.900     1.000     1.000 peak  2664 spectrum    1 weight  0.10000E+01 volume  0.34777E-02 ppm1      8.500 ppm2      4.168 CV     1
 OR { 2664}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 122  and name HB  ))
 ASSI { 2665}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 195  and name HB2 ))
      5.900     4.300     0.100 peak  2665 spectrum    1 weight  0.10000E+01 volume  0.28965E-03 ppm1      8.880 ppm2      1.196 CV     1
 ASSI { 2666}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 196  and name HB2 ))
      4.000     2.000     2.000 peak  2666 spectrum    1 weight  0.10000E+01 volume  0.42303E-03 ppm1      8.875 ppm2      0.926 CV     1
 ASSI { 2668}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 171  and name HA  ))
      2.500     0.800     0.800 peak  2668 spectrum    1 weight  0.10000E+01 volume  0.41941E-02 ppm1      8.190 ppm2      4.143 CV     1
 ASSI { 2670}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 135  and name HG3 ))
      4.200     2.200     1.800 peak  2670 spectrum    1 weight  0.10000E+01 volume  0.70506E-03 ppm1      8.191 ppm2      2.145 CV     1
 ASSI { 2671}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name HB2 ))
      3.500     1.500     1.500 peak  2671 spectrum    1 weight  0.10000E+01 volume  0.28278E-02 ppm1      8.267 ppm2      2.036 CV     1
 ASSI { 2672}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 183  and name HE22))
      4.400     2.400     1.600 peak  2672 spectrum    1 weight  0.10000E+01 volume  0.35444E-03 ppm1      7.020 ppm2      7.273 CV     1
 ASSI { 2674}
   (( segid "    " and resid 187  and name H   ))
   (( segid "    " and resid 188  and name H   ))
      3.600     1.600     1.600 peak  2674 spectrum    1 weight  0.10000E+01 volume  0.36207E-03 ppm1      9.095 ppm2      7.779 CV     1
 ASSI { 2677}
   (( segid "    " and resid 195  and name H   ))
   (( segid "    " and resid 196  and name H   ))
      4.700     2.700     1.300 peak  2677 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      8.779 ppm2      8.348 CV     1
 ASSI { 2678}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 201  and name H   ))
      2.400     0.700     0.700 peak  2678 spectrum    1 weight  0.10000E+01 volume  0.78701E-02 ppm1      7.716 ppm2      8.174 CV     1
 ASSI { 2679}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 200  and name HA  ))
      3.400     1.500     1.500 peak  2679 spectrum    1 weight  0.10000E+01 volume  0.17855E-02 ppm1      7.717 ppm2      4.343 CV     1
 ASSI { 2680}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 202  and name HA  ))
      2.400     0.700     0.700 peak  2680 spectrum    1 weight  0.10000E+01 volume  0.12013E-01 ppm1      7.716 ppm2      4.070 CV     1
 ASSI { 2681}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 200  and name HB2 ))
      3.500     1.600     1.600 peak  2681 spectrum    1 weight  0.10000E+01 volume  0.15797E-02 ppm1      7.714 ppm2      3.817 CV     1
 ASSI { 2682}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 200  and name HB3 ))
      3.800     1.800     1.800 peak  2682 spectrum    1 weight  0.10000E+01 volume  0.10080E-02 ppm1      7.718 ppm2      3.707 CV     1
 ASSI { 2683}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 201  and name HB3 ))
      3.200     1.300     1.300 peak  2683 spectrum    1 weight  0.10000E+01 volume  0.19094E-02 ppm1      7.718 ppm2      2.670 CV     1
 ASSI { 2684}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 201  and name HB2 ))
      4.000     2.000     2.000 peak  2684 spectrum    1 weight  0.10000E+01 volume  0.16750E-02 ppm1      7.716 ppm2      2.612 CV     1
 ASSI { 2685}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 202  and name HG3 ))
      3.100     1.200     1.200 peak  2685 spectrum    1 weight  0.10000E+01 volume  0.57357E-02 ppm1      7.717 ppm2      2.206 CV     1
 OR { 2685}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 202  and name HG2 ))
 ASSI { 2686}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 202  and name HB2 ))
      2.800     1.000     1.000 peak  2686 spectrum    1 weight  0.10000E+01 volume  0.36548E-02 ppm1      7.717 ppm2      2.042 CV     1
 ASSI { 2687}
   (( segid "    " and resid 202  and name H   ))
   (( segid "    " and resid 202  and name HB3 ))
      2.500     0.800     0.800 peak  2687 spectrum    1 weight  0.10000E+01 volume  0.95946E-02 ppm1      7.717 ppm2      1.833 CV     1
 ASSI { 2688}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 137  and name HB2 ))
      4.700     2.800     1.300 peak  2688 spectrum    1 weight  0.10000E+01 volume  0.76031E-03 ppm1      8.384 ppm2      1.692 CV     1
 ASSI { 2689}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 133  and name HG  ))
      2.800     1.000     1.000 peak  2689 spectrum    1 weight  0.10000E+01 volume  0.64407E-03 ppm1      7.388 ppm2      1.497 CV     1
 ASSI { 2692}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 119  and name HG13))
      3.500     1.500     1.500 peak  2692 spectrum    1 weight  0.10000E+01 volume  0.24163E-02 ppm1      7.470 ppm2      1.284 CV     1
 ASSI { 2695}
   (( segid "    " and resid 31   and name H   ))
   (  segid "    " and resid 28   and name HB% )
      4.300     2.300     1.700 peak  2695 spectrum    1 weight  0.10000E+01 volume  0.76794E-03 ppm1      8.332 ppm2      1.008 CV     1
 ASSI { 2697}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 40   and name HG  ))
      4.300     2.300     1.700 peak  2697 spectrum    1 weight  0.10000E+01 volume  0.15778E-02 ppm1      7.350 ppm2      1.601 CV     1
 ASSI { 2698}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 31   and name HG3 ))
      4.900     2.900     1.100 peak  2698 spectrum    1 weight  0.10000E+01 volume  0.40398E-03 ppm1      7.176 ppm2      2.533 CV     1
 ASSI { 2699}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 171  and name HA  ))
      5.200     3.400     0.800 peak  2699 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1     10.155 ppm2      4.192 CV     1
 ASSI { 2701}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 185  and name HA  ))
      4.400     2.400     1.600 peak  2701 spectrum    1 weight  0.10000E+01 volume  0.80606E-03 ppm1      9.032 ppm2      3.842 CV     1
 ASSI { 2710}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 132  and name HB2 ))
      3.200     3.200     2.800 peak  2710 spectrum    1 weight  0.10000E+01 volume  0.15664E-02 ppm1      8.634 ppm2      1.905 CV     1
 ASSI { 2711}
   (( segid "    " and resid 186  and name H   ))
   (( segid "    " and resid 187  and name HB2 ))
      4.600     2.600     1.400 peak  2711 spectrum    1 weight  0.10000E+01 volume  0.66123E-03 ppm1      8.814 ppm2      1.921 CV     1
 OR { 2711}
   (( segid "    " and resid 186  and name H   ))
   (( segid "    " and resid 187  and name HB3 ))
 ASSI { 2712}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 183  and name HB2 ))
      3.700     1.700     1.700 peak  2712 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      7.341 ppm2      2.179 CV     1
 OR { 2712}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 183  and name HG2 ))
 ASSI { 2713}
   (( segid "    " and resid 185  and name H   ))
   (( segid "    " and resid 180  and name HB2 ))
      4.600     2.700     1.400 peak  2713 spectrum    1 weight  0.10000E+01 volume  0.54499E-03 ppm1      7.337 ppm2      1.909 CV     1
 ASSI { 2717}
   (( segid "    " and resid 183  and name H   ))
   (( segid "    " and resid 178  and name HG3 ))
      4.700     2.700     1.300 peak  2717 spectrum    1 weight  0.10000E+01 volume  0.35444E-03 ppm1      7.158 ppm2      1.503 CV     1
 ASSI { 2719}
   (( segid "    " and resid 175  and name H   ))
   (( segid "    " and resid 129  and name HB3 ))
      5.600     3.900     0.400 peak  2719 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      9.120 ppm2      1.486 CV     1
 ASSI { 2721}
   (( segid "    " and resid 169  and name H   ))
   (( segid "    " and resid 138  and name HB3 ))
      1.900     0.400     0.400 peak  2721 spectrum    1 weight  0.10000E+01 volume  0.42629E-02 ppm1      8.323 ppm2      1.783 CV     1
 ASSI { 2724}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 135  and name HA  ))
      3.600     1.600     1.600 peak  2724 spectrum    1 weight  0.10000E+01 volume  0.26639E-02 ppm1      8.081 ppm2      4.147 CV     1
 ASSI { 2726}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HE3 ))
      4.200     2.200     1.800 peak  2726 spectrum    1 weight  0.10000E+01 volume  0.11128E-02 ppm1      8.081 ppm2      2.899 CV     1
 OR { 2726}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HE2 ))
 ASSI { 2730}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 134  and name HG3 ))
      5.000     3.100     1.000 peak  2730 spectrum    1 weight  0.10000E+01 volume  0.70315E-03 ppm1      8.208 ppm2      2.551 CV     1
 ASSI { 2734}
   (( segid "    " and resid 125  and name H   ))
   (  segid "    " and resid 197  and name HE% )
      4.300     2.300     1.700 peak  2734 spectrum    1 weight  0.10000E+01 volume  0.87084E-03 ppm1      8.062 ppm2      7.146 CV     1
 ASSI { 2735}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 124  and name HB2 ))
      4.200     2.300     1.800 peak  2735 spectrum    1 weight  0.10000E+01 volume  0.72793E-03 ppm1      8.064 ppm2      2.976 CV     1
 ASSI { 2741}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 118  and name HB2 ))
      4.600     2.600     1.400 peak  2741 spectrum    1 weight  0.10000E+01 volume  0.98518E-03 ppm1      7.755 ppm2      1.934 CV     1
 OR { 2741}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 2743}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 100  and name HG2%)
      4.700     2.700     1.300 peak  2743 spectrum    1 weight  0.10000E+01 volume  0.63265E-03 ppm1      7.756 ppm2      0.643 CV     1
 OR { 2743}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 2752}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name HG3 ))
      3.700     1.700     1.700 peak  2752 spectrum    1 weight  0.10000E+01 volume  0.15073E-02 ppm1      8.414 ppm2      1.292 CV     1
 OR { 2752}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name HG2 ))
 ASSI { 2755}
   (( segid "    " and resid 98   and name H   ))
   (( segid "    " and resid 92   and name HG2 ))
      4.900     3.000     1.100 peak  2755 spectrum    1 weight  0.10000E+01 volume  0.43637E-03 ppm1      9.132 ppm2      2.444 CV     1
 ASSI { 2756}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 91   and name HD3 ))
      4.900     3.000     1.100 peak  2756 spectrum    1 weight  0.10000E+01 volume  0.48020E-03 ppm1      7.983 ppm2      3.169 CV     1
 ASSI { 2761}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 105  and name H   ))
      4.100     2.100     1.900 peak  2761 spectrum    1 weight  0.10000E+01 volume  0.31632E-03 ppm1      7.129 ppm2      8.600 CV     1
 ASSI { 2766}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 7    and name H   ))
      4.000     2.000     2.000 peak  2766 spectrum    1 weight  0.10000E+01 volume  0.52974E-03 ppm1      8.078 ppm2      8.680 CV     1
 ASSI { 2771}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 66   and name HB2 ))
      5.000     3.100     1.000 peak  2771 spectrum    1 weight  0.10000E+01 volume  0.37920E-03 ppm1      7.900 ppm2      2.070 CV     1
 ASSI { 2776}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 25   and name HB  ))
      4.600     2.600     1.400 peak  2776 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      8.161 ppm2      2.757 CV     1
 ASSI { 2778}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 183  and name HB3 ))
      4.400     2.400     1.600 peak  2778 spectrum    1 weight  0.10000E+01 volume  0.71077E-03 ppm1      8.022 ppm2      2.019 CV     1
 ASSI { 2782}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 58   and name HA  ))
      5.100     3.300     0.900 peak  2782 spectrum    1 weight  0.10000E+01 volume  0.48211E-03 ppm1      9.265 ppm2      4.345 CV     1
 ASSI { 2783}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 56   and name HG2 ))
      5.500     3.800     0.500 peak  2783 spectrum    1 weight  0.10000E+01 volume  0.56215E-03 ppm1      9.263 ppm2      2.022 CV     1
 OR { 2783}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 56   and name HG3 ))
 ASSI { 2785}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 84   and name HE3 ))
      4.500     2.600     1.500 peak  2785 spectrum    1 weight  0.10000E+01 volume  0.39445E-03 ppm1      9.079 ppm2      2.359 CV     1
 OR { 2785}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 84   and name HE2 ))
 ASSI { 2789}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 37   and name HB2 ))
      4.500     2.500     1.500 peak  2789 spectrum    1 weight  0.10000E+01 volume  0.65361E-03 ppm1      7.363 ppm2      1.789 CV     1
 ASSI { 2792}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 37   and name HB3 ))
      5.500     3.800     0.500 peak  2792 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      7.365 ppm2      2.253 CV     1
 ASSI { 2794}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 36   and name HG12))
      5.600     3.900     0.400 peak  2794 spectrum    1 weight  0.10000E+01 volume  0.51069E-03 ppm1      7.515 ppm2      0.846 CV     1
 OR { 2794}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 2795}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 27   and name HB3 ))
      4.000     2.000     2.000 peak  2795 spectrum    1 weight  0.10000E+01 volume  0.11472E-02 ppm1      7.177 ppm2      2.607 CV     1
 OR { 2795}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 2798}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 27   and name HB3 ))
      3.600     1.600     1.600 peak  2798 spectrum    1 weight  0.10000E+01 volume  0.30643E-02 ppm1      8.212 ppm2      2.609 CV     1
 OR { 2798}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 2800}
   (( segid "    " and resid 27   and name H   ))
   (  segid "    " and resid 31   and name HE% )
      5.100     3.200     0.900 peak  2800 spectrum    1 weight  0.10000E+01 volume  0.44781E-03 ppm1      6.718 ppm2      2.039 CV     1
 ASSI { 2801}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 24   and name HA  ))
      4.900     3.000     1.100 peak  2801 spectrum    1 weight  0.10000E+01 volume  0.54690E-03 ppm1      7.709 ppm2      4.690 CV     1
 ASSI { 2804}
   (( segid "    " and resid 20   and name H   ))
   (  segid "    " and resid -1   and name HE% )
      4.800     2.900     1.200 peak  2804 spectrum    1 weight  0.10000E+01 volume  0.31061E-03 ppm1      9.212 ppm2      7.250 CV     1
 OR { 2804}
   (( segid "    " and resid 20   and name H   ))
   (  segid "    " and resid -1   and name HD% )
 ASSI { 2806}
   (( segid "    " and resid 16   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
      4.600     2.600     1.400 peak  2806 spectrum    1 weight  0.10000E+01 volume  0.51640E-03 ppm1      8.580 ppm2      0.820 CV     1
 ASSI { 2807}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 15   and name HG3 ))
      5.700     4.000     0.300 peak  2807 spectrum    1 weight  0.10000E+01 volume  0.28203E-03 ppm1      8.208 ppm2      1.232 CV     1
 ASSI { 2809}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 8    and name HG12))
      3.200     1.300     1.300 peak  2809 spectrum    1 weight  0.10000E+01 volume  0.69172E-03 ppm1      9.029 ppm2      1.406 CV     1
 ASSI { 2810}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 75   and name HD22))
      4.900     3.000     1.100 peak  2810 spectrum    1 weight  0.10000E+01 volume  0.39065E-03 ppm1      8.727 ppm2      7.061 CV     1
 ASSI { 2812}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 21   and name HG3 ))
      4.800     2.900     1.200 peak  2812 spectrum    1 weight  0.10000E+01 volume  0.58882E-03 ppm1      8.729 ppm2      1.950 CV     1
 ASSI { 2815}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 138  and name HB2 ))
      4.100     2.100     1.900 peak  2815 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      6.985 ppm2      1.669 CV     1
 ASSI { 2816}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 138  and name HB2 ))
      4.300     2.300     1.700 peak  2816 spectrum    1 weight  0.10000E+01 volume  0.65361E-03 ppm1      7.389 ppm2      1.668 CV     1
 ASSI { 2819}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 131  and name HD3 ))
      2.700     2.700     3.300 peak  2819 spectrum    1 weight  0.10000E+01 volume  0.62693E-03 ppm1      6.982 ppm2      3.061 CV     1
 ASSI { 2820}
   (( segid "    " and resid 172  and name HD22))
   (( segid "    " and resid 132  and name HA  ))
      3.900     1.900     1.900 peak  2820 spectrum    1 weight  0.10000E+01 volume  0.13148E-02 ppm1      6.981 ppm2      4.135 CV     1
 ASSI { 2824}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 29   and name HB3 ))
      3.600     1.600     1.600 peak  2824 spectrum    1 weight  0.10000E+01 volume  0.70506E-03 ppm1      7.666 ppm2      3.253 CV     1
 ASSI { 2828}
   (( segid "    " and resid 82   and name HE  ))
   (( segid "    " and resid 83   and name HB2 ))
      5.100     3.200     0.900 peak  2828 spectrum    1 weight  0.10000E+01 volume  0.48782E-03 ppm1      6.673 ppm2      1.291 CV     1
 ASSI { 2831}
   (( segid "    " and resid 50   and name H   ))
   (  segid "    " and resid 50   and name HD% )
      4.600     2.700     1.400 peak  2831 spectrum    1 weight  0.10000E+01 volume  0.81939E-03 ppm1      9.129 ppm2      5.482 CV     1
 ASSI { 2832}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 50   and name HZ  ))
      5.500     3.800     0.500 peak  2832 spectrum    1 weight  0.10000E+01 volume  0.20961E-03 ppm1      8.264 ppm2      6.711 CV     1
 ASSI { 2837}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 110  and name HB2 ))
      4.500     2.500     1.500 peak  2837 spectrum    1 weight  0.10000E+01 volume  0.60026E-03 ppm1      7.232 ppm2      2.666 CV     1
 ASSI { 2840}
   (( segid "    " and resid 128  and name H   ))
   (  segid "    " and resid 112  and name HD2%)
      4.000     2.000     2.000 peak  2840 spectrum    1 weight  0.10000E+01 volume  0.91847E-03 ppm1      8.877 ppm2      0.673 CV     1
 ASSI { 2842}
   (( segid "    " and resid 178  and name H   ))
   (( segid "    " and resid 107  and name HA  ))
      4.500     2.600     1.500 peak  2842 spectrum    1 weight  0.10000E+01 volume  0.39065E-03 ppm1      7.019 ppm2      3.772 CV     1
 ASSI { 2844}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 202  and name HB3 ))
      4.000     2.000     2.000 peak  2844 spectrum    1 weight  0.10000E+01 volume  0.31252E-03 ppm1      8.235 ppm2      1.809 CV     1
 ASSI {    2}
   (( segid "    " and resid 61   and name HH2 ))
   (( segid "    " and resid 82   and name HB2 ))
      3.800     1.800     1.800 peak     2 spectrum    1 weight  0.10000E+01 volume  0.17166E-02 ppm1      6.487 ppm2      1.442 CV     1
 OR {    2}
   (( segid "    " and resid 61   and name HH2 ))
   (( segid "    " and resid 82   and name HG2 ))
 ASSI {    3}
   (  segid "    " and resid 70   and name HE% )
   (( segid "    " and resid 66   and name HE3 ))
      3.700     1.700     1.700 peak     3 spectrum    1 weight  0.10000E+01 volume  0.42096E-02 ppm1      6.534 ppm2      2.242 CV     1
 OR {    3}
   (  segid "    " and resid 70   and name HE% )
   (( segid "    " and resid 66   and name HE2 ))
 ASSI {    4}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 40   and name HB3 ))
      3.300     1.300     1.300 peak     4 spectrum    1 weight  0.10000E+01 volume  0.13476E-02 ppm1      6.304 ppm2      1.548 CV     1
 ASSI {    6}
   (( segid "    " and resid 124  and name HE1 ))
   (( segid "    " and resid 110  and name HA  ))
      3.200     1.300     1.300 peak     6 spectrum    1 weight  0.10000E+01 volume  0.21498E-02 ppm1      7.817 ppm2      4.311 CV     1
 ASSI {    7}
   (  segid "    " and resid 127  and name HE% )
   (  segid "    " and resid 93   and name HD2%)
      2.700     0.900     0.900 peak     7 spectrum    1 weight  0.10000E+01 volume  0.35648E-02 ppm1      6.633 ppm2      0.951 CV     1
 OR {    7}
   (  segid "    " and resid 127  and name HE% )
   (  segid "    " and resid 93   and name HD1%)
 ASSI {    8}
   (( segid "    " and resid 124  and name HE1 ))
   (( segid "    " and resid 113  and name HB2 ))
      2.100     0.600     0.600 peak     8 spectrum    1 weight  0.10000E+01 volume  0.92504E-02 ppm1      7.826 ppm2      1.888 CV     1
 ASSI {   15}
   (  segid "    " and resid 19   and name HD% )
   (  segid "    " and resid 68   and name HD1%)
      3.100     1.200     1.200 peak    15 spectrum    1 weight  0.10000E+01 volume  0.35168E-02 ppm1      7.050 ppm2      0.321 CV     1
 ASSI {   18}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 68   and name HG  ))
      3.900     1.900     1.900 peak    18 spectrum    1 weight  0.10000E+01 volume  0.23487E-02 ppm1      7.054 ppm2      1.643 CV     1
 ASSI {   22}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HB2 ))
      2.400     0.700     0.700 peak    22 spectrum    1 weight  0.10000E+01 volume  0.46172E-02 ppm1      7.054 ppm2      2.287 CV     1
 ASSI {   23}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HB3 ))
      2.500     0.800     0.800 peak    23 spectrum    1 weight  0.10000E+01 volume  0.36129E-02 ppm1      7.052 ppm2      2.928 CV     1
 ASSI {   24}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 28   and name HA  ))
      2.800     1.000     1.000 peak    24 spectrum    1 weight  0.10000E+01 volume  0.14728E-02 ppm1      7.056 ppm2      4.236 CV     1
 ASSI {   25}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HA  ))
      2.900     1.000     1.000 peak    25 spectrum    1 weight  0.10000E+01 volume  0.30482E-02 ppm1      7.052 ppm2      4.833 CV     1
 ASSI {   26}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 23   and name HB  ))
      4.400     2.400     1.600 peak    26 spectrum    1 weight  0.10000E+01 volume  0.86312E-03 ppm1      7.061 ppm2      3.905 CV     1
 ASSI {   27}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 18   and name HA  ))
      3.100     1.200     1.200 peak    27 spectrum    1 weight  0.10000E+01 volume  0.11711E-02 ppm1      7.052 ppm2      5.273 CV     1
 ASSI {   28}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name H   ))
      2.700     0.900     0.900 peak    28 spectrum    1 weight  0.10000E+01 volume  0.27916E-02 ppm1      7.050 ppm2      8.858 CV     1
 ASSI {   29}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 20   and name H   ))
      3.900     1.900     1.900 peak    29 spectrum    1 weight  0.10000E+01 volume  0.13123E-02 ppm1      7.059 ppm2      9.186 CV     1
 ASSI {   30}
   (  segid "    " and resid 26   and name HD% )
   (( segid "    " and resid 26   and name H   ))
      2.600     0.900     0.900 peak    30 spectrum    1 weight  0.10000E+01 volume  0.50953E-02 ppm1      7.064 ppm2      8.696 CV     1
 ASSI {   31}
   (  segid "    " and resid 26   and name HD% )
   (  segid "    " and resid 26   and name HE% )
      1.800     0.400     0.400 peak    31 spectrum    1 weight  0.10000E+01 volume  0.46438E-01 ppm1      7.064 ppm2      6.775 CV     1
 ASSI {   33}
   (  segid "    " and resid 26   and name HD% )
   (( segid "    " and resid 26   and name HA  ))
      3.300     1.300     1.300 peak    33 spectrum    1 weight  0.10000E+01 volume  0.67221E-02 ppm1      7.064 ppm2      4.359 CV     1
 ASSI {   34}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 26   and name HA  ))
      4.200     2.200     1.800 peak    34 spectrum    1 weight  0.10000E+01 volume  0.31542E-02 ppm1      6.779 ppm2      4.351 CV     1
 ASSI {   35}
   (  segid "    " and resid 26   and name HD% )
   (( segid "    " and resid 64   and name HA  ))
      3.200     1.300     1.300 peak    35 spectrum    1 weight  0.10000E+01 volume  0.20086E-02 ppm1      7.065 ppm2      3.909 CV     1
 ASSI {   36}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 26   and name HB3 ))
      3.900     1.900     1.900 peak    36 spectrum    1 weight  0.10000E+01 volume  0.29198E-02 ppm1      6.778 ppm2      3.179 CV     1
 ASSI {   37}
   (  segid "    " and resid 26   and name HD% )
   (( segid "    " and resid 26   and name HB3 ))
      2.100     0.600     0.600 peak    37 spectrum    1 weight  0.10000E+01 volume  0.10807E-01 ppm1      7.064 ppm2      3.181 CV     1
 ASSI {   38}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 24   and name HG3 ))
      3.500     1.500     1.500 peak    38 spectrum    1 weight  0.10000E+01 volume  0.35424E-02 ppm1      6.778 ppm2      2.719 CV     1
 ASSI {   39}
   (  segid "    " and resid 26   and name HD% )
   (( segid "    " and resid 26   and name HB2 ))
      2.400     0.700     0.700 peak    39 spectrum    1 weight  0.10000E+01 volume  0.94750E-02 ppm1      7.065 ppm2      2.802 CV     1
 ASSI {   42}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 26   and name HB2 ))
      4.100     2.100     1.900 peak    42 spectrum    1 weight  0.10000E+01 volume  0.21851E-02 ppm1      6.776 ppm2      2.797 CV     1
 ASSI {   45}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 24   and name HB3 ))
      3.000     1.100     1.100 peak    45 spectrum    1 weight  0.10000E+01 volume  0.29518E-02 ppm1      6.779 ppm2      1.725 CV     1
 OR {   45}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 24   and name HB2 ))
 ASSI {   46}
   (  segid "    " and resid 26   and name HD% )
   (( segid "    " and resid 24   and name HB3 ))
      2.800     1.000     1.000 peak    46 spectrum    1 weight  0.10000E+01 volume  0.32953E-02 ppm1      7.063 ppm2      1.723 CV     1
 ASSI {   48}
   (  segid "    " and resid 26   and name HD% )
   (  segid "    " and resid 25   and name HG1%)
      4.300     2.300     1.700 peak    48 spectrum    1 weight  0.10000E+01 volume  0.15754E-02 ppm1      7.058 ppm2      0.755 CV     1
 ASSI {   51}
   (  segid "    " and resid 47   and name HD% )
   (  segid "    " and resid 47   and name HE% )
      2.100     0.500     0.500 peak    51 spectrum    1 weight  0.10000E+01 volume  0.11346E-01 ppm1      6.698 ppm2      7.082 CV     1
 ASSI {   52}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 48   and name H   ))
      3.600     1.600     1.600 peak    52 spectrum    1 weight  0.10000E+01 volume  0.17230E-02 ppm1      6.698 ppm2      8.612 CV     1
 ASSI {   53}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 83   and name H   ))
      3.500     1.500     1.500 peak    53 spectrum    1 weight  0.10000E+01 volume  0.11583E-02 ppm1      6.699 ppm2      8.421 CV     1
 ASSI {   55}
   (  segid "    " and resid 47   and name HE% )
   (( segid "    " and resid 83   and name H   ))
      3.300     1.400     1.400 peak    55 spectrum    1 weight  0.10000E+01 volume  0.11808E-02 ppm1      7.081 ppm2      8.412 CV     1
 ASSI {   58}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 47   and name HA  ))
      3.000     1.100     1.100 peak    58 spectrum    1 weight  0.10000E+01 volume  0.18129E-02 ppm1      6.699 ppm2      4.857 CV     1
 ASSI {   60}
   (  segid "    " and resid 47   and name HE% )
   (( segid "    " and resid 42   and name HA3 ))
      3.700     1.700     1.700 peak    60 spectrum    1 weight  0.10000E+01 volume  0.20022E-02 ppm1      7.076 ppm2      4.076 CV     1
 ASSI {   61}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 42   and name HA3 ))
      4.400     2.400     1.600 peak    61 spectrum    1 weight  0.10000E+01 volume  0.10364E-02 ppm1      6.697 ppm2      4.075 CV     1
 ASSI {   62}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak    62 spectrum    1 weight  0.10000E+01 volume  0.15177E-02 ppm1      6.693 ppm2      4.706 CV     1
 ASSI {   63}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 44   and name HA  ))
      3.400     1.400     1.400 peak    63 spectrum    1 weight  0.10000E+01 volume  0.14311E-02 ppm1      6.689 ppm2      4.224 CV     1
 ASSI {   64}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 83   and name HA  ))
      3.100     1.200     1.200 peak    64 spectrum    1 weight  0.10000E+01 volume  0.12706E-02 ppm1      6.696 ppm2      3.523 CV     1
 ASSI {   65}
   (  segid "    " and resid 47   and name HE% )
   (( segid "    " and resid 43   and name HD3 ))
      3.000     1.100     1.100 peak    65 spectrum    1 weight  0.10000E+01 volume  0.14150E-02 ppm1      7.080 ppm2      3.675 CV     1
 OR {   65}
   (  segid "    " and resid 47   and name HE% )
   (( segid "    " and resid 43   and name HD2 ))
 ASSI {   66}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 47   and name HB2 ))
      2.800     0.900     0.900 peak    66 spectrum    1 weight  0.10000E+01 volume  0.32824E-02 ppm1      6.700 ppm2      2.551 CV     1
 ASSI {   67}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 46   and name HB2 ))
      2.800     1.000     1.000 peak    67 spectrum    1 weight  0.10000E+01 volume  0.19380E-02 ppm1      6.699 ppm2      2.318 CV     1
 ASSI {   70}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 47   and name HB3 ))
      2.500     0.800     0.800 peak    70 spectrum    1 weight  0.10000E+01 volume  0.38856E-02 ppm1      6.699 ppm2      1.839 CV     1
 ASSI {   71}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 83   and name HB3 ))
      4.300     2.300     1.700 peak    71 spectrum    1 weight  0.10000E+01 volume  0.13990E-02 ppm1      6.695 ppm2      1.520 CV     1
 ASSI {   72}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 83   and name HD2 ))
      3.700     1.700     1.700 peak    72 spectrum    1 weight  0.10000E+01 volume  0.16909E-02 ppm1      6.700 ppm2      1.462 CV     1
 OR {   72}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 83   and name HD3 ))
 ASSI {   73}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 83   and name HB2 ))
      3.400     1.500     1.500 peak    73 spectrum    1 weight  0.10000E+01 volume  0.14118E-02 ppm1      6.701 ppm2      1.344 CV     1
 ASSI {   74}
   (  segid "    " and resid 47   and name HD% )
   (( segid "    " and resid 83   and name HG3 ))
      3.000     1.100     1.100 peak    74 spectrum    1 weight  0.10000E+01 volume  0.15594E-02 ppm1      6.701 ppm2      0.906 CV     1
 ASSI {   75}
   (  segid "    " and resid 47   and name HE% )
   (( segid "    " and resid 83   and name HG3 ))
      3.000     1.100     1.100 peak    75 spectrum    1 weight  0.10000E+01 volume  0.18225E-02 ppm1      7.078 ppm2      0.900 CV     1
 ASSI {   76}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 50   and name HB3 ))
      2.700     0.900     0.900 peak    76 spectrum    1 weight  0.10000E+01 volume  0.20792E-02 ppm1      5.493 ppm2      2.153 CV     1
 ASSI {   77}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 50   and name HB2 ))
      3.000     1.200     1.200 peak    77 spectrum    1 weight  0.10000E+01 volume  0.14407E-02 ppm1      5.501 ppm2      2.410 CV     1
 ASSI {   78}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 80   and name HB3 ))
      3.000     1.100     1.100 peak    78 spectrum    1 weight  0.10000E+01 volume  0.15851E-02 ppm1      5.504 ppm2      1.970 CV     1
 OR {   78}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 80   and name HB2 ))
 ASSI {   81}
   (  segid "    " and resid 50   and name HE% )
   (( segid "    " and resid 59   and name HA2 ))
      4.700     2.700     1.300 peak    81 spectrum    1 weight  0.10000E+01 volume  0.91767E-03 ppm1      6.503 ppm2      3.558 CV     1
 ASSI {   83}
   (  segid "    " and resid 50   and name HE% )
   (( segid "    " and resid 52   and name HA  ))
      3.000     1.100     1.100 peak    83 spectrum    1 weight  0.10000E+01 volume  0.17615E-02 ppm1      6.499 ppm2      3.952 CV     1
 ASSI {   85}
   (( segid "    " and resid 50   and name HZ  ))
   (( segid "    " and resid 59   and name HA3 ))
      3.000     1.100     1.100 peak    85 spectrum    1 weight  0.10000E+01 volume  0.10845E-02 ppm1      6.741 ppm2      3.702 CV     1
 ASSI {   86}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 50   and name HA  ))
      3.100     1.200     1.200 peak    86 spectrum    1 weight  0.10000E+01 volume  0.14984E-02 ppm1      5.498 ppm2      4.691 CV     1
 ASSI {   88}
   (  segid "    " and resid 50   and name HE% )
   (  segid "    " and resid 50   and name HD% )
      2.600     0.800     0.800 peak    88 spectrum    1 weight  0.10000E+01 volume  0.42996E-02 ppm1      6.499 ppm2      5.492 CV     1
 ASSI {   89}
   (( segid "    " and resid 50   and name HZ  ))
   (  segid "    " and resid 50   and name HD% )
      4.300     2.300     1.700 peak    89 spectrum    1 weight  0.10000E+01 volume  0.96900E-03 ppm1      6.738 ppm2      5.489 CV     1
 ASSI {   91}
   (( segid "    " and resid 50   and name HZ  ))
   (  segid "    " and resid 50   and name HE% )
      2.700     0.900     0.900 peak    91 spectrum    1 weight  0.10000E+01 volume  0.33304E-02 ppm1      6.738 ppm2      6.500 CV     1
 ASSI {   94}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 61   and name HD1 ))
      3.700     1.700     1.700 peak    94 spectrum    1 weight  0.10000E+01 volume  0.80536E-03 ppm1      5.499 ppm2      7.314 CV     1
 ASSI {   96}
   (  segid "    " and resid 50   and name HE% )
   (( segid "    " and resid 181  and name HE  ))
      3.100     1.200     1.200 peak    96 spectrum    1 weight  0.10000E+01 volume  0.14118E-02 ppm1      6.491 ppm2      8.025 CV     1
 ASSI {   97}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 51   and name H   ))
      3.600     1.600     1.600 peak    97 spectrum    1 weight  0.10000E+01 volume  0.12931E-02 ppm1      5.486 ppm2      8.444 CV     1
 ASSI {   99}
   (( segid "    " and resid 61   and name HD1 ))
   (( segid "    " and resid 61   and name H   ))
      3.000     1.100     1.100 peak    99 spectrum    1 weight  0.10000E+01 volume  0.25508E-02 ppm1      7.326 ppm2      8.458 CV     1
 ASSI {  100}
   (( segid "    " and resid 61   and name HH2 ))
   (( segid "    " and resid 61   and name HZ2 ))
      2.800     1.000     1.000 peak   100 spectrum    1 weight  0.10000E+01 volume  0.20663E-02 ppm1      6.488 ppm2      7.155 CV     1
 ASSI {  101}
   (( segid "    " and resid 61   and name HH2 ))
   (( segid "    " and resid 61   and name HZ3 ))
      2.800     1.000     1.000 peak   101 spectrum    1 weight  0.10000E+01 volume  0.15369E-02 ppm1      6.489 ppm2      6.612 CV     1
 ASSI {  102}
   (( segid "    " and resid 61   and name HD1 ))
   (  segid "    " and resid 50   and name HE% )
      3.700     1.700     1.700 peak   102 spectrum    1 weight  0.10000E+01 volume  0.10685E-02 ppm1      7.319 ppm2      6.491 CV     1
 ASSI {  103}
   (( segid "    " and resid 61   and name HE3 ))
   (( segid "    " and resid 61   and name HZ3 ))
      3.000     1.200     1.200 peak   103 spectrum    1 weight  0.10000E+01 volume  0.14022E-02 ppm1      7.515 ppm2      6.610 CV     1
 ASSI {  105}
   (( segid "    " and resid 61   and name HZ2 ))
   (( segid "    " and resid 61   and name HZ3 ))
      4.400     2.500     1.600 peak   105 spectrum    1 weight  0.10000E+01 volume  0.76365E-03 ppm1      7.147 ppm2      6.611 CV     1
 ASSI {  106}
   (( segid "    " and resid 61   and name HD1 ))
   (( segid "    " and resid 105  and name HA  ))
      3.000     1.100     1.100 peak   106 spectrum    1 weight  0.10000E+01 volume  0.23776E-02 ppm1      7.330 ppm2      4.152 CV     1
 ASSI {  107}
   (( segid "    " and resid 61   and name HD1 ))
   (( segid "    " and resid 60   and name HA  ))
      3.700     1.700     1.700 peak   107 spectrum    1 weight  0.10000E+01 volume  0.11711E-02 ppm1      7.325 ppm2      4.477 CV     1
 ASSI {  110}
   (( segid "    " and resid 61   and name HZ2 ))
   (( segid "    " and resid 84   and name HA  ))
      3.700     1.700     1.700 peak   110 spectrum    1 weight  0.10000E+01 volume  0.10909E-02 ppm1      7.155 ppm2      3.695 CV     1
 ASSI {  111}
   (( segid "    " and resid 61   and name HD1 ))
   (( segid "    " and resid 61   and name HB2 ))
      2.900     1.000     1.000 peak   111 spectrum    1 weight  0.10000E+01 volume  0.15851E-02 ppm1      7.327 ppm2      3.013 CV     1
 ASSI {  112}
   (( segid "    " and resid 61   and name HD1 ))
   (( segid "    " and resid 61   and name HB3 ))
      3.900     1.900     1.900 peak   112 spectrum    1 weight  0.10000E+01 volume  0.15947E-02 ppm1      7.332 ppm2      3.164 CV     1
 ASSI {  114}
   (( segid "    " and resid 61   and name HZ2 ))
   (( segid "    " and resid 104  and name HB3 ))
      3.400     1.500     1.500 peak   114 spectrum    1 weight  0.10000E+01 volume  0.80215E-03 ppm1      7.155 ppm2      2.448 CV     1
 ASSI {  115}
   (( segid "    " and resid 61   and name HH2 ))
   (( segid "    " and resid 50   and name HB2 ))
      3.700     1.700     1.700 peak   115 spectrum    1 weight  0.10000E+01 volume  0.65136E-03 ppm1      6.482 ppm2      2.415 CV     1
 ASSI {  117}
   (( segid "    " and resid 61   and name HD1 ))
   (( segid "    " and resid 105  and name HB3 ))
      3.600     1.600     1.600 peak   117 spectrum    1 weight  0.10000E+01 volume  0.10428E-02 ppm1      7.330 ppm2      2.413 CV     1
 ASSI {  118}
   (( segid "    " and resid 61   and name HD1 ))
   (( segid "    " and resid 104  and name HB3 ))
      3.800     1.800     1.800 peak   118 spectrum    1 weight  0.10000E+01 volume  0.11455E-02 ppm1      7.328 ppm2      2.446 CV     1
 ASSI {  119}
   (( segid "    " and resid 61   and name HZ2 ))
   (( segid "    " and resid 82   and name HB2 ))
      4.900     3.000     1.100 peak   119 spectrum    1 weight  0.10000E+01 volume  0.10171E-02 ppm1      7.153 ppm2      1.473 CV     1
 OR {  119}
   (( segid "    " and resid 61   and name HZ2 ))
   (( segid "    " and resid 82   and name HG2 ))
 ASSI {  120}
   (( segid "    " and resid 61   and name HH2 ))
   (( segid "    " and resid 82   and name HG3 ))
      2.600     0.900     0.900 peak   120 spectrum    1 weight  0.10000E+01 volume  0.11840E-02 ppm1      6.485 ppm2      1.500 CV     1
 ASSI {  121}
   (( segid "    " and resid 61   and name HH2 ))
   (( segid "    " and resid 82   and name HB3 ))
      5.200     3.400     0.800 peak   121 spectrum    1 weight  0.10000E+01 volume  0.82782E-03 ppm1      6.489 ppm2      1.679 CV     1
 ASSI {  122}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 66   and name HD2 ))
      4.400     2.400     1.600 peak   122 spectrum    1 weight  0.10000E+01 volume  0.13476E-02 ppm1      6.059 ppm2      0.493 CV     1
 ASSI {  123}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 66   and name HD3 ))
      5.000     3.200     1.000 peak   123 spectrum    1 weight  0.10000E+01 volume  0.95938E-03 ppm1      6.056 ppm2      0.849 CV     1
 ASSI {  124}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 66   and name HG3 ))
      2.600     0.900     0.900 peak   124 spectrum    1 weight  0.10000E+01 volume  0.17808E-02 ppm1      6.057 ppm2      0.984 CV     1
 OR {  124}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 66   and name HG2 ))
 ASSI {  125}
   (  segid "    " and resid 70   and name HE% )
   (( segid "    " and resid 66   and name HG3 ))
      3.200     1.300     1.300 peak   125 spectrum    1 weight  0.10000E+01 volume  0.17808E-02 ppm1      6.540 ppm2      0.989 CV     1
 OR {  125}
   (  segid "    " and resid 70   and name HE% )
   (( segid "    " and resid 66   and name HG2 ))
 ASSI {  126}
   (  segid "    " and resid 70   and name HE% )
   (( segid "    " and resid 66   and name HD3 ))
      4.700     2.700     1.300 peak   126 spectrum    1 weight  0.10000E+01 volume  0.12000E-02 ppm1      6.536 ppm2      0.840 CV     1
 ASSI {  128}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 66   and name HB3 ))
      4.500     2.500     1.500 peak   128 spectrum    1 weight  0.10000E+01 volume  0.13027E-02 ppm1      6.059 ppm2      1.533 CV     1
 ASSI {  129}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 66   and name HE3 ))
      4.300     2.300     1.700 peak   129 spectrum    1 weight  0.10000E+01 volume  0.19219E-02 ppm1      6.059 ppm2      2.239 CV     1
 ASSI {  130}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 66   and name HB2 ))
      3.400     1.500     1.500 peak   130 spectrum    1 weight  0.10000E+01 volume  0.90162E-03 ppm1      6.060 ppm2      2.043 CV     1
 ASSI {  131}
   (  segid "    " and resid 70   and name HE% )
   (( segid "    " and resid 70   and name HB2 ))
      4.100     2.100     1.900 peak   131 spectrum    1 weight  0.10000E+01 volume  0.20054E-02 ppm1      6.536 ppm2      2.828 CV     1
 ASSI {  132}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 70   and name HB2 ))
      2.500     0.800     0.800 peak   132 spectrum    1 weight  0.10000E+01 volume  0.49348E-02 ppm1      6.056 ppm2      2.824 CV     1
 ASSI {  133}
   (  segid "    " and resid 70   and name HE% )
   (( segid "    " and resid 70   and name HB3 ))
      3.900     1.900     1.900 peak   133 spectrum    1 weight  0.10000E+01 volume  0.23808E-02 ppm1      6.533 ppm2      3.103 CV     1
 ASSI {  134}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 70   and name HB3 ))
      2.300     0.700     0.700 peak   134 spectrum    1 weight  0.10000E+01 volume  0.48867E-02 ppm1      6.058 ppm2      3.103 CV     1
 ASSI {  135}
   (  segid "    " and resid 70   and name HE% )
   (( segid "    " and resid 70   and name HA  ))
      4.100     2.100     1.900 peak   135 spectrum    1 weight  0.10000E+01 volume  0.23230E-02 ppm1      6.533 ppm2      3.921 CV     1
 ASSI {  136}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 70   and name HA  ))
      2.700     0.900     0.900 peak   136 spectrum    1 weight  0.10000E+01 volume  0.55413E-02 ppm1      6.056 ppm2      3.922 CV     1
 ASSI {  137}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 66   and name HA  ))
      4.600     2.600     1.400 peak   137 spectrum    1 weight  0.10000E+01 volume  0.10556E-02 ppm1      6.055 ppm2      4.386 CV     1
 ASSI {  138}
   (  segid "    " and resid 70   and name HE% )
   (  segid "    " and resid 70   and name HD% )
      2.000     0.500     0.500 peak   138 spectrum    1 weight  0.10000E+01 volume  0.20513E-01 ppm1      6.535 ppm2      6.060 CV     1
 ASSI {  140}
   (  segid "    " and resid 70   and name HD% )
   (  segid "    " and resid 71   and name HE% )
      4.100     2.100     1.900 peak   140 spectrum    1 weight  0.10000E+01 volume  0.16236E-02 ppm1      6.057 ppm2      6.851 CV     1
 ASSI {  141}
   (  segid "    " and resid 70   and name HE% )
   (  segid "    " and resid 71   and name HE% )
      3.600     1.600     1.600 peak   141 spectrum    1 weight  0.10000E+01 volume  0.17744E-02 ppm1      6.536 ppm2      6.847 CV     1
 ASSI {  142}
   (  segid "    " and resid 70   and name HE% )
   (  segid "    " and resid 71   and name HD% )
      4.100     2.100     1.900 peak   142 spectrum    1 weight  0.10000E+01 volume  0.10877E-02 ppm1      6.533 ppm2      7.233 CV     1
 ASSI {  143}
   (  segid "    " and resid 70   and name HD% )
   (  segid "    " and resid 71   and name HD% )
      3.300     1.400     1.400 peak   143 spectrum    1 weight  0.10000E+01 volume  0.12802E-02 ppm1      6.056 ppm2      7.229 CV     1
 ASSI {  144}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 71   and name H   ))
      3.300     1.400     1.400 peak   144 spectrum    1 weight  0.10000E+01 volume  0.14471E-02 ppm1      6.058 ppm2      7.553 CV     1
 ASSI {  145}
   (  segid "    " and resid 70   and name HD% )
   (( segid "    " and resid 70   and name H   ))
      3.700     1.700     1.700 peak   145 spectrum    1 weight  0.10000E+01 volume  0.31444E-02 ppm1      6.056 ppm2      7.892 CV     1
 ASSI {  148}
   (  segid "    " and resid 71   and name HD% )
   (  segid "    " and resid 71   and name HE% )
      2.900     1.000     1.000 peak   148 spectrum    1 weight  0.10000E+01 volume  0.15979E-02 ppm1      7.231 ppm2      6.844 CV     1
 ASSI {  152}
   (  segid "    " and resid 71   and name HD% )
   (( segid "    " and resid 71   and name HB2 ))
      3.000     1.100     1.100 peak   152 spectrum    1 weight  0.10000E+01 volume  0.10717E-02 ppm1      7.241 ppm2      2.665 CV     1
 ASSI {  153}
   (  segid "    " and resid 71   and name HD% )
   (  segid "    " and resid 60   and name HD1%)
      3.100     1.200     1.200 peak   153 spectrum    1 weight  0.10000E+01 volume  0.16557E-02 ppm1      7.222 ppm2      0.818 CV     1
 ASSI {  154}
   (  segid "    " and resid 81   and name HE% )
   (  segid "    " and resid 32   and name HD1%)
      3.600     1.700     1.700 peak   154 spectrum    1 weight  0.10000E+01 volume  0.13027E-02 ppm1      6.303 ppm2      0.096 CV     1
 ASSI {  156}
   (  segid "    " and resid 81   and name HE% )
   (  segid "    " and resid 32   and name HG2%)
      2.500     0.800     0.800 peak   156 spectrum    1 weight  0.10000E+01 volume  0.28813E-02 ppm1      6.303 ppm2      0.725 CV     1
 ASSI {  157}
   (  segid "    " and resid 81   and name HE% )
   (  segid "    " and resid 49   and name HD2%)
      2.700     0.900     0.900 peak   157 spectrum    1 weight  0.10000E+01 volume  0.22845E-02 ppm1      6.306 ppm2      0.855 CV     1
 ASSI {  159}
   (  segid "    " and resid 81   and name HD% )
   (  segid "    " and resid 32   and name HG2%)
      2.300     0.700     0.700 peak   159 spectrum    1 weight  0.10000E+01 volume  0.55349E-02 ppm1      6.812 ppm2      0.719 CV     1
 ASSI {  162}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 47   and name HB3 ))
      2.700     0.900     0.900 peak   162 spectrum    1 weight  0.10000E+01 volume  0.16300E-02 ppm1      6.308 ppm2      1.823 CV     1
 ASSI {  163}
   (  segid "    " and resid 81   and name HD% )
   (( segid "    " and resid 32   and name HB  ))
      3.400     1.400     1.400 peak   163 spectrum    1 weight  0.10000E+01 volume  0.18225E-02 ppm1      6.806 ppm2      1.561 CV     1
 ASSI {  164}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 33   and name HB2 ))
      2.400     2.400     3.600 peak   164 spectrum    1 weight  0.10000E+01 volume  0.14150E-02 ppm1      6.305 ppm2      1.707 CV     1
 ASSI {  165}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 81   and name HB2 ))
      4.200     2.200     1.800 peak   165 spectrum    1 weight  0.10000E+01 volume  0.10332E-02 ppm1      6.308 ppm2      2.429 CV     1
 ASSI {  166}
   (  segid "    " and resid 81   and name HD% )
   (( segid "    " and resid 81   and name HB2 ))
      2.500     0.800     0.800 peak   166 spectrum    1 weight  0.10000E+01 volume  0.28653E-02 ppm1      6.806 ppm2      2.432 CV     1
 ASSI {  167}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 29   and name HB2 ))
      3.200     1.300     1.300 peak   167 spectrum    1 weight  0.10000E+01 volume  0.20535E-02 ppm1      6.305 ppm2      2.968 CV     1
 ASSI {  168}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 29   and name HB3 ))
      3.800     1.800     1.800 peak   168 spectrum    1 weight  0.10000E+01 volume  0.14984E-02 ppm1      6.310 ppm2      3.213 CV     1
 ASSI {  169}
   (  segid "    " and resid 81   and name HD% )
   (( segid "    " and resid 81   and name HB3 ))
      2.700     0.900     0.900 peak   169 spectrum    1 weight  0.10000E+01 volume  0.28748E-02 ppm1      6.809 ppm2      3.101 CV     1
 ASSI {  170}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 39   and name HA  ))
      3.300     1.400     1.400 peak   170 spectrum    1 weight  0.10000E+01 volume  0.15883E-02 ppm1      6.308 ppm2      3.986 CV     1
 ASSI {  171}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 29   and name HA  ))
      2.700     0.900     0.900 peak   171 spectrum    1 weight  0.10000E+01 volume  0.18738E-02 ppm1      6.309 ppm2      3.930 CV     1
 ASSI {  173}
   (  segid "    " and resid 81   and name HE% )
   (( segid "    " and resid 82   and name HA  ))
      2.300     2.300     3.700 peak   173 spectrum    1 weight  0.10000E+01 volume  0.15273E-02 ppm1      6.305 ppm2      4.696 CV     1
 ASSI {  176}
   (  segid "    " and resid 81   and name HE% )
   (  segid "    " and resid 47   and name HD% )
      2.700     0.900     0.900 peak   176 spectrum    1 weight  0.10000E+01 volume  0.20567E-02 ppm1      6.308 ppm2      6.702 CV     1
 ASSI {  177}
   (  segid "    " and resid 81   and name HE% )
   (  segid "    " and resid 81   and name HD% )
      2.000     0.500     0.500 peak   177 spectrum    1 weight  0.10000E+01 volume  0.10588E-01 ppm1      6.303 ppm2      6.809 CV     1
 ASSI {  178}
   (  segid "    " and resid 81   and name HD% )
   (  segid "    " and resid 47   and name HD% )
      2.800     1.000     1.000 peak   178 spectrum    1 weight  0.10000E+01 volume  0.22428E-02 ppm1      6.809 ppm2      6.699 CV     1
 ASSI {  180}
   (  segid "    " and resid 81   and name HE% )
   (  segid "    " and resid 47   and name HE% )
      4.400     2.500     1.600 peak   180 spectrum    1 weight  0.10000E+01 volume  0.82141E-03 ppm1      6.305 ppm2      7.089 CV     1
 ASSI {  182}
   (  segid "    " and resid 81   and name HD% )
   (( segid "    " and resid 82   and name H   ))
      3.400     1.400     1.400 peak   182 spectrum    1 weight  0.10000E+01 volume  0.14824E-02 ppm1      6.809 ppm2      8.676 CV     1
 ASSI {  183}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name H   ))
      2.900     1.100     1.100 peak   183 spectrum    1 weight  0.10000E+01 volume  0.15979E-02 ppm1      7.067 ppm2      7.673 CV     1
 ASSI {  184}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name HE1 ))
      4.500     2.500     1.500 peak   184 spectrum    1 weight  0.10000E+01 volume  0.73478E-03 ppm1      7.064 ppm2      7.830 CV     1
 ASSI {  185}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 125  and name H   ))
      3.900     1.900     1.900 peak   185 spectrum    1 weight  0.10000E+01 volume  0.97541E-03 ppm1      7.066 ppm2      7.980 CV     1
 ASSI {  187}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name HA  ))
      3.900     1.900     1.900 peak   187 spectrum    1 weight  0.10000E+01 volume  0.15080E-02 ppm1      7.061 ppm2      4.384 CV     1
 ASSI {  188}
   (( segid "    " and resid 124  and name HE1 ))
   (( segid "    " and resid 125  and name HA  ))
      3.400     1.500     1.500 peak   188 spectrum    1 weight  0.10000E+01 volume  0.15273E-02 ppm1      7.822 ppm2      4.423 CV     1
 ASSI {  189}
   (( segid "    " and resid 124  and name HE1 ))
   (( segid "    " and resid 109  and name HB  ))
      4.600     2.600     1.400 peak   189 spectrum    1 weight  0.10000E+01 volume  0.10364E-02 ppm1      7.820 ppm2      3.983 CV     1
 ASSI {  190}
   (( segid "    " and resid 124  and name HE1 ))
   (( segid "    " and resid 109  and name HA  ))
      3.800     1.800     1.800 peak   190 spectrum    1 weight  0.10000E+01 volume  0.82782E-03 ppm1      7.817 ppm2      3.823 CV     1
 ASSI {  191}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name HB2 ))
      3.800     1.800     1.800 peak   191 spectrum    1 weight  0.10000E+01 volume  0.15658E-02 ppm1      7.067 ppm2      2.926 CV     1
 ASSI {  192}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name HB3 ))
      3.000     1.100     1.100 peak   192 spectrum    1 weight  0.10000E+01 volume  0.15947E-02 ppm1      7.069 ppm2      3.052 CV     1
 ASSI {  193}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 113  and name HG3 ))
      3.200     1.200     1.200 peak   193 spectrum    1 weight  0.10000E+01 volume  0.11904E-02 ppm1      7.063 ppm2      2.288 CV     1
 ASSI {  194}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 113  and name HG2 ))
      4.300     2.300     1.700 peak   194 spectrum    1 weight  0.10000E+01 volume  0.14439E-02 ppm1      7.064 ppm2      1.733 CV     1
 OR {  194}
   (( segid "    " and resid 124  and name HD2 ))
   (  segid "    " and resid 113  and name HE% )
 ASSI {  195}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 113  and name HB2 ))
      3.500     1.500     1.500 peak   195 spectrum    1 weight  0.10000E+01 volume  0.20760E-02 ppm1      7.066 ppm2      1.888 CV     1
 ASSI {  196}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 125  and name HB2 ))
      4.400     2.400     1.600 peak   196 spectrum    1 weight  0.10000E+01 volume  0.81500E-03 ppm1      7.066 ppm2      2.433 CV     1
 ASSI {  197}
   (( segid "    " and resid 188  and name HE1 ))
   (( segid "    " and resid 186  and name HG3 ))
      2.400     0.700     0.700 peak   197 spectrum    1 weight  0.10000E+01 volume  0.49637E-02 ppm1      7.822 ppm2      2.385 CV     1
 ASSI {  198}
   (( segid "    " and resid 188  and name HE1 ))
   (( segid "    " and resid 186  and name HB2 ))
      2.700     0.900     0.900 peak   198 spectrum    1 weight  0.10000E+01 volume  0.80440E-02 ppm1      7.820 ppm2      2.159 CV     1
 ASSI {  199}
   (( segid "    " and resid 188  and name HE1 ))
   (( segid "    " and resid 186  and name HB3 ))
      2.500     0.800     0.800 peak   199 spectrum    1 weight  0.10000E+01 volume  0.58941E-02 ppm1      7.821 ppm2      1.658 CV     1
 ASSI {  200}
   (( segid "    " and resid 124  and name HD2 ))
   (  segid "    " and resid 109  and name HG2%)
      4.500     2.600     1.500 peak   200 spectrum    1 weight  0.10000E+01 volume  0.11423E-02 ppm1      7.066 ppm2      1.196 CV     1
 ASSI {  201}
   (( segid "    " and resid 124  and name HE1 ))
   (  segid "    " and resid 109  and name HG2%)
      3.200     1.300     1.300 peak   201 spectrum    1 weight  0.10000E+01 volume  0.14246E-02 ppm1      7.827 ppm2      1.201 CV     1
 ASSI {  203}
   (  segid "    " and resid 127  and name HD% )
   (( segid "    " and resid 194  and name H   ))
      3.600     1.600     1.600 peak   203 spectrum    1 weight  0.10000E+01 volume  0.92088E-03 ppm1      6.860 ppm2      8.643 CV     1
 ASSI {  205}
   (  segid "    " and resid 199  and name HE% )
   (( segid "    " and resid 199  and name H   ))
      4.300     2.300     1.700 peak   205 spectrum    1 weight  0.10000E+01 volume  0.14471E-02 ppm1      6.621 ppm2      7.822 CV     1
 ASSI {  207}
   (  segid "    " and resid 127  and name HE% )
   (( segid "    " and resid 126  and name H   ))
      3.200     1.300     1.300 peak   207 spectrum    1 weight  0.10000E+01 volume  0.13893E-02 ppm1      6.626 ppm2      7.662 CV     1
 ASSI {  208}
   (  segid "    " and resid 127  and name HE% )
   (  segid "    " and resid 127  and name HD% )
      2.200     0.600     0.600 peak   208 spectrum    1 weight  0.10000E+01 volume  0.87211E-02 ppm1      6.631 ppm2      6.859 CV     1
 ASSI {  210}
   (  segid "    " and resid 127  and name HD% )
   (( segid "    " and resid 127  and name HA  ))
      3.400     1.400     1.400 peak   210 spectrum    1 weight  0.10000E+01 volume  0.69627E-03 ppm1      6.857 ppm2      4.717 CV     1
 ASSI {  211}
   (  segid "    " and resid 127  and name HE% )
   (( segid "    " and resid 127  and name HA  ))
      3.900     1.900     1.900 peak   211 spectrum    1 weight  0.10000E+01 volume  0.21113E-02 ppm1      6.618 ppm2      4.713 CV     1
 ASSI {  214}
   (  segid "    " and resid 199  and name HE% )
   (( segid "    " and resid 126  and name HA  ))
      4.300     2.400     1.700 peak   214 spectrum    1 weight  0.10000E+01 volume  0.11679E-02 ppm1      6.613 ppm2      4.157 CV     1
 ASSI {  215}
   (  segid "    " and resid 127  and name HD% )
   (( segid "    " and resid 127  and name HB3 ))
      2.600     0.900     0.900 peak   215 spectrum    1 weight  0.10000E+01 volume  0.29358E-02 ppm1      6.860 ppm2      2.794 CV     1
 OR {  215}
   (  segid "    " and resid 127  and name HD% )
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  216}
   (  segid "    " and resid 127  and name HE% )
   (( segid "    " and resid 116  and name HB3 ))
      3.300     1.300     1.300 peak   216 spectrum    1 weight  0.10000E+01 volume  0.26727E-02 ppm1      6.623 ppm2      2.794 CV     1
 ASSI {  217}
   (  segid "    " and resid 127  and name HD% )
   (( segid "    " and resid 126  and name HB2 ))
      3.600     1.600     1.600 peak   217 spectrum    1 weight  0.10000E+01 volume  0.86953E-03 ppm1      6.860 ppm2      1.824 CV     1
 ASSI {  218}
   (  segid "    " and resid 127  and name HD% )
   (( segid "    " and resid 193  and name HG  ))
      3.700     1.700     1.700 peak   218 spectrum    1 weight  0.10000E+01 volume  0.12257E-02 ppm1      6.860 ppm2      1.386 CV     1
 ASSI {  221}
   (  segid "    " and resid 127  and name HE% )
   (( segid "    " and resid 121  and name HB  ))
      4.100     2.100     1.900 peak   221 spectrum    1 weight  0.10000E+01 volume  0.12353E-02 ppm1      6.639 ppm2      1.203 CV     1
 ASSI {  222}
   (  segid "    " and resid 127  and name HE% )
   (( segid "    " and resid 112  and name HG  ))
      3.900     1.900     1.900 peak   222 spectrum    1 weight  0.10000E+01 volume  0.13604E-02 ppm1      6.639 ppm2      1.497 CV     1
 ASSI {  225}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 173  and name HB3 ))
      3.400     1.500     1.500 peak   225 spectrum    1 weight  0.10000E+01 volume  0.31573E-02 ppm1      7.254 ppm2      3.530 CV     1
 ASSI {  226}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 173  and name HB2 ))
      2.500     0.800     0.800 peak   226 spectrum    1 weight  0.10000E+01 volume  0.41391E-02 ppm1      7.256 ppm2      2.996 CV     1
 ASSI {  228}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 172  and name HA  ))
      4.000     2.000     2.000 peak   228 spectrum    1 weight  0.10000E+01 volume  0.13829E-02 ppm1      7.258 ppm2      4.747 CV     1
 ASSI {  229}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 173  and name HA  ))
      3.100     1.200     1.200 peak   229 spectrum    1 weight  0.10000E+01 volume  0.15369E-02 ppm1      7.252 ppm2      4.655 CV     1
 ASSI {  230}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 173  and name H   ))
      2.400     0.700     0.700 peak   230 spectrum    1 weight  0.10000E+01 volume  0.60835E-02 ppm1      7.254 ppm2      7.673 CV     1
 ASSI {  231}
   (( segid "    " and resid 173  and name HE3 ))
   (( segid "    " and resid 173  and name HZ3 ))
      2.900     1.100     1.100 peak   231 spectrum    1 weight  0.10000E+01 volume  0.22492E-02 ppm1      7.562 ppm2      6.718 CV     1
 ASSI {  233}
   (( segid "    " and resid 173  and name HH2 ))
   (( segid "    " and resid 173  and name HZ3 ))
      2.800     1.000     1.000 peak   233 spectrum    1 weight  0.10000E+01 volume  0.23070E-02 ppm1      6.856 ppm2      6.710 CV     1
 ASSI {  234}
   (( segid "    " and resid 173  and name HZ2 ))
   (( segid "    " and resid 173  and name HH2 ))
      2.600     0.800     0.800 peak   234 spectrum    1 weight  0.10000E+01 volume  0.47007E-02 ppm1      7.333 ppm2      6.849 CV     1
 ASSI {  235}
   (( segid "    " and resid 173  and name HZ2 ))
   (( segid "    " and resid 173  and name HZ3 ))
      4.400     2.400     1.600 peak   235 spectrum    1 weight  0.10000E+01 volume  0.12032E-02 ppm1      7.328 ppm2      6.724 CV     1
 ASSI {  239}
   (( segid "    " and resid 173  and name HZ2 ))
   (( segid "    " and resid 194  and name HG3 ))
      3.600     1.600     1.600 peak   239 spectrum    1 weight  0.10000E+01 volume  0.99146E-03 ppm1      7.329 ppm2      1.422 CV     1
 ASSI {  241}
   (( segid "    " and resid 176  and name HD2 ))
   (( segid "    " and resid 108  and name HB  ))
      4.100     2.100     1.900 peak   241 spectrum    1 weight  0.10000E+01 volume  0.86953E-03 ppm1      6.918 ppm2      2.292 CV     1
 ASSI {  242}
   (( segid "    " and resid 176  and name HD2 ))
   (( segid "    " and resid 176  and name HB3 ))
      4.100     2.100     1.900 peak   242 spectrum    1 weight  0.10000E+01 volume  0.12385E-02 ppm1      6.907 ppm2      3.501 CV     1
 ASSI {  243}
   (( segid "    " and resid 176  and name HD2 ))
   (( segid "    " and resid 176  and name HB2 ))
      3.200     1.300     1.300 peak   243 spectrum    1 weight  0.10000E+01 volume  0.12642E-02 ppm1      6.912 ppm2      2.992 CV     1
 ASSI {  244}
   (( segid "    " and resid 176  and name HE1 ))
   (( segid "    " and resid 128  and name HB2 ))
      4.200     2.200     1.800 peak   244 spectrum    1 weight  0.10000E+01 volume  0.28942E-02 ppm1      8.028 ppm2      3.650 CV     1
 ASSI {  245}
   (( segid "    " and resid 176  and name HE1 ))
   (( segid "    " and resid 112  and name HB2 ))
      2.600     0.800     0.800 peak   245 spectrum    1 weight  0.10000E+01 volume  0.13572E-02 ppm1      8.028 ppm2      1.647 CV     1
 ASSI {  246}
   (( segid "    " and resid 176  and name HE1 ))
   (( segid "    " and resid 112  and name HG  ))
      4.300     2.300     1.700 peak   246 spectrum    1 weight  0.10000E+01 volume  0.16075E-02 ppm1      8.028 ppm2      1.491 CV     1
 ASSI {  247}
   (( segid "    " and resid 176  and name HE1 ))
   (  segid "    " and resid 108  and name HG2%)
      2.400     2.400     3.600 peak   247 spectrum    1 weight  0.10000E+01 volume  0.12321E-02 ppm1      8.026 ppm2      0.899 CV     1
 ASSI {  248}
   (( segid "    " and resid 176  and name HE1 ))
   (  segid "    " and resid 112  and name HD1%)
      2.600     0.900     0.900 peak   248 spectrum    1 weight  0.10000E+01 volume  0.41585E-02 ppm1      8.025 ppm2      0.737 CV     1
 ASSI {  249}
   (( segid "    " and resid 176  and name HE1 ))
   (  segid "    " and resid 112  and name HD2%)
      2.000     0.500     0.500 peak   249 spectrum    1 weight  0.10000E+01 volume  0.66803E-02 ppm1      8.026 ppm2      0.680 CV     1
 ASSI {  250}
   (( segid "    " and resid 176  and name HE1 ))
   (  segid "    " and resid 108  and name HG1%)
      2.700     0.900     0.900 peak   250 spectrum    1 weight  0.10000E+01 volume  0.16909E-02 ppm1      8.028 ppm2      0.485 CV     1
 ASSI {  251}
   (( segid "    " and resid 176  and name HD2 ))
   (  segid "    " and resid 112  and name HD1%)
      4.300     2.300     1.700 peak   251 spectrum    1 weight  0.10000E+01 volume  0.14567E-02 ppm1      6.907 ppm2      0.750 CV     1
 ASSI {  253}
   (( segid "    " and resid 176  and name HD2 ))
   (  segid "    " and resid 112  and name HD2%)
      4.000     2.000     2.000 peak   253 spectrum    1 weight  0.10000E+01 volume  0.17455E-02 ppm1      6.912 ppm2      0.678 CV     1
 ASSI {  255}
   (( segid "    " and resid 176  and name HD2 ))
   (( segid "    " and resid 176  and name HA  ))
      3.700     1.700     1.700 peak   255 spectrum    1 weight  0.10000E+01 volume  0.14728E-02 ppm1      6.909 ppm2      4.254 CV     1
 ASSI {  256}
   (( segid "    " and resid 176  and name HD2 ))
   (( segid "    " and resid 175  and name HA  ))
      3.400     1.400     1.400 peak   256 spectrum    1 weight  0.10000E+01 volume  0.13251E-02 ppm1      6.912 ppm2      4.632 CV     1
 ASSI {  257}
   (( segid "    " and resid 176  and name HE1 ))
   (( segid "    " and resid 128  and name HA  ))
      3.500     1.600     1.600 peak   257 spectrum    1 weight  0.10000E+01 volume  0.25059E-02 ppm1      8.027 ppm2      4.634 CV     1
 ASSI {  258}
   (( segid "    " and resid 176  and name HE1 ))
   (( segid "    " and resid 176  and name HD2 ))
      3.800     1.800     1.800 peak   258 spectrum    1 weight  0.10000E+01 volume  0.10075E-02 ppm1      8.029 ppm2      6.915 CV     1
 ASSI {  259}
   (( segid "    " and resid 176  and name HD2 ))
   (( segid "    " and resid 177  and name H   ))
      2.400     2.400     3.600 peak   259 spectrum    1 weight  0.10000E+01 volume  0.12064E-02 ppm1      6.906 ppm2      8.765 CV     1
 ASSI {  260}
   (( segid "    " and resid 176  and name HD2 ))
   (( segid "    " and resid 176  and name H   ))
      3.100     1.200     1.200 peak   260 spectrum    1 weight  0.10000E+01 volume  0.18321E-02 ppm1      6.912 ppm2      9.304 CV     1
 ASSI {  261}
   (( segid "    " and resid 176  and name HE1 ))
   (( segid "    " and resid 129  and name H   ))
      3.700     1.700     1.700 peak   261 spectrum    1 weight  0.10000E+01 volume  0.20824E-02 ppm1      8.025 ppm2      8.887 CV     1
 ASSI {  262}
   (( segid "    " and resid 188  and name HD2 ))
   (( segid "    " and resid 188  and name HE1 ))
      4.300     2.300     1.700 peak   262 spectrum    1 weight  0.10000E+01 volume  0.10492E-02 ppm1      6.985 ppm2      7.828 CV     1
 ASSI {  263}
   (( segid "    " and resid 188  and name HD2 ))
   (( segid "    " and resid 188  and name HA  ))
      4.000     2.000     2.000 peak   263 spectrum    1 weight  0.10000E+01 volume  0.16589E-02 ppm1      6.986 ppm2      4.505 CV     1
 ASSI {  264}
   (( segid "    " and resid 188  and name HD2 ))
   (( segid "    " and resid 189  and name HA  ))
      3.400     1.500     1.500 peak   264 spectrum    1 weight  0.10000E+01 volume  0.10332E-02 ppm1      6.984 ppm2      3.975 CV     1
 ASSI {  265}
   (( segid "    " and resid 188  and name HD2 ))
   (( segid "    " and resid 188  and name HB3 ))
      3.800     1.800     1.800 peak   265 spectrum    1 weight  0.10000E+01 volume  0.22781E-02 ppm1      6.980 ppm2      2.972 CV     1
 ASSI {  266}
   (( segid "    " and resid 188  and name HD2 ))
   (( segid "    " and resid 188  and name HB2 ))
      2.800     1.000     1.000 peak   266 spectrum    1 weight  0.10000E+01 volume  0.28782E-02 ppm1      6.984 ppm2      3.232 CV     1
 ASSI {  267}
   (( segid "    " and resid 188  and name HD2 ))
   (( segid "    " and resid 186  and name HB2 ))
      3.500     1.500     1.500 peak   267 spectrum    1 weight  0.10000E+01 volume  0.14503E-02 ppm1      6.984 ppm2      2.157 CV     1
 ASSI {  268}
   (( segid "    " and resid 188  and name HD2 ))
   (( segid "    " and resid 189  and name HB3 ))
      3.400     1.400     1.400 peak   268 spectrum    1 weight  0.10000E+01 volume  0.19123E-02 ppm1      6.984 ppm2      1.852 CV     1
 ASSI {  269}
   (( segid "    " and resid 188  and name HD2 ))
   (( segid "    " and resid 186  and name HB3 ))
      4.200     2.200     1.800 peak   269 spectrum    1 weight  0.10000E+01 volume  0.10877E-02 ppm1      6.984 ppm2      1.661 CV     1
 ASSI {  270}
   (( segid "    " and resid 19   and name HZ  ))
   (  segid "    " and resid 8    and name HD1%)
      2.700     0.900     0.900 peak   270 spectrum    1 weight  0.10000E+01 volume  0.48451E-02 ppm1      6.957 ppm2      0.720 CV     1
 OR {  270}
   (( segid "    " and resid 19   and name HZ  ))
   (  segid "    " and resid 8    and name HG2%)
 ASSI {  274}
   (( segid "    " and resid 197  and name HZ  ))
   (( segid "    " and resid 196  and name HE2 ))
      3.600     1.600     1.600 peak   274 spectrum    1 weight  0.10000E+01 volume  0.12546E-02 ppm1      6.960 ppm2      1.962 CV     1
 ASSI {  278}
   (  segid "    " and resid 197  and name HD% )
   (( segid "    " and resid 197  and name HB2 ))
      2.500     0.800     0.800 peak   278 spectrum    1 weight  0.10000E+01 volume  0.29358E-02 ppm1      6.998 ppm2      2.425 CV     1
 ASSI {  284}
   (  segid "    " and resid 199  and name HD% )
   (  segid "    " and resid 199  and name HE% )
      1.600     0.300     0.600 peak   284 spectrum    1 weight  0.10000E+01 volume  0.71010E-01 ppm1      6.963 ppm2      6.611 CV     1
 ASSI {  287}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 201  and name HA  ))
      2.400     0.700     0.700 peak   287 spectrum    1 weight  0.10000E+01 volume  0.85511E-02 ppm1      6.964 ppm2      4.541 CV     1
 ASSI {  289}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 126  and name HA  ))
      4.600     2.700     1.400 peak   289 spectrum    1 weight  0.10000E+01 volume  0.15818E-02 ppm1      6.965 ppm2      4.160 CV     1
 ASSI {  290}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 199  and name HB2 ))
      2.200     0.600     0.600 peak   290 spectrum    1 weight  0.10000E+01 volume  0.95008E-02 ppm1      6.962 ppm2      2.990 CV     1
 ASSI {  291}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 199  and name HB3 ))
      2.300     0.600     0.600 peak   291 spectrum    1 weight  0.10000E+01 volume  0.12796E-01 ppm1      6.963 ppm2      2.757 CV     1
 ASSI {  292}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 197  and name HB2 ))
      3.200     1.300     1.300 peak   292 spectrum    1 weight  0.10000E+01 volume  0.18995E-02 ppm1      6.961 ppm2      2.427 CV     1
 ASSI {  294}
   (  segid "    " and resid 199  and name HE% )
   (( segid "    " and resid 126  and name HB3 ))
      3.000     1.100     1.100 peak   294 spectrum    1 weight  0.10000E+01 volume  0.12963E-02 ppm1      6.607 ppm2      2.098 CV     1
 OR {  294}
   (  segid "    " and resid 199  and name HE% )
   (( segid "    " and resid 126  and name HG3 ))
 ASSI {  295}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 126  and name HB3 ))
      3.700     1.700     1.700 peak   295 spectrum    1 weight  0.10000E+01 volume  0.17840E-02 ppm1      6.964 ppm2      2.095 CV     1
 OR {  295}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 126  and name HG3 ))
 ASSI {  296}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 126  and name HB2 ))
      3.800     1.800     1.800 peak   296 spectrum    1 weight  0.10000E+01 volume  0.23455E-02 ppm1      6.963 ppm2      1.815 CV     1
 OR {  296}
   (  segid "    " and resid 199  and name HD% )
   (( segid "    " and resid 126  and name HG2 ))
 ASSI {  297}
   (  segid "    " and resid 199  and name HE% )
   (( segid "    " and resid 126  and name HB2 ))
      3.400     1.400     1.400 peak   297 spectrum    1 weight  0.10000E+01 volume  0.22781E-02 ppm1      6.609 ppm2      1.814 CV     1
 OR {  297}
   (  segid "    " and resid 199  and name HE% )
   (( segid "    " and resid 126  and name HG2 ))
 ASSI {  298}
   (( segid "    " and resid 188  and name HE1 ))
   (( segid "    " and resid 186  and name H   ))
      4.500     2.500     1.500 peak   298 spectrum    1 weight  0.10000E+01 volume  0.18899E-02 ppm1      7.822 ppm2      8.794 CV     1
 ASSI {  299}
   (( segid "    " and resid 124  and name HE1 ))
   (( segid "    " and resid 124  and name HB2 ))
      4.200     2.200     1.800 peak   299 spectrum    1 weight  0.10000E+01 volume  0.11776E-02 ppm1      7.829 ppm2      2.952 CV     1
 ASSI {  300}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 26   and name H   ))
      4.000     2.000     2.000 peak   300 spectrum    1 weight  0.10000E+01 volume  0.16236E-02 ppm1      6.779 ppm2      8.696 CV     1
 ASSI {  301}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 171  and name HB2 ))
      2.500     0.800     0.800 peak   301 spectrum    1 weight  0.10000E+01 volume  0.14118E-02 ppm1      7.256 ppm2      1.355 CV     1
 ASSI {  302}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 171  and name HB3 ))
      3.800     1.800     1.800 peak   302 spectrum    1 weight  0.10000E+01 volume  0.94013E-03 ppm1      7.256 ppm2      0.885 CV     1
 ASSI {  303}
   (( segid "    " and resid 173  and name HD1 ))
   (  segid "    " and resid 171  and name HD1%)
      4.000     2.000     2.000 peak   303 spectrum    1 weight  0.10000E+01 volume  0.15112E-02 ppm1      7.252 ppm2      0.678 CV     1
 ASSI {  306}
   (  segid "    " and resid 19   and name HE% )
   (( segid "    " and resid 31   and name HB3 ))
      3.700     1.700     1.700 peak   306 spectrum    1 weight  0.10000E+01 volume  0.22557E-02 ppm1      7.124 ppm2      2.313 CV     1
 ASSI {  308}
   (( segid "    " and resid 188  and name HE1 ))
   (( segid "    " and resid 187  and name H   ))
      4.400     2.400     1.600 peak   308 spectrum    1 weight  0.10000E+01 volume  0.12321E-02 ppm1      7.826 ppm2      9.139 CV     1
 ASSI {  310}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 51   and name HA  ))
      3.700     1.800     1.800 peak   310 spectrum    1 weight  0.10000E+01 volume  0.84707E-03 ppm1      5.495 ppm2      4.436 CV     1
 ASSI {  312}
   (  segid "    " and resid 19   and name HE% )
   (( segid "    " and resid 28   and name HA  ))
      2.800     1.000     1.000 peak   312 spectrum    1 weight  0.10000E+01 volume  0.27306E-02 ppm1      7.120 ppm2      4.230 CV     1
 ASSI {  313}
   (  segid "    " and resid 19   and name HE% )
   (  segid "    " and resid 8    and name HD1%)
      2.100     0.500     0.500 peak   313 spectrum    1 weight  0.10000E+01 volume  0.85446E-02 ppm1      7.121 ppm2      0.715 CV     1
 ASSI {    3}
   (( segid "    " and resid 189  and name HB3 ))
   (( segid "    " and resid 190  and name H   ))
      3.400     1.400     1.400 peak     3 spectrum    1 weight  0.10000E+01 volume  0.28774E-02 ppm1      1.839 ppm2      8.629 CV     1
 OR {    3}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name H   ))
 ASSI {    7}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HA  ))
      2.600     0.800     0.800 peak     7 spectrum    1 weight  0.10000E+01 volume  0.49389E-02 ppm1      1.836 ppm2      4.075 CV     1
 OR {    7}
   (( segid "    " and resid 202  and name HB3 ))
   (( segid "    " and resid 202  and name HA  ))
 ASSI {   16}
   (( segid "    " and resid 202  and name HB2 ))
   (( segid "    " and resid 202  and name HG2 ))
      1.800     0.400     0.400 peak    16 spectrum    1 weight  0.10000E+01 volume  0.35889E-01 ppm1      2.045 ppm2      2.206 CV     1
 OR {   16}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 34   and name HG2 ))
 OR {   16}
   (( segid "    " and resid 202  and name HB2 ))
   (( segid "    " and resid 202  and name HG3 ))
 ASSI {   23}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 106  and name HB3 ))
      4.100     2.100     1.900 peak    23 spectrum    1 weight  0.10000E+01 volume  0.26911E-02 ppm1      2.660 ppm2      1.976 CV     1
 OR {   23}
   (( segid "    " and resid 169  and name HB3 ))
   (( segid "    " and resid 135  and name HB3 ))
 ASSI {   24}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 106  and name HB3 ))
      3.600     1.600     1.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.27994E-02 ppm1      2.600 ppm2      1.951 CV     1
 OR {   24}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI {   25}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 106  and name HB2 ))
      3.600     1.600     1.600 peak    25 spectrum    1 weight  0.10000E+01 volume  0.22579E-02 ppm1      2.670 ppm2      1.818 CV     1
 OR {   25}
   (( segid "    " and resid 197  and name HB3 ))
   (( segid "    " and resid 126  and name HB2 ))
 ASSI {   28}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 106  and name HG3 ))
      3.900     1.900     1.900 peak    28 spectrum    1 weight  0.10000E+01 volume  0.10528E-02 ppm1      2.625 ppm2      1.155 CV     1
 OR {   28}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {   30}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 27   and name HA  ))
      2.300     0.600     0.600 peak    30 spectrum    1 weight  0.10000E+01 volume  0.10182E-01 ppm1      2.605 ppm2      4.586 CV     1
 OR {   30}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 27   and name HA  ))
 OR {   30}
   (( segid "    " and resid 201  and name HB2 ))
   (( segid "    " and resid 201  and name HA  ))
 ASSI {   31}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 46   and name HA  ))
      2.200     0.600     0.600 peak    31 spectrum    1 weight  0.10000E+01 volume  0.10724E-01 ppm1      2.659 ppm2      4.456 CV     1
 OR {   31}
   (( segid "    " and resid 197  and name HB3 ))
   (( segid "    " and resid 197  and name HA  ))
 OR {   31}
   (( segid "    " and resid 169  and name HB3 ))
   (( segid "    " and resid 169  and name HA  ))
 ASSI {   32}
   (( segid "    " and resid 197  and name HB3 ))
   (  segid "    " and resid 199  and name HD% )
      2.400     0.700     0.700 peak    32 spectrum    1 weight  0.10000E+01 volume  0.52198E-02 ppm1      2.681 ppm2      7.005 CV     1
 OR {   32}
   (( segid "    " and resid 197  and name HB3 ))
   (  segid "    " and resid 197  and name HD% )
 OR {   32}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 110  and name H   ))
 ASSI {   76}
   (( segid "    " and resid 199  and name HA  ))
   (( segid "    " and resid 198  and name HB2 ))
      4.000     2.000     2.000 peak    76 spectrum    1 weight  0.10000E+01 volume  0.11611E-02 ppm1      4.471 ppm2      2.692 CV     1
 OR {   76}
   (( segid "    " and resid 199  and name HA  ))
   (( segid "    " and resid 197  and name HB3 ))
 ASSI {  104}
   (( segid "    " and resid 198  and name HA  ))
   (  segid "    " and resid 198  and name HD% )
      2.800     1.000     1.000 peak   104 spectrum    1 weight  0.10000E+01 volume  0.38049E-02 ppm1      4.407 ppm2      6.970 CV     1
 OR {  104}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 110  and name H   ))
 ASSI {  109}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 110  and name HB2 ))
      2.600     0.800     0.800 peak   109 spectrum    1 weight  0.10000E+01 volume  0.67431E-02 ppm1      4.405 ppm2      2.678 CV     1
 OR {  109}
   (( segid "    " and resid 198  and name HA  ))
   (( segid "    " and resid 198  and name HB2 ))
 ASSI {  182}
   (( segid "    " and resid 121  and name HG13))
   (( segid "    " and resid 120  and name H   ))
      3.700     1.700     1.700 peak   182 spectrum    1 weight  0.10000E+01 volume  0.16892E-02 ppm1      0.820 ppm2      7.552 CV     1
 OR {  182}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 71   and name H   ))
 ASSI {  203}
   (( segid "    " and resid 195  and name HG3 ))
   (( segid "    " and resid 195  and name HB2 ))
      2.400     0.700     0.700 peak   203 spectrum    1 weight  0.10000E+01 volume  0.63234E-02 ppm1      0.818 ppm2      1.206 CV     1
 OR {  203}
   (( segid "    " and resid 121  and name HG13))
   (( segid "    " and resid 121  and name HB  ))
 OR {  203}
   (( segid "    " and resid 195  and name HG2 ))
   (( segid "    " and resid 195  and name HB2 ))
 OR {  203}
   (( segid "    " and resid 121  and name HG12))
   (( segid "    " and resid 121  and name HB  ))
 ASSI {  204}
   (( segid "    " and resid 195  and name HG3 ))
   (( segid "    " and resid 195  and name HB2 ))
      2.500     0.800     0.800 peak   204 spectrum    1 weight  0.10000E+01 volume  0.54331E-02 ppm1      0.785 ppm2      1.209 CV     1
 OR {  204}
   (  segid "    " and resid 191  and name HD1%)
   (( segid "    " and resid 191  and name HB3 ))
 OR {  204}
   (( segid "    " and resid 195  and name HG2 ))
   (( segid "    " and resid 195  and name HB2 ))
 ASSI {  215}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 82   and name H   ))
      3.700     1.700     1.700 peak   215 spectrum    1 weight  0.10000E+01 volume  0.11780E-02 ppm1      1.702 ppm2      8.664 CV     1
 OR {  215}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 194  and name H   ))
 ASSI {  221}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 82   and name HA  ))
      2.700     0.900     0.900 peak   221 spectrum    1 weight  0.10000E+01 volume  0.18855E-02 ppm1      1.714 ppm2      4.728 CV     1
 OR {  221}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 194  and name HA  ))
 ASSI {  224}
   (( segid "    " and resid 4    and name HG  ))
   (( segid "    " and resid 4    and name HA  ))
      2.800     1.000     1.000 peak   224 spectrum    1 weight  0.10000E+01 volume  0.28536E-02 ppm1      1.446 ppm2      4.722 CV     1
 OR {  224}
   (( segid "    " and resid 194  and name HG2 ))
   (( segid "    " and resid 194  and name HA  ))
 ASSI {  236}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 82   and name HB2 ))
      1.900     0.400     0.400 peak   236 spectrum    1 weight  0.10000E+01 volume  0.60965E-02 ppm1      1.708 ppm2      1.456 CV     1
 OR {  236}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 194  and name HB2 ))
 OR {  236}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 194  and name HG3 ))
 OR {  236}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 194  and name HG2 ))
 ASSI {  246}
   (( segid "    " and resid 36   and name HG13))
   (( segid "    " and resid 36   and name HB  ))
      2.600     0.800     0.800 peak   246 spectrum    1 weight  0.10000E+01 volume  0.22782E-02 ppm1      1.479 ppm2      1.885 CV     1
 OR {  246}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HB3 ))
 ASSI {  249}
   (( segid "    " and resid 194  and name HB3 ))
   (  segid "    " and resid 193  and name HD2%)
      2.500     2.500     3.500 peak   249 spectrum    1 weight  0.10000E+01 volume  0.97492E-03 ppm1      1.710 ppm2      0.713 CV     1
 OR {  249}
   (( segid "    " and resid 82   and name HB3 ))
   (  segid "    " and resid 10   and name HD1%)
 ASSI {  254}
   (( segid "    " and resid 91   and name HD2 ))
   (  segid "    " and resid 190  and name HG2%)
      3.400     1.400     1.400 peak   254 spectrum    1 weight  0.10000E+01 volume  0.20717E-02 ppm1      3.004 ppm2      0.953 CV     1
 OR {  254}
   (( segid "    " and resid 194  and name HD2 ))
   (  segid "    " and resid 93   and name HD1%)
 ASSI {  260}
   (( segid "    " and resid 91   and name HD2 ))
   (  segid "    " and resid 192  and name HD2%)
      2.400     0.700     0.700 peak   260 spectrum    1 weight  0.10000E+01 volume  0.52808E-02 ppm1      2.991 ppm2      0.702 CV     1
 OR {  260}
   (( segid "    " and resid 194  and name HD3 ))
   (  segid "    " and resid 192  and name HD1%)
 ASSI {  265}
   (( segid "    " and resid 16   and name HB  ))
   (( segid "    " and resid 16   and name H   ))
      2.500     0.800     0.800 peak   265 spectrum    1 weight  0.10000E+01 volume  0.50743E-02 ppm1      3.871 ppm2      8.597 CV     1
 OR {  265}
   (( segid "    " and resid 190  and name HB  ))
   (( segid "    " and resid 190  and name H   ))
 ASSI {  276}
   (( segid "    " and resid 16   and name HB  ))
   (  segid "    " and resid 16   and name HG2%)
      2.300     0.700     0.700 peak   276 spectrum    1 weight  0.10000E+01 volume  0.10887E-01 ppm1      3.869 ppm2      0.928 CV     1
 OR {  276}
   (( segid "    " and resid 190  and name HB  ))
   (  segid "    " and resid 190  and name HG2%)
 ASSI {  301}
   (( segid "    " and resid 186  and name HB2 ))
   (( segid "    " and resid 186  and name HB3 ))
      2.000     0.500     0.500 peak   301 spectrum    1 weight  0.10000E+01 volume  0.46443E-02 ppm1      2.147 ppm2      1.706 CV     1
 OR {  301}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 79   and name HB2 ))
 OR {  301}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI {  303}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB3 ))
      2.300     0.600     0.600 peak   303 spectrum    1 weight  0.10000E+01 volume  0.73457E-02 ppm1      4.326 ppm2      1.665 CV     1
 OR {  303}
   (( segid "    " and resid 186  and name HA  ))
   (( segid "    " and resid 186  and name HB3 ))
 ASSI {  306}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 63   and name HB3 ))
      2.400     0.700     0.700 peak   306 spectrum    1 weight  0.10000E+01 volume  0.70850E-02 ppm1      2.403 ppm2      2.055 CV     1
 OR {  306}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 34   and name HB3 ))
 ASSI {  309}
   (( segid "    " and resid 187  and name HG3 ))
   (( segid "    " and resid 187  and name HB3 ))
      2.400     0.700     0.700 peak   309 spectrum    1 weight  0.10000E+01 volume  0.10108E-01 ppm1      2.209 ppm2      1.914 CV     1
 OR {  309}
   (( segid "    " and resid 187  and name HG3 ))
   (( segid "    " and resid 187  and name HB2 ))
 OR {  309}
   (( segid "    " and resid 182  and name HG3 ))
   (( segid "    " and resid 182  and name HB2 ))
 ASSI {  311}
   (( segid "    " and resid 182  and name HG3 ))
   (( segid "    " and resid 178  and name HG3 ))
      3.800     1.800     1.800 peak   311 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      2.208 ppm2      1.485 CV     1
 OR {  311}
   (( segid "    " and resid 187  and name HG3 ))
   (( segid "    " and resid 86   and name HG2 ))
 ASSI {  312}
   (( segid "    " and resid 186  and name HG2 ))
   (( segid "    " and resid 186  and name HG3 ))
      1.700     0.400     0.500 peak   312 spectrum    1 weight  0.10000E+01 volume  0.15101E-01 ppm1      2.174 ppm2      2.393 CV     1
 OR {  312}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HG3 ))
 ASSI {  323}
   (( segid "    " and resid 186  and name HA  ))
   (( segid "    " and resid 185  and name HA  ))
      4.000     2.000     2.000 peak   323 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      4.331 ppm2      3.836 CV     1
 OR {  323}
   (( segid "    " and resid 186  and name HA  ))
   (( segid "    " and resid 187  and name HA  ))
 ASSI {  342}
   (( segid "    " and resid 185  and name HB  ))
   (( segid "    " and resid 186  and name H   ))
      3.300     1.300     1.300 peak   342 spectrum    1 weight  0.10000E+01 volume  0.90382E-03 ppm1      1.692 ppm2      8.808 CV     1
 OR {  342}
   (( segid "    " and resid 186  and name HB3 ))
   (( segid "    " and resid 186  and name H   ))
 ASSI {  346}
   (( segid "    " and resid 186  and name HB2 ))
   (( segid "    " and resid 187  and name H   ))
      3.300     1.300     1.300 peak   346 spectrum    1 weight  0.10000E+01 volume  0.21326E-02 ppm1      2.143 ppm2      9.158 CV     1
 OR {  346}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 80   and name H   ))
 ASSI {  349}
   (( segid "    " and resid 187  and name HG3 ))
   (( segid "    " and resid 187  and name H   ))
      3.500     1.500     1.500 peak   349 spectrum    1 weight  0.10000E+01 volume  0.37269E-02 ppm1      2.204 ppm2      9.145 CV     1
 OR {  349}
   (( segid "    " and resid 186  and name HG2 ))
   (( segid "    " and resid 187  and name H   ))
 ASSI {  352}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 131  and name HE  ))
      2.600     0.900     0.900 peak   352 spectrum    1 weight  0.10000E+01 volume  0.54129E-02 ppm1      0.707 ppm2      9.033 CV     1
 OR {  352}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 8    and name H   ))
 OR {  352}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 131  and name HE  ))
 ASSI {  354}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 90   and name H   ))
      3.000     1.200     1.200 peak   354 spectrum    1 weight  0.10000E+01 volume  0.53248E-02 ppm1      0.693 ppm2      8.802 CV     1
 OR {  354}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 186  and name H   ))
 ASSI {  362}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 114  and name H   ))
      4.300     2.300     1.700 peak   362 spectrum    1 weight  0.10000E+01 volume  0.12220E-02 ppm1      0.751 ppm2      7.465 CV     1
 OR {  362}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 66   and name H   ))
 ASSI {  376}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 114  and name HB  ))
      2.900     1.000     1.000 peak   376 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      0.747 ppm2      4.254 CV     1
 OR {  376}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  389}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 131  and name HD2 ))
      3.300     1.300     1.300 peak   389 spectrum    1 weight  0.10000E+01 volume  0.16316E-02 ppm1      0.753 ppm2      2.970 CV     1
 OR {  389}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 29   and name HB2 ))
 ASSI {  394}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 111  and name HG2 ))
      3.700     1.700     1.700 peak   394 spectrum    1 weight  0.10000E+01 volume  0.14217E-02 ppm1      0.698 ppm2      2.556 CV     1
 OR {  394}
   (  segid "    " and resid 185  and name HG1%)
   (( segid "    " and resid 183  and name HG3 ))
 ASSI {  401}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 97   and name HB  ))
      1.900     0.400     0.400 peak   401 spectrum    1 weight  0.10000E+01 volume  0.27226E-01 ppm1      0.704 ppm2      1.798 CV     1
 OR {  401}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 14   and name HB  ))
 ASSI {  427}
   (( segid "    " and resid 120  and name HA2 ))
   (( segid "    " and resid 120  and name HA3 ))
      1.900     0.500     0.500 peak   427 spectrum    1 weight  0.10000E+01 volume  0.84459E-02 ppm1      3.673 ppm2      4.044 CV     1
 OR {  427}
   (( segid "    " and resid 184  and name HA2 ))
   (( segid "    " and resid 184  and name HA3 ))
 ASSI {  453}
   (( segid "    " and resid 179  and name HA  ))
   (  segid "    " and resid 179  and name HG2%)
      3.200     1.300     1.300 peak   453 spectrum    1 weight  0.10000E+01 volume  0.35204E-02 ppm1      4.583 ppm2      1.180 CV     1
 OR {  453}
   (( segid "    " and resid 179  and name HA  ))
   (  segid "    " and resid 107  and name HG2%)
 ASSI {  476}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 177  and name H   ))
      3.100     1.200     1.200 peak   476 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      4.261 ppm2      8.772 CV     1
 OR {  476}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 109  and name H   ))
 ASSI {  493}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 118  and name HG3 ))
      4.900     3.000     1.100 peak   493 spectrum    1 weight  0.10000E+01 volume  0.73796E-03 ppm1      4.261 ppm2      1.741 CV     1
 OR {  493}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 101  and name HE% )
 ASSI {  501}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 174  and name H   ))
      2.500     0.800     0.800 peak   501 spectrum    1 weight  0.10000E+01 volume  0.31684E-02 ppm1      4.657 ppm2      8.441 CV     1
 OR {  501}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 131  and name H   ))
 ASSI {  522}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 67   and name H   ))
      3.600     1.600     1.600 peak   522 spectrum    1 weight  0.10000E+01 volume  0.11306E-02 ppm1      2.852 ppm2      8.085 CV     1
 OR {  522}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 13   and name H   ))
 ASSI {  528}
   (( segid "    " and resid 172  and name HB3 ))
   (( segid "    " and resid 172  and name HA  ))
      2.600     0.900     0.900 peak   528 spectrum    1 weight  0.10000E+01 volume  0.34426E-02 ppm1      2.627 ppm2      4.762 CV     1
 OR {  528}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI {  532}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 132  and name HA  ))
      3.300     1.300     1.300 peak   532 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      2.836 ppm2      4.139 CV     1
 OR {  532}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 171  and name HA  ))
 ASSI {  541}
   (( segid "    " and resid 172  and name HB3 ))
   (( segid "    " and resid 131  and name HB3 ))
      5.100     3.200     0.900 peak   541 spectrum    1 weight  0.10000E+01 volume  0.93768E-03 ppm1      2.631 ppm2      1.500 CV     1
 OR {  541}
   (( segid "    " and resid 172  and name HB3 ))
   (( segid "    " and resid 133  and name HG  ))
 ASSI {  544}
   (( segid "    " and resid 172  and name HB3 ))
   (  segid "    " and resid 174  and name HD2%)
      3.300     1.300     1.300 peak   544 spectrum    1 weight  0.10000E+01 volume  0.11408E-02 ppm1      2.624 ppm2      0.697 CV     1
 OR {  544}
   (( segid "    " and resid 75   and name HB2 ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI {  551}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 131  and name H   ))
      2.300     0.700     0.700 peak   551 spectrum    1 weight  0.10000E+01 volume  0.31650E-02 ppm1      4.390 ppm2      8.411 CV     1
 OR {  551}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 174  and name H   ))
 ASSI {  558}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 131  and name H   ))
      3.500     1.500     1.500 peak   558 spectrum    1 weight  0.10000E+01 volume  0.33782E-02 ppm1      0.227 ppm2      8.416 CV     1
 OR {  558}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 174  and name H   ))
 ASSI {  563}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 109  and name H   ))
      3.100     1.200     1.200 peak   563 spectrum    1 weight  0.10000E+01 volume  0.52098E-02 ppm1      0.489 ppm2      8.779 CV     1
 OR {  563}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 130  and name H   ))
 ASSI {  565}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 192  and name H   ))
      3.600     1.600     1.600 peak   565 spectrum    1 weight  0.10000E+01 volume  0.19566E-02 ppm1      0.485 ppm2      9.092 CV     1
 OR {  565}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 175  and name H   ))
 ASSI {  569}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 173  and name HZ2 ))
      4.300     2.300     1.700 peak   569 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      0.229 ppm2      7.348 CV     1
 OR {  569}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 194  and name HE  ))
 ASSI {  575}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 110  and name H   ))
      4.200     2.200     1.800 peak   575 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      0.491 ppm2      7.002 CV     1
 OR {  575}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 178  and name H   ))
 ASSI {  595}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 173  and name HB2 ))
      3.500     1.600     1.600 peak   595 spectrum    1 weight  0.10000E+01 volume  0.36356E-02 ppm1      0.487 ppm2      2.988 CV     1
 OR {  595}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 176  and name HB2 ))
 ASSI {  602}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 194  and name HB2 ))
      3.300     1.400     1.400 peak   602 spectrum    1 weight  0.10000E+01 volume  0.57682E-02 ppm1      0.228 ppm2      1.522 CV     1
 OR {  602}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 192  and name HB3 ))
 ASSI {  603}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 194  and name HG2 ))
      2.100     0.600     0.600 peak   603 spectrum    1 weight  0.10000E+01 volume  0.78502E-02 ppm1      0.227 ppm2      1.427 CV     1
 OR {  603}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 192  and name HB2 ))
 OR {  603}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 194  and name HG3 ))
 ASSI {  607}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 129  and name HB3 ))
      2.700     0.900     0.900 peak   607 spectrum    1 weight  0.10000E+01 volume  0.68345E-02 ppm1      0.485 ppm2      1.434 CV     1
 OR {  607}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 192  and name HB2 ))
 ASSI {  609}
   (( segid "    " and resid 130  and name HA  ))
   (  segid "    " and resid 174  and name HD2%)
      3.700     1.700     1.700 peak   609 spectrum    1 weight  0.10000E+01 volume  0.19464E-02 ppm1      4.384 ppm2      0.675 CV     1
 OR {  609}
   (( segid "    " and resid 130  and name HA  ))
   (  segid "    " and resid 129  and name HD2%)
 OR {  609}
   (( segid "    " and resid 130  and name HA  ))
   (  segid "    " and resid 174  and name HD1%)
 ASSI {  621}
   (  segid "    " and resid 108  and name HG1%)
   (  segid "    " and resid 174  and name HD1%)
      2.100     0.600     0.600 peak   621 spectrum    1 weight  0.10000E+01 volume  0.21536E-01 ppm1      0.487 ppm2      0.694 CV     1
 OR {  621}
   (  segid "    " and resid 130  and name HG2%)
   (  segid "    " and resid 192  and name HD1%)
 ASSI {  637}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 193  and name HA  ))
      3.400     1.500     1.500 peak   637 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      0.636 ppm2      4.876 CV     1
 OR {  637}
   (  segid "    " and resid 129  and name HD2%)
   (( segid "    " and resid 191  and name HA  ))
 ASSI {  648}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 4    and name HG  ))
      2.100     0.600     0.600 peak   648 spectrum    1 weight  0.10000E+01 volume  0.12416E-01 ppm1      0.738 ppm2      1.502 CV     1
 OR {  648}
   (  segid "    " and resid 129  and name HD1%)
   (( segid "    " and resid 129  and name HB3 ))
 ASSI {  652}
   (( segid "    " and resid 129  and name HB2 ))
   (  segid "    " and resid 129  and name HD2%)
      3.500     1.500     1.500 peak   652 spectrum    1 weight  0.10000E+01 volume  0.18923E-02 ppm1      1.160 ppm2      0.648 CV     1
 OR {  652}
   (( segid "    " and resid 129  and name HB2 ))
   (  segid "    " and resid 174  and name HD1%)
 ASSI {  657}
   (  segid "    " and resid 129  and name HD1%)
   (  segid "    " and resid 129  and name HD2%)
      1.800     0.400     0.400 peak   657 spectrum    1 weight  0.10000E+01 volume  0.44311E-01 ppm1      0.741 ppm2      0.649 CV     1
 OR {  657}
   (  segid "    " and resid 192  and name HD1%)
   (  segid "    " and resid 192  and name HD2%)
 ASSI {  669}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 124  and name H   ))
      3.700     1.700     1.700 peak   669 spectrum    1 weight  0.10000E+01 volume  0.12660E-02 ppm1      0.490 ppm2      7.677 CV     1
 OR {  669}
   (  segid "    " and resid 121  and name HG2%)
   (( segid "    " and resid 126  and name H   ))
 ASSI {  697}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HB  ))
      2.000     0.500     0.500 peak   697 spectrum    1 weight  0.10000E+01 volume  0.17268E-01 ppm1      0.286 ppm2      1.211 CV     1
 OR {  697}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 119  and name HG12))
 ASSI {  699}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 93   and name HG  ))
      3.800     1.800     1.800 peak   699 spectrum    1 weight  0.10000E+01 volume  0.14962E-02 ppm1      0.284 ppm2      1.734 CV     1
 OR {  699}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  700}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 66   and name HE2 ))
      2.300     0.700     0.700 peak   700 spectrum    1 weight  0.10000E+01 volume  0.39266E-02 ppm1      0.862 ppm2      2.248 CV     1
 OR {  700}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 66   and name HE3 ))
 OR {  700}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 63   and name HG3 ))
 ASSI {  701}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 66   and name HB2 ))
      3.800     1.800     1.800 peak   701 spectrum    1 weight  0.10000E+01 volume  0.15030E-02 ppm1      0.858 ppm2      2.039 CV     1
 OR {  701}
   (( segid "    " and resid 66   and name HD3 ))
   (  segid "    " and resid 24   and name HE% )
 ASSI {  709}
   (  segid "    " and resid 121  and name HD1%)
   (  segid "    " and resid 193  and name HD2%)
      2.500     0.800     0.800 peak   709 spectrum    1 weight  0.10000E+01 volume  0.10754E-01 ppm1      0.286 ppm2      0.767 CV     1
 OR {  709}
   (  segid "    " and resid 121  and name HD1%)
   (  segid "    " and resid 119  and name HG2%)
 ASSI {  718}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HG12))
      2.600     0.800     0.800 peak   718 spectrum    1 weight  0.10000E+01 volume  0.61406E-02 ppm1      4.119 ppm2      0.786 CV     1
 OR {  718}
   (( segid "    " and resid -4   and name HA  ))
   (  segid "    " and resid -4   and name HG2%)
 OR {  718}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HG13))
 ASSI {  723}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 93   and name H   ))
      2.700     2.700     3.300 peak   723 spectrum    1 weight  0.10000E+01 volume  0.72442E-03 ppm1      0.585 ppm2      8.527 CV     1
 OR {  723}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 115  and name H   ))
 ASSI {  756}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 118  and name HB2 ))
      2.100     0.500     0.500 peak   756 spectrum    1 weight  0.10000E+01 volume  0.86456E-02 ppm1      0.592 ppm2      1.952 CV     1
 OR {  756}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HB  ))
 ASSI {  757}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 98   and name HD3 ))
      2.500     0.800     0.800 peak   757 spectrum    1 weight  0.10000E+01 volume  0.23323E-02 ppm1      0.592 ppm2      1.607 CV     1
 OR {  757}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 118  and name HG2 ))
 ASSI {  764}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 119  and name HG2%)
      1.900     0.500     0.500 peak   764 spectrum    1 weight  0.10000E+01 volume  0.22362E-01 ppm1      0.592 ppm2      0.756 CV     1
 OR {  764}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 115  and name HG2%)
 ASSI {  795}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 119  and name HG12))
      2.600     0.800     0.800 peak   795 spectrum    1 weight  0.10000E+01 volume  0.23154E-02 ppm1      3.749 ppm2      1.227 CV     1
 OR {  795}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 121  and name HB  ))
 ASSI {  798}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 119  and name HB  ))
      4.600     2.600     1.400 peak   798 spectrum    1 weight  0.10000E+01 volume  0.62624E-03 ppm1      3.761 ppm2      1.913 CV     1
 OR {  798}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 118  and name HB2 ))
 ASSI {  818}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 118  and name HG3 ))
      2.600     0.900     0.900 peak   818 spectrum    1 weight  0.10000E+01 volume  0.13744E-02 ppm1      3.375 ppm2      1.739 CV     1
 OR {  818}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  821}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      2.200     0.600     0.600 peak   821 spectrum    1 weight  0.10000E+01 volume  0.54297E-02 ppm1      3.374 ppm2      0.719 CV     1
 OR {  821}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 100  and name HG2%)
 ASSI {  842}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 118  and name H   ))
      4.200     2.200     1.800 peak   842 spectrum    1 weight  0.10000E+01 volume  0.91059E-03 ppm1      3.838 ppm2      7.650 CV     1
 OR {  842}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 113  and name H   ))
 ASSI {  851}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 115  and name H   ))
      3.000     1.100     1.100 peak   851 spectrum    1 weight  0.10000E+01 volume  0.53418E-02 ppm1      1.147 ppm2      8.505 CV     1
 OR {  851}
   (  segid "    " and resid 122  and name HG2%)
   (( segid "    " and resid 122  and name H   ))
 ASSI {  868}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 102  and name HG1%)
      2.200     0.600     0.600 peak   868 spectrum    1 weight  0.10000E+01 volume  0.11533E-01 ppm1      1.163 ppm2      0.698 CV     1
 OR {  868}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 100  and name HG2%)
 ASSI {  871}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name H   ))
      3.000     1.100     1.100 peak   871 spectrum    1 weight  0.10000E+01 volume  0.16045E-02 ppm1      3.839 ppm2      8.742 CV     1
 OR {  871}
   (( segid "    " and resid 180  and name HA  ))
   (( segid "    " and resid 181  and name H   ))
 ASSI {  885}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 51   and name H   ))
      3.500     1.500     1.500 peak   885 spectrum    1 weight  0.10000E+01 volume  0.26166E-02 ppm1      0.732 ppm2      8.438 CV     1
 OR {  885}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 191  and name H   ))
 ASSI {  892}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 51   and name HA  ))
      2.300     0.600     0.600 peak   892 spectrum    1 weight  0.10000E+01 volume  0.50607E-02 ppm1      0.728 ppm2      4.413 CV     1
 OR {  892}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  901}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 71   and name HB3 ))
      3.800     1.800     1.800 peak   901 spectrum    1 weight  0.10000E+01 volume  0.29756E-02 ppm1      0.702 ppm2      3.172 CV     1
 OR {  901}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 91   and name HD3 ))
 ASSI {  909}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 111  and name HB3 ))
      4.100     2.100     1.900 peak   909 spectrum    1 weight  0.10000E+01 volume  0.81580E-03 ppm1      3.842 ppm2      2.025 CV     1
 OR {  909}
   (( segid "    " and resid 180  and name HA  ))
   (( segid "    " and resid 183  and name HB3 ))
 ASSI {  910}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HB3 ))
      2.800     1.000     1.000 peak   910 spectrum    1 weight  0.10000E+01 volume  0.25456E-02 ppm1      3.840 ppm2      1.760 CV     1
 OR {  910}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  911}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HB2 ))
      2.800     1.000     1.000 peak   911 spectrum    1 weight  0.10000E+01 volume  0.24880E-02 ppm1      3.841 ppm2      1.643 CV     1
 OR {  911}
   (( segid "    " and resid 180  and name HA  ))
   (( segid "    " and resid 180  and name HG  ))
 ASSI {  921}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 112  and name HG  ))
      1.800     0.400     0.400 peak   921 spectrum    1 weight  0.10000E+01 volume  0.26980E-01 ppm1      0.743 ppm2      1.494 CV     1
 OR {  921}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 49   and name HB2 ))
 OR {  921}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 51   and name HB3 ))
 ASSI {  922}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 51   and name HG  ))
      1.900     0.500     0.500 peak   922 spectrum    1 weight  0.10000E+01 volume  0.18676E-01 ppm1      0.728 ppm2      1.301 CV     1
 OR {  922}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 49   and name HB3 ))
 OR {  922}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 4    and name HB3 ))
 ASSI {  934}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 181  and name H   ))
      3.100     1.200     1.200 peak   934 spectrum    1 weight  0.10000E+01 volume  0.60187E-02 ppm1      1.205 ppm2      8.766 CV     1
 OR {  934}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 109  and name H   ))
 ASSI {  944}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 110  and name HA  ))
      3.100     1.200     1.200 peak   944 spectrum    1 weight  0.10000E+01 volume  0.52299E-02 ppm1      1.206 ppm2      4.381 CV     1
 OR {  944}
   (  segid "    " and resid 179  and name HG2%)
   (( segid "    " and resid 182  and name HA  ))
 ASSI {  965}
   (  segid "    " and resid 109  and name HG2%)
   (  segid "    " and resid 112  and name HD2%)
      3.900     1.900     1.900 peak   965 spectrum    1 weight  0.10000E+01 volume  0.20412E-02 ppm1      1.196 ppm2      0.636 CV     1
 OR {  965}
   (  segid "    " and resid 179  and name HG2%)
   (  segid "    " and resid 180  and name HD2%)
 ASSI {  977}
   (( segid "    " and resid 108  and name HB  ))
   (  segid "    " and resid 107  and name HG2%)
      4.500     2.500     1.500 peak   977 spectrum    1 weight  0.10000E+01 volume  0.17806E-02 ppm1      2.303 ppm2      1.199 CV     1
 OR {  977}
   (( segid "    " and resid 108  and name HB  ))
   (  segid "    " and resid 109  and name HG2%)
 ASSI {  986}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 109  and name H   ))
      3.400     1.500     1.500 peak   986 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      3.455 ppm2      8.756 CV     1
 OR {  986}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 112  and name H   ))
 ASSI {  990}
   (( segid "    " and resid 108  and name HB  ))
   (( segid "    " and resid 109  and name H   ))
      3.100     1.200     1.200 peak   990 spectrum    1 weight  0.10000E+01 volume  0.82595E-03 ppm1      2.312 ppm2      8.770 CV     1
 OR {  990}
   (( segid "    " and resid 108  and name HB  ))
   (( segid "    " and resid 177  and name H   ))
 ASSI {  993}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 177  and name H   ))
      3.500     1.500     1.500 peak   993 spectrum    1 weight  0.10000E+01 volume  0.25929E-02 ppm1      0.931 ppm2      8.763 CV     1
 OR {  993}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 109  and name H   ))
 ASSI { 1004}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 107  and name HA  ))
      3.700     1.700     1.700 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.27319E-02 ppm1      0.932 ppm2      3.799 CV     1
 OR { 1004}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 109  and name HA  ))
 ASSI { 1005}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 176  and name HB2 ))
      5.200     3.400     0.800 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      0.931 ppm2      3.042 CV     1
 OR { 1005}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 131  and name HD3 ))
 ASSI { 1006}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 92   and name HG3 ))
      3.600     1.600     1.600 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.16045E-02 ppm1      0.929 ppm2      2.572 CV     1
 OR { 1006}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 183  and name HG3 ))
 ASSI { 1014}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 109  and name H   ))
      3.800     1.800     1.800 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.25929E-02 ppm1      1.208 ppm2      8.768 CV     1
 OR { 1014}
   (  segid "    " and resid 107  and name HG2%)
   (( segid "    " and resid 177  and name H   ))
 ASSI { 1047}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 114  and name HB  ))
      3.700     1.700     1.700 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.13947E-02 ppm1      0.731 ppm2      4.245 CV     1
 OR { 1047}
   (  segid "    " and resid 102  and name HG2%)
   (( segid "    " and resid 100  and name HA  ))
 ASSI { 1064}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HG12))
      1.800     0.400     0.400 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.24823E-01 ppm1      0.635 ppm2      1.244 CV     1
 OR { 1064}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 90   and name HG13))
 OR { 1064}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 191  and name HB3 ))
 ASSI { 1065}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HG13))
      1.800     0.400     0.400 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.20619E-01 ppm1      0.634 ppm2      1.084 CV     1
 OR { 1065}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 90   and name HG12))
 ASSI { 1075}
   (( segid "    " and resid 100  and name HG12))
   (( segid "    " and resid 100  and name HB  ))
      2.500     0.800     0.800 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.34325E-02 ppm1      1.253 ppm2      1.588 CV     1
 OR { 1075}
   (( segid "    " and resid 100  and name HG12))
   (( segid "    " and resid 118  and name HG2 ))
 ASSI { 1092}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HA  ))
      3.200     1.300     1.300 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.61440E-02 ppm1      0.635 ppm2      4.272 CV     1
 OR { 1092}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 114  and name HB  ))
 ASSI { 1098}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 101  and name HA  ))
      3.200     1.300     1.300 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.32767E-02 ppm1      0.634 ppm2      4.904 CV     1
 OR { 1098}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 191  and name HA  ))
 ASSI { 1118}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name H   ))
      2.500     0.800     0.800 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.35713E-02 ppm1      4.935 ppm2      9.164 CV     1
 OR { 1118}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 100  and name H   ))
 ASSI { 1126}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 99   and name HA  ))
      2.300     0.700     0.700 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.95290E-02 ppm1      0.927 ppm2      4.948 CV     1
 OR { 1126}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 16   and name HA  ))
 ASSI { 1128}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 87   and name HA  ))
      2.600     0.900     0.900 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.58866E-02 ppm1      0.906 ppm2      4.631 CV     1
 OR { 1128}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 89   and name HA  ))
 ASSI { 1147}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 91   and name HG3 ))
      3.900     1.900     1.900 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.80905E-03 ppm1      4.857 ppm2      1.361 CV     1
 OR { 1147}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 91   and name HB2 ))
 OR { 1147}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 98   and name HG3 ))
 ASSI { 1161}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 97   and name HA  ))
      2.800     1.000     1.000 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.74406E-02 ppm1      0.821 ppm2      4.856 CV     1
 OR { 1161}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name HA  ))
 ASSI { 1166}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 97   and name H   ))
      2.500     0.800     0.800 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.46510E-02 ppm1      1.810 ppm2      8.399 CV     1
 OR { 1166}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 191  and name H   ))
 ASSI { 1196}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name H   ))
      2.200     0.600     0.600 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.61339E-02 ppm1      4.402 ppm2      8.138 CV     1
 OR { 1196}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 67   and name H   ))
 ASSI { 1223}
   (  segid "    " and resid 25   and name HG2%)
   (  segid "    " and resid 68   and name HD2%)
      2.100     0.600     0.600 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.11987E-01 ppm1      0.969 ppm2      0.292 CV     1
 OR { 1223}
   (  segid "    " and resid 93   and name HD2%)
   (  segid "    " and resid 121  and name HD1%)
 ASSI { 1226}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name HB3 ))
      2.500     0.800     0.800 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.44582E-02 ppm1      4.073 ppm2      1.618 CV     1
 OR { 1226}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HG2 ))
 ASSI { 1236}
   (( segid "    " and resid 66   and name HG3 ))
   (( segid "    " and resid 66   and name HB3 ))
      2.400     0.700     0.700 peak  1236 spectrum    1 weight  0.10000E+01 volume  0.59070E-02 ppm1      0.967 ppm2      1.522 CV     1
 OR { 1236}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
 OR { 1236}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 66   and name HB3 ))
 ASSI { 1238}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 174  and name HB2 ))
      3.600     1.700     1.700 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.14996E-02 ppm1      0.960 ppm2      1.267 CV     1
 OR { 1238}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 49   and name HB3 ))
 ASSI { 1248}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 92   and name HG3 ))
      3.600     1.600     1.600 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.16553E-02 ppm1      0.971 ppm2      2.608 CV     1
 OR { 1248}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 24   and name HG2 ))
 ASSI { 1253}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 63   and name HB2 ))
      3.800     1.800     1.800 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.26166E-02 ppm1      0.970 ppm2      1.913 CV     1
 OR { 1253}
   (  segid "    " and resid 93   and name HD2%)
   (  segid "    " and resid 92   and name HE% )
 ASSI { 1258}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 62   and name HA  ))
      3.000     1.200     1.200 peak  1258 spectrum    1 weight  0.10000E+01 volume  0.53958E-02 ppm1      0.976 ppm2      3.909 CV     1
 OR { 1258}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 1278}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 68   and name H   ))
      3.500     1.500     1.500 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.15775E-02 ppm1      0.975 ppm2      8.348 CV     1
 OR { 1278}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 68   and name H   ))
 ASSI { 1296}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 193  and name HA  ))
      3.300     1.300     1.300 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.23933E-02 ppm1      0.640 ppm2      4.874 CV     1
 OR { 1296}
   (  segid "    " and resid 90   and name HG2%)
   (( segid "    " and resid 97   and name HA  ))
 ASSI { 1308}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 15   and name HB2 ))
      1.900     0.400     0.400 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.12305E-01 ppm1      0.662 ppm2      1.478 CV     1
 OR { 1308}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HG13))
 ASSI { 1313}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 191  and name HB2 ))
      2.900     1.100     1.100 peak  1313 spectrum    1 weight  0.10000E+01 volume  0.15538E-02 ppm1      5.055 ppm2      1.652 CV     1
 OR { 1313}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HB  ))
 ASSI { 1363}
   (( segid "    " and resid 76   and name HA3 ))
   (( segid "    " and resid 75   and name HA  ))
      4.000     2.000     2.000 peak  1363 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      4.256 ppm2      4.720 CV     1
 OR { 1363}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI { 1369}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name H   ))
      2.600     0.800     0.800 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.19566E-02 ppm1      2.696 ppm2      7.537 CV     1
 OR { 1369}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 75   and name HD21))
 ASSI { 1392}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 0    and name HB  ))
      4.200     2.200     1.800 peak  1392 spectrum    1 weight  0.10000E+01 volume  0.17772E-02 ppm1      4.377 ppm2      4.092 CV     1
 OR { 1392}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 1393}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 68   and name HA  ))
      3.800     1.800     1.800 peak  1393 spectrum    1 weight  0.10000E+01 volume  0.11340E-02 ppm1      4.370 ppm2      3.920 CV     1
 OR { 1393}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 1410}
   (( segid "    " and resid 180  and name HB2 ))
   (  segid "    " and resid 180  and name HD1%)
      3.100     1.200     1.200 peak  1410 spectrum    1 weight  0.10000E+01 volume  0.16147E-02 ppm1      1.928 ppm2      0.726 CV     1
 OR { 1410}
   (( segid "    " and resid 180  and name HB2 ))
   (  segid "    " and resid 185  and name HG2%)
 ASSI { 1415}
   (  segid "    " and resid 68   and name HD1%)
   (  segid "    " and resid 6    and name HD1%)
      2.500     0.800     0.800 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.55584E-02 ppm1      0.327 ppm2      0.709 CV     1
 OR { 1415}
   (  segid "    " and resid 68   and name HD1%)
   (  segid "    " and resid 49   and name HD1%)
 ASSI { 1417}
   (  segid "    " and resid 68   and name HD2%)
   (  segid "    " and resid 25   and name HG2%)
      2.300     0.600     0.600 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.10792E-01 ppm1      0.295 ppm2      0.986 CV     1
 OR { 1417}
   (  segid "    " and resid 68   and name HD2%)
   (  segid "    " and resid 28   and name HB% )
 ASSI { 1433}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HG  ))
      2.900     1.000     1.000 peak  1433 spectrum    1 weight  0.10000E+01 volume  0.13168E-02 ppm1      1.929 ppm2      1.677 CV     1
 OR { 1433}
   (( segid "    " and resid 180  and name HB2 ))
   (( segid "    " and resid 180  and name HG  ))
 ASSI { 1463}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 67   and name H   ))
      2.200     0.600     0.600 peak  1463 spectrum    1 weight  0.10000E+01 volume  0.11357E-01 ppm1      1.394 ppm2      8.130 CV     1
 OR { 1463}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 69   and name H   ))
 ASSI { 1481}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 24   and name HG3 ))
      3.300     1.300     1.300 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.18923E-02 ppm1      1.393 ppm2      2.755 CV     1
 OR { 1481}
   (  segid "    " and resid 67   and name HB% )
   (( segid "    " and resid 69   and name HB2 ))
 ASSI { 1494}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HG2 ))
      3.400     1.400     1.400 peak  1494 spectrum    1 weight  0.10000E+01 volume  0.88351E-03 ppm1      4.872 ppm2      0.974 CV     1
 OR { 1494}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
 ASSI { 1502}
   (( segid "    " and resid 65   and name HA2 ))
   (  segid "    " and resid 64   and name HB% )
      4.000     2.000     2.000 peak  1502 spectrum    1 weight  0.10000E+01 volume  0.82257E-03 ppm1      3.594 ppm2      1.520 CV     1
 OR { 1502}
   (( segid "    " and resid 65   and name HA2 ))
   (( segid "    " and resid 66   and name HB3 ))
 ASSI { 1509}
   (  segid "    " and resid 64   and name HB% )
   (  segid "    " and resid 24   and name HE% )
      4.200     2.200     1.800 peak  1509 spectrum    1 weight  0.10000E+01 volume  0.24610E-02 ppm1      1.519 ppm2      2.040 CV     1
 OR { 1509}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 63   and name HB3 ))
 ASSI { 1520}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 26   and name HA  ))
      4.400     2.400     1.600 peak  1520 spectrum    1 weight  0.10000E+01 volume  0.76843E-03 ppm1      3.910 ppm2      4.380 CV     1
 OR { 1520}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HA3 ))
 ASSI { 1538}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 51   and name H   ))
      3.500     1.500     1.500 peak  1538 spectrum    1 weight  0.10000E+01 volume  0.37677E-02 ppm1     -0.161 ppm2      8.470 CV     1
 OR { 1538}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 63   and name H   ))
 ASSI { 1559}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 68   and name HA  ))
      3.100     1.200     1.200 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.48002E-02 ppm1      0.403 ppm2      3.888 CV     1
 OR { 1559}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 1571}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 49   and name HG  ))
      4.100     2.100     1.900 peak  1571 spectrum    1 weight  0.10000E+01 volume  0.21225E-02 ppm1      0.403 ppm2      1.786 CV     1
 OR { 1571}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 79   and name HB3 ))
 ASSI { 1572}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 79   and name HB2 ))
      4.100     2.100     1.900 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.15910E-02 ppm1      0.403 ppm2      1.695 CV     1
 OR { 1572}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 68   and name HG  ))
 ASSI { 1573}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 62   and name HB3 ))
      2.200     0.600     0.600 peak  1573 spectrum    1 weight  0.10000E+01 volume  0.11310E-01 ppm1      0.403 ppm2      1.478 CV     1
 OR { 1573}
   (  segid "    " and resid 62   and name HD1%)
   (  segid "    " and resid 79   and name HE% )
 ASSI { 1575}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 62   and name HB3 ))
      2.300     0.700     0.700 peak  1575 spectrum    1 weight  0.10000E+01 volume  0.86252E-02 ppm1     -0.161 ppm2      1.480 CV     1
 OR { 1575}
   (  segid "    " and resid 62   and name HD2%)
   (( segid "    " and resid 51   and name HB3 ))
 ASSI { 1583}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 51   and name HB2 ))
      2.300     0.600     0.600 peak  1583 spectrum    1 weight  0.10000E+01 volume  0.10859E-01 ppm1      0.402 ppm2      0.972 CV     1
 OR { 1583}
   (  segid "    " and resid 62   and name HD1%)
   (  segid "    " and resid 25   and name HG2%)
 ASSI { 1584}
   (  segid "    " and resid 62   and name HD1%)
   (  segid "    " and resid 49   and name HD1%)
      2.400     0.700     0.700 peak  1584 spectrum    1 weight  0.10000E+01 volume  0.19326E-01 ppm1      0.403 ppm2      0.750 CV     1
 OR { 1584}
   (  segid "    " and resid 62   and name HD1%)
   (  segid "    " and resid 51   and name HD1%)
 ASSI { 1585}
   (  segid "    " and resid 62   and name HD1%)
   (( segid "    " and resid 62   and name HG  ))
      2.000     0.500     0.500 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.12132E-01 ppm1      0.403 ppm2      0.684 CV     1
 OR { 1585}
   (  segid "    " and resid 62   and name HD1%)
   (  segid "    " and resid 49   and name HD1%)
 ASSI { 1586}
   (( segid "    " and resid 62   and name HB3 ))
   (  segid "    " and resid 49   and name HD1%)
      4.400     2.400     1.600 peak  1586 spectrum    1 weight  0.10000E+01 volume  0.90382E-03 ppm1      1.441 ppm2      0.750 CV     1
 OR { 1586}
   (( segid "    " and resid 62   and name HB3 ))
   (  segid "    " and resid 25   and name HG1%)
 ASSI { 1600}
   (( segid "    " and resid 180  and name HB3 ))
   (  segid "    " and resid 180  and name HD1%)
      2.800     1.000     1.000 peak  1600 spectrum    1 weight  0.10000E+01 volume  0.25050E-02 ppm1      1.173 ppm2      0.746 CV     1
 OR { 1600}
   (( segid "    " and resid 180  and name HB3 ))
   (  segid "    " and resid 185  and name HG2%)
 ASSI { 1606}
   (( segid "    " and resid 62   and name HG  ))
   (( segid "    " and resid 51   and name HB2 ))
      3.000     1.200     1.200 peak  1606 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      0.675 ppm2      0.973 CV     1
 OR { 1606}
   (( segid "    " and resid 62   and name HG  ))
   (  segid "    " and resid 25   and name HG2%)
 ASSI { 1611}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 62   and name H   ))
      4.400     2.400     1.600 peak  1611 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      1.545 ppm2      8.797 CV     1
 OR { 1611}
   (( segid "    " and resid 192  and name HB3 ))
   (( segid "    " and resid 130  and name H   ))
 ASSI { 1613}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 51   and name H   ))
      3.900     1.900     1.900 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.20988E-02 ppm1      0.833 ppm2      8.454 CV     1
 OR { 1613}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 61   and name H   ))
 ASSI { 1616}
   (( segid "    " and resid 60   and name HG13))
   (( segid "    " and resid 51   and name H   ))
      3.400     1.500     1.500 peak  1616 spectrum    1 weight  0.10000E+01 volume  0.14962E-02 ppm1      1.330 ppm2      8.454 CV     1
 OR { 1616}
   (( segid "    " and resid 60   and name HG13))
   (( segid "    " and resid 61   and name H   ))
 ASSI { 1620}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 134  and name H   ))
      2.000     0.500     0.500 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.45598E-02 ppm1      1.573 ppm2      8.198 CV     1
 OR { 1620}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name H   ))
 ASSI { 1624}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 71   and name HD% )
      2.800     1.000     1.000 peak  1624 spectrum    1 weight  0.10000E+01 volume  0.64960E-02 ppm1      0.834 ppm2      7.231 CV     1
 OR { 1624}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 60   and name H   ))
 ASSI { 1648}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HG13))
      2.500     0.800     0.800 peak  1648 spectrum    1 weight  0.10000E+01 volume  0.49557E-02 ppm1      1.562 ppm2      1.329 CV     1
 OR { 1648}
   (( segid "    " and resid 192  and name HB3 ))
   (( segid "    " and resid 192  and name HG  ))
 ASSI { 1649}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 15   and name HB3 ))
      3.700     1.700     1.700 peak  1649 spectrum    1 weight  0.10000E+01 volume  0.11645E-02 ppm1      0.904 ppm2      1.680 CV     1
 OR { 1649}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 35   and name HG2 ))
 OR { 1649}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 35   and name HG3 ))
 ASSI { 1673}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 55   and name H   ))
      3.600     1.600     1.600 peak  1673 spectrum    1 weight  0.10000E+01 volume  0.29009E-02 ppm1      2.458 ppm2      9.273 CV     1
 OR { 1673}
   (( segid "    " and resid 55   and name HB3 ))
   (( segid "    " and resid 55   and name H   ))
 ASSI { 1674}
   (( segid "    " and resid 55   and name HB3 ))
   (( segid "    " and resid 57   and name H   ))
      3.100     1.200     1.200 peak  1674 spectrum    1 weight  0.10000E+01 volume  0.15504E-02 ppm1      2.457 ppm2      8.147 CV     1
 OR { 1674}
   (( segid "    " and resid 77   and name HB3 ))
   (( segid "    " and resid 78   and name H   ))
 OR { 1674}
   (( segid "    " and resid 197  and name HB2 ))
   (( segid "    " and resid 198  and name H   ))
 ASSI { 1705}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name H   ))
      2.700     0.900     0.900 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.18381E-02 ppm1      5.436 ppm2      9.131 CV     1
 OR { 1705}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name H   ))
 ASSI { 1706}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name H   ))
      3.900     1.900     1.900 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.89366E-03 ppm1      1.291 ppm2      9.092 CV     1
 OR { 1706}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 50   and name H   ))
 ASSI { 1707}
   (( segid "    " and resid 191  and name HB3 ))
   (( segid "    " and resid 192  and name H   ))
      3.500     1.600     1.600 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.10663E-02 ppm1      1.256 ppm2      9.096 CV     1
 OR { 1707}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name H   ))
 OR { 1707}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 50   and name H   ))
 ASSI { 1708}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 62   and name H   ))
      4.400     2.400     1.600 peak  1708 spectrum    1 weight  0.10000E+01 volume  0.60254E-03 ppm1      1.287 ppm2      8.832 CV     1
 OR { 1708}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 1711}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name H   ))
      3.000     1.100     1.100 peak  1711 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      1.522 ppm2      9.092 CV     1
 OR { 1711}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name H   ))
 ASSI { 1717}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 60   and name H   ))
      3.900     1.900     1.900 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.28671E-02 ppm1      0.728 ppm2      7.230 CV     1
 OR { 1717}
   (  segid "    " and resid 51   and name HD2%)
   (  segid "    " and resid 71   and name HD% )
 ASSI { 1727}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 132  and name HB2 ))
      2.600     0.800     0.800 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.78398E-02 ppm1      0.696 ppm2      1.941 CV     1
 OR { 1727}
   (  segid "    " and resid 171  and name HD1%)
   (( segid "    " and resid 170  and name HB3 ))
 ASSI { 1731}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 49   and name HG  ))
      2.200     0.600     0.600 peak  1731 spectrum    1 weight  0.10000E+01 volume  0.82699E-02 ppm1      0.869 ppm2      1.780 CV     1
 OR { 1731}
   (  segid "    " and resid 49   and name HD2%)
   (( segid "    " and resid 79   and name HB3 ))
 ASSI { 1735}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HG  ))
      3.600     1.600     1.600 peak  1735 spectrum    1 weight  0.10000E+01 volume  0.82934E-03 ppm1      1.292 ppm2      1.781 CV     1
 OR { 1735}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 74   and name HB2 ))
 ASSI { 1737}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HB2 ))
      1.900     0.400     0.400 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.34292E-02 ppm1      1.287 ppm2      1.488 CV     1
 OR { 1737}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HG  ))
 ASSI { 1738}
   (( segid "    " and resid 4    and name HB3 ))
   (  segid "    " and resid 6    and name HD2%)
      2.400     0.700     0.700 peak  1738 spectrum    1 weight  0.10000E+01 volume  0.22375E-02 ppm1      1.290 ppm2      0.872 CV     1
 OR { 1738}
   (( segid "    " and resid 49   and name HB3 ))
   (  segid "    " and resid 49   and name HD2%)
 ASSI { 1739}
   (( segid "    " and resid 49   and name HB3 ))
   (  segid "    " and resid 49   and name HD1%)
      2.400     0.700     0.700 peak  1739 spectrum    1 weight  0.10000E+01 volume  0.64621E-02 ppm1      1.289 ppm2      0.712 CV     1
 OR { 1739}
   (( segid "    " and resid 4    and name HB3 ))
   (  segid "    " and resid 4    and name HD2%)
 OR { 1739}
   (( segid "    " and resid 4    and name HB3 ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 1742}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 49   and name HD1%)
      2.700     0.900     0.900 peak  1742 spectrum    1 weight  0.10000E+01 volume  0.22612E-02 ppm1      1.520 ppm2      0.742 CV     1
 OR { 1742}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 25   and name HG1%)
 ASSI { 1743}
   (( segid "    " and resid 4    and name HB2 ))
   (  segid "    " and resid 4    and name HD1%)
      2.600     0.800     0.800 peak  1743 spectrum    1 weight  0.10000E+01 volume  0.53620E-02 ppm1      1.582 ppm2      0.708 CV     1
 OR { 1743}
   (( segid "    " and resid 191  and name HB2 ))
   (  segid "    " and resid 191  and name HD2%)
 OR { 1743}
   (( segid "    " and resid 4    and name HB2 ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI { 1744}
   (  segid "    " and resid 49   and name HD2%)
   (  segid "    " and resid 49   and name HD1%)
      1.800     0.400     0.400 peak  1744 spectrum    1 weight  0.10000E+01 volume  0.29898E-01 ppm1      0.869 ppm2      0.739 CV     1
 OR { 1744}
   (  segid "    " and resid 49   and name HD2%)
   (  segid "    " and resid 8    and name HD1%)
 ASSI { 1767}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 43   and name HB3 ))
      4.000     2.000     2.000 peak  1767 spectrum    1 weight  0.10000E+01 volume  0.98169E-03 ppm1      2.772 ppm2      2.320 CV     1
 OR { 1767}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI { 1799}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 172  and name HD21))
      1.900     0.500     0.500 peak  1799 spectrum    1 weight  0.10000E+01 volume  0.59647E-02 ppm1      0.844 ppm2      7.369 CV     1
 OR { 1799}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name H   ))
 ASSI { 1803}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name H   ))
      2.300     0.700     0.700 peak  1803 spectrum    1 weight  0.10000E+01 volume  0.57512E-02 ppm1      4.218 ppm2      7.364 CV     1
 OR { 1803}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 41   and name H   ))
 ASSI { 1805}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 40   and name H   ))
      2.600     0.900     0.900 peak  1805 spectrum    1 weight  0.10000E+01 volume  0.67668E-02 ppm1      0.736 ppm2      7.367 CV     1
 OR { 1805}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 41   and name H   ))
 ASSI { 1806}
   (( segid "    " and resid 35   and name HG3 ))
   (( segid "    " and resid 36   and name H   ))
      2.800     1.000     1.000 peak  1806 spectrum    1 weight  0.10000E+01 volume  0.17839E-02 ppm1      1.638 ppm2      7.978 CV     1
 OR { 1806}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 36   and name H   ))
 OR { 1806}
   (( segid "    " and resid 181  and name HG3 ))
   (( segid "    " and resid 181  and name HE  ))
 ASSI { 1812}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 40   and name HA  ))
      2.400     0.700     0.700 peak  1812 spectrum    1 weight  0.10000E+01 volume  0.17000E-01 ppm1      0.736 ppm2      4.216 CV     1
 OR { 1812}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 41   and name HA  ))
 ASSI { 1824}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HB2 ))
      2.200     0.600     0.600 peak  1824 spectrum    1 weight  0.10000E+01 volume  0.14546E-01 ppm1      0.845 ppm2      1.692 CV     1
 OR { 1824}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 33   and name HB3 ))
 ASSI { 1831}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 39   and name HB% )
      3.200     1.300     1.300 peak  1831 spectrum    1 weight  0.10000E+01 volume  0.14793E-02 ppm1      0.845 ppm2      1.132 CV     1
 OR { 1831}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 33   and name HG2 ))
 ASSI { 1835}
   (( segid "    " and resid 73   and name HA  ))
   (  segid "    " and resid 73   and name HD2%)
      2.900     1.100     1.100 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.68751E-02 ppm1      4.217 ppm2      0.826 CV     1
 OR { 1835}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 1840}
   (  segid "    " and resid 39   and name HB% )
   (  segid "    " and resid 10   and name HD1%)
      2.300     0.700     0.700 peak  1840 spectrum    1 weight  0.10000E+01 volume  0.10981E-01 ppm1      1.108 ppm2      0.690 CV     1
 OR { 1840}
   (  segid "    " and resid 39   and name HB% )
   (  segid "    " and resid 32   and name HG2%)
 ASSI { 1846}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
      4.200     2.200     1.800 peak  1846 spectrum    1 weight  0.10000E+01 volume  0.70749E-03 ppm1      4.021 ppm2      1.833 CV     1
 OR { 1846}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 36   and name HB  ))
 ASSI { 1858}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 19   and name HA  ))
      3.800     1.800     1.800 peak  1858 spectrum    1 weight  0.10000E+01 volume  0.16215E-02 ppm1      1.105 ppm2      4.863 CV     1
 OR { 1858}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 5    and name HA  ))
 ASSI { 1869}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name H   ))
      2.900     1.100     1.100 peak  1869 spectrum    1 weight  0.10000E+01 volume  0.23899E-02 ppm1      4.023 ppm2      7.368 CV     1
 OR { 1869}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 41   and name H   ))
 ASSI { 1887}
   (( segid "    " and resid 182  and name HG3 ))
   (( segid "    " and resid 182  and name H   ))
      4.000     2.000     2.000 peak  1887 spectrum    1 weight  0.10000E+01 volume  0.15775E-02 ppm1      2.230 ppm2      8.006 CV     1
 OR { 1887}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 39   and name H   ))
 ASSI { 1888}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 41   and name H   ))
      3.500     1.500     1.500 peak  1888 spectrum    1 weight  0.10000E+01 volume  0.12694E-02 ppm1      3.927 ppm2      7.368 CV     1
 OR { 1888}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 40   and name H   ))
 ASSI { 1891}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 23   and name HB  ))
      2.400     0.700     0.700 peak  1891 spectrum    1 weight  0.10000E+01 volume  0.17264E-02 ppm1      1.912 ppm2      3.918 CV     1
 OR { 1891}
   (( segid "    " and resid 38   and name HB3 ))
   (( segid "    " and resid 38   and name HA  ))
 OR { 1891}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 23   and name HA  ))
 ASSI { 1914}
   (( segid "    " and resid 38   and name HG3 ))
   (  segid "    " and resid 13   and name HG1%)
      3.300     1.400     1.400 peak  1914 spectrum    1 weight  0.10000E+01 volume  0.19397E-02 ppm1      2.427 ppm2      0.910 CV     1
 OR { 1914}
   (( segid "    " and resid 38   and name HG3 ))
   (  segid "    " and resid 10   and name HG2%)
 ASSI { 1915}
   (( segid "    " and resid 38   and name HG3 ))
   (  segid "    " and resid 36   and name HG2%)
      3.600     1.600     1.600 peak  1915 spectrum    1 weight  0.10000E+01 volume  0.19634E-02 ppm1      2.430 ppm2      0.829 CV     1
 OR { 1915}
   (( segid "    " and resid 38   and name HG3 ))
   (  segid "    " and resid 10   and name HG2%)
 ASSI { 1916}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 10   and name HG2%)
      3.100     1.200     1.200 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.13473E-02 ppm1      1.795 ppm2      0.842 CV     1
 OR { 1916}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 1917}
   (( segid "    " and resid 38   and name HB3 ))
   (  segid "    " and resid 36   and name HG2%)
      3.500     1.500     1.500 peak  1917 spectrum    1 weight  0.10000E+01 volume  0.14996E-02 ppm1      1.924 ppm2      0.844 CV     1
 OR { 1917}
   (( segid "    " and resid 38   and name HB3 ))
   (  segid "    " and resid 10   and name HG2%)
 ASSI { 1918}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 10   and name HG2%)
      3.800     1.800     1.800 peak  1918 spectrum    1 weight  0.10000E+01 volume  0.17806E-02 ppm1      3.928 ppm2      0.840 CV     1
 OR { 1918}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 1919}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 10   and name HD1%)
      4.300     2.300     1.700 peak  1919 spectrum    1 weight  0.10000E+01 volume  0.68040E-03 ppm1      3.931 ppm2      0.695 CV     1
 OR { 1919}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI { 1943}
   (( segid "    " and resid 37   and name HD2 ))
   (( segid "    " and resid 37   and name HG3 ))
      2.500     0.800     0.800 peak  1943 spectrum    1 weight  0.10000E+01 volume  0.38998E-02 ppm1      3.750 ppm2      1.899 CV     1
 OR { 1943}
   (( segid "    " and resid 44   and name HD3 ))
   (( segid "    " and resid 44   and name HG3 ))
 OR { 1943}
   (( segid "    " and resid 37   and name HD3 ))
   (( segid "    " and resid 37   and name HG3 ))
 ASSI { 1949}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 37   and name HG2 ))
      1.700     0.400     0.500 peak  1949 spectrum    1 weight  0.10000E+01 volume  0.12620E-01 ppm1      1.895 ppm2      2.067 CV     1
 OR { 1949}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 44   and name HG2 ))
 ASSI { 1954}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HA  ))
      2.600     0.800     0.800 peak  1954 spectrum    1 weight  0.10000E+01 volume  0.45495E-02 ppm1      1.807 ppm2      4.149 CV     1
 OR { 1954}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI { 1959}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 37   and name HD2 ))
      2.400     0.700     0.700 peak  1959 spectrum    1 weight  0.10000E+01 volume  0.63539E-02 ppm1      1.902 ppm2      3.754 CV     1
 OR { 1959}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 44   and name HD2 ))
 OR { 1959}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 44   and name HD3 ))
 OR { 1959}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 37   and name HD3 ))
 ASSI { 1969}
   (( segid "    " and resid 37   and name HD3 ))
   (( segid "    " and resid 36   and name H   ))
      4.400     2.400     1.600 peak  1969 spectrum    1 weight  0.10000E+01 volume  0.57887E-03 ppm1      3.735 ppm2      7.975 CV     1
 OR { 1969}
   (( segid "    " and resid 37   and name HD2 ))
   (( segid "    " and resid 39   and name H   ))
 OR { 1969}
   (( segid "    " and resid 37   and name HD2 ))
   (( segid "    " and resid 36   and name H   ))
 OR { 1969}
   (( segid "    " and resid 37   and name HD3 ))
   (( segid "    " and resid 39   and name H   ))
 ASSI { 1970}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 58   and name H   ))
      4.700     2.800     1.300 peak  1970 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      2.027 ppm2      8.019 CV     1
 OR { 1970}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 39   and name H   ))
 ASSI { 1980}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 15   and name H   ))
      2.500     2.500     3.500 peak  1980 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      0.830 ppm2      8.897 CV     1
 OR { 1980}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 10   and name H   ))
 ASSI { 2022}
   (( segid "    " and resid 36   and name HB  ))
   (  segid "    " and resid 36   and name HD1%)
      2.700     0.900     0.900 peak  2022 spectrum    1 weight  0.10000E+01 volume  0.28198E-02 ppm1      1.864 ppm2      0.673 CV     1
 OR { 2022}
   (( segid "    " and resid 36   and name HB  ))
   (  segid "    " and resid 10   and name HD1%)
 ASSI { 2025}
   (  segid "    " and resid 36   and name HG2%)
   (  segid "    " and resid 36   and name HD1%)
      1.900     0.500     0.500 peak  2025 spectrum    1 weight  0.10000E+01 volume  0.18665E-01 ppm1      0.835 ppm2      0.673 CV     1
 OR { 2025}
   (  segid "    " and resid 36   and name HG2%)
   (  segid "    " and resid 10   and name HD1%)
 ASSI { 2034}
   (( segid "    " and resid 35   and name HD3 ))
   (( segid "    " and resid 35   and name HG3 ))
      2.000     0.500     0.500 peak  2034 spectrum    1 weight  0.10000E+01 volume  0.15612E-01 ppm1      3.119 ppm2      1.659 CV     1
 OR { 2034}
   (( segid "    " and resid 30   and name HD2 ))
   (( segid "    " and resid 30   and name HG3 ))
 OR { 2034}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name HG3 ))
 OR { 2034}
   (( segid "    " and resid 35   and name HD3 ))
   (  segid "    " and resid 17   and name HE% )
 ASSI { 2036}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HB3 ))
      1.800     0.400     0.400 peak  2036 spectrum    1 weight  0.10000E+01 volume  0.10805E-01 ppm1      1.888 ppm2      1.672 CV     1
 OR { 2036}
   (( segid "    " and resid 87   and name HB3 ))
   (( segid "    " and resid 87   and name HB2 ))
 OR { 2036}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HG3 ))
 ASSI { 2038}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HB2 ))
      2.200     0.600     0.600 peak  2038 spectrum    1 weight  0.10000E+01 volume  0.10132E-01 ppm1      1.638 ppm2      1.892 CV     1
 OR { 2038}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name HB3 ))
 OR { 2038}
   (( segid "    " and resid 35   and name HG3 ))
   (( segid "    " and resid 35   and name HB2 ))
 ASSI { 2046}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name HD3 ))
      2.500     0.800     0.800 peak  2046 spectrum    1 weight  0.10000E+01 volume  0.40248E-02 ppm1      1.658 ppm2      3.221 CV     1
 OR { 2046}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI { 2047}
   (( segid "    " and resid 118  and name HG2 ))
   (( segid "    " and resid 118  and name HD2 ))
      2.100     0.600     0.600 peak  2047 spectrum    1 weight  0.10000E+01 volume  0.94918E-02 ppm1      1.639 ppm2      3.148 CV     1
 OR { 2047}
   (( segid "    " and resid 35   and name HG3 ))
   (( segid "    " and resid 35   and name HD3 ))
 OR { 2047}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 74   and name HD2 ))
 OR { 2047}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name HD2 ))
 OR { 2047}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 74   and name HD3 ))
 OR { 2047}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HD3 ))
 ASSI { 2056}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name H   ))
      3.500     1.500     1.500 peak  2056 spectrum    1 weight  0.10000E+01 volume  0.21394E-02 ppm1      1.898 ppm2      7.480 CV     1
 OR { 2056}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 114  and name H   ))
 ASSI { 2070}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 19   and name HE% )
      3.400     1.400     1.400 peak  2070 spectrum    1 weight  0.10000E+01 volume  0.19769E-02 ppm1      0.738 ppm2      7.131 CV     1
 OR { 2070}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 30   and name H   ))
 ASSI { 2096}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 32   and name HB  ))
      2.400     0.700     0.700 peak  2096 spectrum    1 weight  0.10000E+01 volume  0.49929E-02 ppm1      0.112 ppm2      1.574 CV     1
 OR { 2096}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 10   and name HG13))
 ASSI { 2100}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 33   and name HB3 ))
      3.400     1.500     1.500 peak  2100 spectrum    1 weight  0.10000E+01 volume  0.38623E-02 ppm1      0.738 ppm2      1.682 CV     1
 OR { 2100}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 17   and name HE% )
 ASSI { 2105}
   (( segid "    " and resid 32   and name HG12))
   (  segid "    " and resid 32   and name HG2%)
      3.000     1.100     1.100 peak  2105 spectrum    1 weight  0.10000E+01 volume  0.18855E-02 ppm1      0.981 ppm2      0.734 CV     1
 OR { 2105}
   (( segid "    " and resid 32   and name HG13))
   (  segid "    " and resid 32   and name HG2%)
 OR { 2105}
   (( segid "    " and resid 32   and name HG13))
   (  segid "    " and resid 8    and name HG2%)
 OR { 2105}
   (( segid "    " and resid 32   and name HG12))
   (  segid "    " and resid 8    and name HG2%)
 ASSI { 2106}
   (( segid "    " and resid 132  and name HB2 ))
   (  segid "    " and resid 192  and name HD2%)
      3.200     1.200     1.200 peak  2106 spectrum    1 weight  0.10000E+01 volume  0.33276E-02 ppm1      1.934 ppm2      0.716 CV     1
 OR { 2106}
   (( segid "    " and resid 132  and name HB2 ))
   (  segid "    " and resid 192  and name HD1%)
 OR { 2106}
   (( segid "    " and resid 170  and name HB3 ))
   (  segid "    " and resid 171  and name HD1%)
 ASSI { 2109}
   (  segid "    " and resid 32   and name HD1%)
   (  segid "    " and resid 49   and name HD2%)
      3.100     1.200     1.200 peak  2109 spectrum    1 weight  0.10000E+01 volume  0.48169E-02 ppm1      0.113 ppm2      0.856 CV     1
 OR { 2109}
   (  segid "    " and resid 32   and name HD1%)
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 2110}
   (  segid "    " and resid 32   and name HD1%)
   (  segid "    " and resid 8    and name HG2%)
      1.900     0.400     0.400 peak  2110 spectrum    1 weight  0.10000E+01 volume  0.16245E-01 ppm1      0.111 ppm2      0.733 CV     1
 OR { 2110}
   (  segid "    " and resid 32   and name HD1%)
   (  segid "    " and resid 32   and name HG2%)
 ASSI { 2111}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 32   and name HG2%)
      2.800     1.000     1.000 peak  2111 spectrum    1 weight  0.10000E+01 volume  0.17772E-02 ppm1      1.572 ppm2      0.739 CV     1
 OR { 2111}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 8    and name HG2%)
 ASSI { 2124}
   (( segid "    " and resid 31   and name HG3 ))
   (( segid "    " and resid 31   and name H   ))
      2.600     0.900     0.900 peak  2124 spectrum    1 weight  0.10000E+01 volume  0.19058E-02 ppm1      2.519 ppm2      8.327 CV     1
 OR { 2124}
   (( segid "    " and resid 101  and name HG3 ))
   (( segid "    " and resid 101  and name H   ))
 ASSI { 2148}
   (( segid "    " and resid 29   and name HB3 ))
   (  segid "    " and resid 25   and name HG1%)
      4.400     2.400     1.600 peak  2148 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      3.226 ppm2      0.741 CV     1
 OR { 2148}
   (( segid "    " and resid 29   and name HB3 ))
   (  segid "    " and resid 32   and name HG2%)
 OR { 2148}
   (( segid "    " and resid 29   and name HB3 ))
   (  segid "    " and resid 49   and name HD1%)
 ASSI { 2149}
   (( segid "    " and resid 29   and name HB2 ))
   (  segid "    " and resid 49   and name HD1%)
      3.900     1.900     1.900 peak  2149 spectrum    1 weight  0.10000E+01 volume  0.67025E-03 ppm1      2.977 ppm2      0.751 CV     1
 OR { 2149}
   (( segid "    " and resid 29   and name HB2 ))
   (  segid "    " and resid 25   and name HG1%)
 OR { 2149}
   (( segid "    " and resid 29   and name HB2 ))
   (  segid "    " and resid 32   and name HG2%)
 ASSI { 2157}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 19   and name HB2 ))
      4.300     2.300     1.700 peak  2157 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      1.013 ppm2      2.324 CV     1
 OR { 2157}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 31   and name HB3 ))
 ASSI { 2160}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 31   and name HG2 ))
      4.600     2.700     1.400 peak  2160 spectrum    1 weight  0.10000E+01 volume  0.12051E-02 ppm1      1.011 ppm2      2.741 CV     1
 OR { 2160}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 25   and name HB  ))
 ASSI { 2161}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 19   and name HB3 ))
      3.800     1.800     1.800 peak  2161 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      1.015 ppm2      2.964 CV     1
 OR { 2161}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 29   and name HB2 ))
 ASSI { 2163}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 29   and name HA  ))
      3.300     1.300     1.300 peak  2163 spectrum    1 weight  0.10000E+01 volume  0.25861E-02 ppm1      1.013 ppm2      3.918 CV     1
 OR { 2163}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 23   and name HB  ))
 ASSI { 2195}
   (( segid "    " and resid 26   and name HB3 ))
   (  segid "    " and resid 64   and name HB% )
      2.600     0.800     0.800 peak  2195 spectrum    1 weight  0.10000E+01 volume  0.38861E-02 ppm1      3.188 ppm2      1.518 CV     1
 OR { 2195}
   (( segid "    " and resid 71   and name HB3 ))
   (( segid "    " and resid 73   and name HG  ))
 ASSI { 2198}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 28   and name HB% )
      4.600     2.700     1.400 peak  2198 spectrum    1 weight  0.10000E+01 volume  0.70072E-03 ppm1      4.379 ppm2      0.998 CV     1
 OR { 2198}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
 ASSI { 2199}
   (( segid "    " and resid 26   and name HB3 ))
   (  segid "    " and resid 25   and name HG1%)
      4.000     2.000     2.000 peak  2199 spectrum    1 weight  0.10000E+01 volume  0.10494E-02 ppm1      3.182 ppm2      0.751 CV     1
 OR { 2199}
   (( segid "    " and resid 71   and name HB3 ))
   (  segid "    " and resid 51   and name HD1%)
 OR { 2199}
   (( segid "    " and resid 71   and name HB3 ))
   (  segid "    " and resid 51   and name HD2%)
 ASSI { 2204}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 49   and name HD1%)
      2.500     0.800     0.800 peak  2204 spectrum    1 weight  0.10000E+01 volume  0.36457E-02 ppm1      3.286 ppm2      0.753 CV     1
 OR { 2204}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 25   and name HG1%)
 ASSI { 2219}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 66   and name H   ))
      3.300     1.400     1.400 peak  2219 spectrum    1 weight  0.10000E+01 volume  0.20581E-02 ppm1      0.979 ppm2      7.475 CV     1
 OR { 2219}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 66   and name H   ))
 ASSI { 2229}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 68   and name H   ))
      3.900     1.900     1.900 peak  2229 spectrum    1 weight  0.10000E+01 volume  0.10798E-02 ppm1      1.361 ppm2      8.348 CV     1
 OR { 2229}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 31   and name H   ))
 ASSI { 2250}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 19   and name HB2 ))
      4.100     2.100     1.900 peak  2250 spectrum    1 weight  0.10000E+01 volume  0.14421E-02 ppm1      1.366 ppm2      2.313 CV     1
 OR { 2250}
   (  segid "    " and resid 23   and name HG2%)
   (( segid "    " and resid 20   and name HG3 ))
 ASSI { 2291}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 21   and name HA  ))
      2.300     0.700     0.700 peak  2291 spectrum    1 weight  0.10000E+01 volume  0.68413E-02 ppm1      2.342 ppm2      4.080 CV     1
 OR { 2291}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HD2 ))
 ASSI { 2297}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HA  ))
      3.800     1.800     1.800 peak  2297 spectrum    1 weight  0.10000E+01 volume  0.25185E-02 ppm1      1.947 ppm2      4.097 CV     1
 OR { 2297}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 42   and name HA3 ))
 ASSI { 2306}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 72   and name HB3 ))
      2.400     0.700     0.700 peak  2306 spectrum    1 weight  0.10000E+01 volume  0.11489E-01 ppm1      2.276 ppm2      2.029 CV     1
 OR { 2306}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HG2 ))
 ASSI { 2307}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HG2 ))
      2.400     0.700     0.700 peak  2307 spectrum    1 weight  0.10000E+01 volume  0.27859E-02 ppm1      3.885 ppm2      2.135 CV     1
 OR { 2307}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 20   and name HB3 ))
 ASSI { 2308}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HG3 ))
      3.100     1.200     1.200 peak  2308 spectrum    1 weight  0.10000E+01 volume  0.20344E-02 ppm1      3.885 ppm2      1.936 CV     1
 OR { 2308}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 20   and name HB2 ))
 ASSI { 2310}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 20   and name HG2 ))
      3.700     1.700     1.700 peak  2310 spectrum    1 weight  0.10000E+01 volume  0.16282E-02 ppm1      3.876 ppm2      2.346 CV     1
 OR { 2310}
   (( segid "    " and resid 21   and name HD2 ))
   (( segid "    " and resid 21   and name HB3 ))
 ASSI { 2314}
   (( segid "    " and resid 21   and name HG3 ))
   (( segid "    " and resid 21   and name HB3 ))
      2.400     0.700     0.700 peak  2314 spectrum    1 weight  0.10000E+01 volume  0.55819E-02 ppm1      1.949 ppm2      2.333 CV     1
 OR { 2314}
   (( segid "    " and resid 43   and name HG3 ))
   (( segid "    " and resid 43   and name HB3 ))
 OR { 2314}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 43   and name HB3 ))
 ASSI { 2344}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name HG2 ))
      2.800     1.000     1.000 peak  2344 spectrum    1 weight  0.10000E+01 volume  0.25084E-02 ppm1      4.653 ppm2      1.916 CV     1
 OR { 2344}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HB2 ))
 ASSI { 2350}
   (( segid "    " and resid 38   and name HB3 ))
   (  segid "    " and resid 39   and name HB% )
      4.900     3.000     1.100 peak  2350 spectrum    1 weight  0.10000E+01 volume  0.74134E-03 ppm1      1.900 ppm2      1.107 CV     1
 OR { 2350}
   (( segid "    " and resid 20   and name HB2 ))
   (  segid "    " and resid 3    and name HB% )
 ASSI { 2370}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name H   ))
      2.600     0.800     0.800 peak  2370 spectrum    1 weight  0.10000E+01 volume  0.22579E-02 ppm1      4.880 ppm2      8.800 CV     1
 OR { 2370}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 2436}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 17   and name HG3 ))
      2.200     0.600     0.600 peak  2436 spectrum    1 weight  0.10000E+01 volume  0.17186E-01 ppm1      1.683 ppm2      2.061 CV     1
 OR { 2436}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 31   and name HE% )
 ASSI { 2441}
   (( segid "    " and resid 17   and name HB3 ))
   (  segid "    " and resid 17   and name HE% )
      2.600     0.900     0.900 peak  2441 spectrum    1 weight  0.10000E+01 volume  0.31989E-02 ppm1      1.481 ppm2      1.681 CV     1
 OR { 2441}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 8    and name HG13))
 OR { 2441}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 17   and name HE% )
 ASSI { 2469}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 14   and name HG1%)
      3.400     1.500     1.500 peak  2469 spectrum    1 weight  0.10000E+01 volume  0.27115E-02 ppm1      4.999 ppm2      0.780 CV     1
 OR { 2469}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 13   and name HG2%)
 ASSI { 2488}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 15   and name H   ))
      2.400     0.700     0.700 peak  2488 spectrum    1 weight  0.10000E+01 volume  0.39504E-02 ppm1      4.995 ppm2      8.894 CV     1
 OR { 2488}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 10   and name H   ))
 ASSI { 2538}
   (( segid "    " and resid 11   and name HA2 ))
   (  segid "    " and resid 10   and name HG2%)
      5.000     3.100     1.000 peak  2538 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      3.954 ppm2      0.913 CV     1
 OR { 2538}
   (( segid "    " and resid 11   and name HA2 ))
   (  segid "    " and resid 13   and name HG1%)
 ASSI { 2539}
   (( segid "    " and resid 11   and name HA3 ))
   (  segid "    " and resid 10   and name HG2%)
      4.000     2.000     2.000 peak  2539 spectrum    1 weight  0.10000E+01 volume  0.74134E-03 ppm1      3.680 ppm2      0.880 CV     1
 OR { 2539}
   (( segid "    " and resid 11   and name HA3 ))
   (  segid "    " and resid 13   and name HG1%)
 ASSI { 2542}
   (( segid "    " and resid 11   and name HA2 ))
   (( segid "    " and resid 10   and name HA  ))
      4.700     2.700     1.300 peak  2542 spectrum    1 weight  0.10000E+01 volume  0.99523E-03 ppm1      3.962 ppm2      4.629 CV     1
 OR { 2542}
   (( segid "    " and resid 11   and name HA2 ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI { 2543}
   (( segid "    " and resid 11   and name HA3 ))
   (( segid "    " and resid 10   and name HA  ))
      4.600     2.700     1.400 peak  2543 spectrum    1 weight  0.10000E+01 volume  0.85981E-03 ppm1      3.680 ppm2      4.629 CV     1
 OR { 2543}
   (( segid "    " and resid 11   and name HA3 ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI { 2568}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 41   and name H   ))
      4.100     2.100     1.900 peak  2568 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      0.878 ppm2      7.356 CV     1
 OR { 2568}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 40   and name H   ))
 ASSI { 2573}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 40   and name H   ))
      4.300     2.300     1.700 peak  2573 spectrum    1 weight  0.10000E+01 volume  0.12796E-02 ppm1      0.686 ppm2      7.376 CV     1
 OR { 2573}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 41   and name H   ))
 ASSI { 2594}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 13   and name HB  ))
      4.300     2.300     1.700 peak  2594 spectrum    1 weight  0.10000E+01 volume  0.11408E-02 ppm1      1.822 ppm2      2.189 CV     1
 OR { 2594}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 38   and name HG2 ))
 ASSI { 2599}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 81   and name HB2 ))
      3.600     1.600     1.600 peak  2599 spectrum    1 weight  0.10000E+01 volume  0.24440E-02 ppm1      0.686 ppm2      2.430 CV     1
 OR { 2599}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 38   and name HG3 ))
 ASSI { 2652}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 9    and name H   ))
      3.000     1.100     1.100 peak  2652 spectrum    1 weight  0.10000E+01 volume  0.32464E-02 ppm1      3.662 ppm2      8.869 CV     1
 OR { 2652}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 10   and name H   ))
 ASSI { 2654}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 10   and name H   ))
      2.500     0.800     0.800 peak  2654 spectrum    1 weight  0.10000E+01 volume  0.38251E-02 ppm1      5.298 ppm2      8.885 CV     1
 OR { 2654}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 15   and name H   ))
 ASSI { 2658}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 5    and name H   ))
      4.500     2.500     1.500 peak  2658 spectrum    1 weight  0.10000E+01 volume  0.14624E-02 ppm1      0.709 ppm2      8.673 CV     1
 OR { 2658}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 7    and name H   ))
 ASSI { 2659}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 6    and name H   ))
      2.900     1.100     1.100 peak  2659 spectrum    1 weight  0.10000E+01 volume  0.32160E-02 ppm1      0.884 ppm2      8.907 CV     1
 OR { 2659}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 74   and name H   ))
 ASSI { 2660}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 5    and name H   ))
      2.800     1.000     1.000 peak  2660 spectrum    1 weight  0.10000E+01 volume  0.43228E-02 ppm1      0.883 ppm2      8.670 CV     1
 OR { 2660}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 7    and name H   ))
 ASSI { 2667}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 5    and name HA  ))
      4.600     2.600     1.400 peak  2667 spectrum    1 weight  0.10000E+01 volume  0.12390E-02 ppm1      0.712 ppm2      4.894 CV     1
 OR { 2667}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 2678}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 6    and name HB2 ))
      2.600     0.800     0.800 peak  2678 spectrum    1 weight  0.10000E+01 volume  0.51250E-02 ppm1      0.709 ppm2      1.305 CV     1
 OR { 2678}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 4    and name HB3 ))
 ASSI { 2693}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 4    and name HB3 ))
      2.100     0.600     0.600 peak  2693 spectrum    1 weight  0.10000E+01 volume  0.73729E-02 ppm1      0.883 ppm2      1.309 CV     1
 OR { 2693}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 6    and name HB2 ))
 ASSI { 2698}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 83   and name HG3 ))
      3.700     1.700     1.700 peak  2698 spectrum    1 weight  0.10000E+01 volume  0.10595E-02 ppm1      4.884 ppm2      0.922 CV     1
 OR { 2698}
   (( segid "    " and resid 5    and name HA  ))
   (  segid "    " and resid 6    and name HD2%)
 ASSI { 2701}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HG12))
      3.600     1.600     1.600 peak  2701 spectrum    1 weight  0.10000E+01 volume  0.12423E-02 ppm1      4.892 ppm2      1.451 CV     1
 OR { 2701}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 2702}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 10   and name HG13))
      4.400     2.400     1.600 peak  2702 spectrum    1 weight  0.10000E+01 volume  0.12694E-02 ppm1      4.894 ppm2      1.566 CV     1
 OR { 2702}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
 OR { 2702}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 83   and name HB3 ))
 ASSI { 2708}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 83   and name HA  ))
      2.500     0.800     0.800 peak  2708 spectrum    1 weight  0.10000E+01 volume  0.25117E-02 ppm1      4.894 ppm2      3.560 CV     1
 OR { 2708}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 5    and name HB3 ))
 OR { 2708}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 5    and name HB2 ))
 ASSI { 2713}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 4    and name HA  ))
      3.700     1.700     1.700 peak  2713 spectrum    1 weight  0.10000E+01 volume  0.13337E-02 ppm1      4.890 ppm2      4.719 CV     1
 OR { 2713}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI { 2744}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 91   and name HD2 ))
      2.700     0.900     0.900 peak  2744 spectrum    1 weight  0.10000E+01 volume  0.51589E-02 ppm1      0.718 ppm2      2.984 CV     1
 OR { 2744}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 194  and name HD3 ))
 ASSI { 2751}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 192  and name HB3 ))
      2.100     0.600     0.600 peak  2751 spectrum    1 weight  0.10000E+01 volume  0.19024E-01 ppm1      0.714 ppm2      1.547 CV     1
 OR { 2751}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 2753}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 192  and name HG  ))
      1.800     0.400     0.400 peak  2753 spectrum    1 weight  0.10000E+01 volume  0.29301E-01 ppm1      0.719 ppm2      1.372 CV     1
 OR { 2753}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 193  and name HG  ))
 OR { 2753}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 192  and name HB2 ))
 ASSI { 2763}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
      4.000     2.000     2.000 peak  2763 spectrum    1 weight  0.10000E+01 volume  0.95460E-03 ppm1      4.279 ppm2      1.490 CV     1
 OR { 2763}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 4    and name HG  ))
 ASSI { 2768}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
      4.100     2.100     1.900 peak  2768 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      4.288 ppm2      1.582 CV     1
 OR { 2768}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI { 2771}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 2    and name HA  ))
      4.000     2.000     2.000 peak  2771 spectrum    1 weight  0.10000E+01 volume  0.11408E-02 ppm1      4.284 ppm2      4.107 CV     1
 OR { 2771}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 2815}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HB2 ))
      2.200     0.600     0.600 peak  2815 spectrum    1 weight  0.10000E+01 volume  0.13649E-01 ppm1      4.402 ppm2      2.036 CV     1
 OR { 2815}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 1    and name HB2 ))
 ASSI { 2816}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HB3 ))
      2.300     0.700     0.700 peak  2816 spectrum    1 weight  0.10000E+01 volume  0.10020E-01 ppm1      4.402 ppm2      1.960 CV     1
 OR { 2816}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 1    and name HB3 ))
 ASSI { 2819}
   (( segid "    " and resid 1    and name HB2 ))
   (( segid "    " and resid 1    and name HG3 ))
      2.800     1.000     1.000 peak  2819 spectrum    1 weight  0.10000E+01 volume  0.65366E-02 ppm1      2.043 ppm2      2.538 CV     1
 OR { 2819}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name HG3 ))
 ASSI { 2822}
   (( segid "    " and resid 1    and name HB2 ))
   (( segid "    " and resid 1    and name HG2 ))
      2.800     1.000     1.000 peak  2822 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      2.044 ppm2      2.446 CV     1
 OR { 2822}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name HG2 ))
 ASSI { 2826}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 1    and name H   ))
      2.400     0.700     0.700 peak  2826 spectrum    1 weight  0.10000E+01 volume  0.62422E-02 ppm1      4.401 ppm2      8.152 CV     1
 OR { 2826}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name H   ))
 ASSI { 2828}
   (( segid "    " and resid 1    and name HB2 ))
   (( segid "    " and resid 1    and name H   ))
      2.600     0.900     0.900 peak  2828 spectrum    1 weight  0.10000E+01 volume  0.41840E-02 ppm1      2.041 ppm2      8.156 CV     1
 OR { 2828}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name H   ))
 ASSI { 2834}
   (( segid "    " and resid 0    and name HA  ))
   (( segid "    " and resid 0    and name H   ))
      2.700     0.900     0.900 peak  2834 spectrum    1 weight  0.10000E+01 volume  0.45192E-02 ppm1      4.202 ppm2      8.046 CV     1
 OR { 2834}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name H   ))
 ASSI { 2876}
   (( segid "    " and resid 193  and name HA  ))
   (( segid "    " and resid 193  and name HG  ))
      3.100     1.200     1.200 peak  2876 spectrum    1 weight  0.10000E+01 volume  0.12965E-02 ppm1      4.873 ppm2      1.398 CV     1
 OR { 2876}
   (( segid "    " and resid 193  and name HA  ))
   (( segid "    " and resid 194  and name HG2 ))
 ASSI { 2879}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 47   and name HA  ))
      3.000     1.100     1.100 peak  2879 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      1.854 ppm2      4.856 CV     1
 OR { 2879}
   (( segid "    " and resid 193  and name HB3 ))
   (( segid "    " and resid 193  and name HA  ))
 ASSI { 2895}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 48   and name H   ))
      3.600     1.700     1.700 peak  2895 spectrum    1 weight  0.10000E+01 volume  0.95460E-03 ppm1      1.857 ppm2      8.601 CV     1
 OR { 2895}
   (( segid "    " and resid 193  and name HB3 ))
   (( segid "    " and resid 194  and name H   ))
 ASSI { 2905}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 170  and name HG2 ))
      2.400     0.700     0.700 peak  2905 spectrum    1 weight  0.10000E+01 volume  0.10226E-01 ppm1      1.801 ppm2      2.124 CV     1
 OR { 2905}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 170  and name HG3 ))
 OR { 2905}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HG3 ))
 ASSI { 2906}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HB2 ))
      1.600     0.300     0.600 peak  2906 spectrum    1 weight  0.10000E+01 volume  0.23784E-01 ppm1      1.801 ppm2      1.938 CV     1
 OR { 2906}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 170  and name HB3 ))
 ASSI { 2908}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HA  ))
      2.300     0.700     0.700 peak  2908 spectrum    1 weight  0.10000E+01 volume  0.74372E-02 ppm1      1.938 ppm2      4.209 CV     1
 OR { 2908}
   (( segid "    " and resid 170  and name HB3 ))
   (( segid "    " and resid 170  and name HA  ))
 ASSI { 2909}
   (( segid "    " and resid 189  and name HB2 ))
   (( segid "    " and resid 189  and name HA  ))
      3.500     1.600     1.600 peak  2909 spectrum    1 weight  0.10000E+01 volume  0.11983E-02 ppm1      1.797 ppm2      3.981 CV     1
 OR { 2909}
   (( segid "    " and resid 181  and name HB3 ))
   (( segid "    " and resid 181  and name HA  ))
 ASSI { 2915}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 102  and name H   ))
      4.500     2.500     1.500 peak  2915 spectrum    1 weight  0.10000E+01 volume  0.80905E-03 ppm1      1.876 ppm2      8.811 CV     1
 OR { 2915}
   (( segid "    " and resid 189  and name HB3 ))
   (( segid "    " and resid 186  and name H   ))
 ASSI { 2920}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 28   and name H   ))
      3.100     1.200     1.200 peak  2920 spectrum    1 weight  0.10000E+01 volume  0.17061E-02 ppm1      2.610 ppm2      8.612 CV     1
 OR { 2920}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 105  and name H   ))
 OR { 2920}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 28   and name H   ))
 ASSI { 2924}
   (( segid "    " and resid 188  and name HB3 ))
   (( segid "    " and resid 188  and name H   ))
      4.200     2.200     1.800 peak  2924 spectrum    1 weight  0.10000E+01 volume  0.75489E-03 ppm1      2.974 ppm2      7.589 CV     1
 OR { 2924}
   (( segid "    " and resid 173  and name HB2 ))
   (( segid "    " and resid 173  and name HE3 ))
 ASSI { 2935}
   (( segid "    " and resid 15   and name HE2 ))
   (( segid "    " and resid 15   and name HG2 ))
      2.400     0.700     0.700 peak  2935 spectrum    1 weight  0.10000E+01 volume  0.99996E-02 ppm1      2.806 ppm2      1.320 CV     1
 OR { 2935}
   (( segid "    " and resid 15   and name HE3 ))
   (( segid "    " and resid 15   and name HG2 ))
 OR { 2935}
   (( segid "    " and resid 89   and name HE2 ))
   (( segid "    " and resid 89   and name HG3 ))
 OR { 2935}
   (( segid "    " and resid 89   and name HE3 ))
   (( segid "    " and resid 89   and name HG3 ))
 ASSI { 2936}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 7    and name HD3 ))
      1.800     0.400     0.400 peak  2936 spectrum    1 weight  0.10000E+01 volume  0.33656E-01 ppm1      2.800 ppm2      1.461 CV     1
 OR { 2936}
   (( segid "    " and resid 83   and name HE2 ))
   (( segid "    " and resid 83   and name HD3 ))
 OR { 2936}
   (( segid "    " and resid 89   and name HE3 ))
   (( segid "    " and resid 89   and name HD2 ))
 OR { 2936}
   (( segid "    " and resid 89   and name HE2 ))
   (( segid "    " and resid 89   and name HD3 ))
 OR { 2936}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 7    and name HD2 ))
 OR { 2936}
   (( segid "    " and resid 89   and name HE2 ))
   (( segid "    " and resid 89   and name HD2 ))
 OR { 2936}
   (( segid "    " and resid 89   and name HE3 ))
   (( segid "    " and resid 89   and name HD3 ))
 OR { 2936}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 7    and name HD2 ))
 OR { 2936}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 7    and name HD3 ))
 OR { 2936}
   (( segid "    " and resid 83   and name HE2 ))
   (( segid "    " and resid 83   and name HD2 ))
 ASSI { 2938}
   (( segid "    " and resid 15   and name HE2 ))
   (  segid "    " and resid 13   and name HG2%)
      2.300     0.700     0.700 peak  2938 spectrum    1 weight  0.10000E+01 volume  0.96070E-02 ppm1      2.803 ppm2      0.820 CV     1
 OR { 2938}
   (( segid "    " and resid 15   and name HE3 ))
   (  segid "    " and resid 13   and name HG2%)
 OR { 2938}
   (( segid "    " and resid 15   and name HE3 ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 2939}
   (( segid "    " and resid 15   and name HE3 ))
   (( segid "    " and resid 15   and name HG3 ))
      2.300     0.700     0.700 peak  2939 spectrum    1 weight  0.10000E+01 volume  0.90010E-02 ppm1      2.800 ppm2      1.206 CV     1
 OR { 2939}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 7    and name HG2 ))
 OR { 2939}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 7    and name HG2 ))
 OR { 2939}
   (( segid "    " and resid 15   and name HE2 ))
   (( segid "    " and resid 15   and name HG3 ))
 ASSI { 2960}
   (( segid "    " and resid 111  and name HG2 ))
   (  segid "    " and resid 102  and name HG1%)
      3.100     1.200     1.200 peak  2960 spectrum    1 weight  0.10000E+01 volume  0.24677E-02 ppm1      2.567 ppm2      0.737 CV     1
 OR { 2960}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 115  and name HG13))
 OR { 2960}
   (( segid "    " and resid 111  and name HG2 ))
   (  segid "    " and resid 102  and name HG2%)
 ASSI { 2988}
   (( segid "    " and resid 81   and name HB2 ))
   (  segid "    " and resid 8    and name HG2%)
      3.100     1.200     1.200 peak  2988 spectrum    1 weight  0.10000E+01 volume  0.13845E-02 ppm1      2.448 ppm2      0.733 CV     1
 OR { 2988}
   (( segid "    " and resid 81   and name HB2 ))
   (  segid "    " and resid 8    and name HD1%)
 OR { 2988}
   (( segid "    " and resid 81   and name HB2 ))
   (  segid "    " and resid 10   and name HD1%)
 ASSI { 2989}
   (( segid "    " and resid 81   and name HB3 ))
   (  segid "    " and resid 10   and name HG2%)
      4.100     2.100     1.900 peak  2989 spectrum    1 weight  0.10000E+01 volume  0.11069E-02 ppm1      3.108 ppm2      0.872 CV     1
 OR { 2989}
   (( segid "    " and resid 81   and name HB3 ))
   (  segid "    " and resid 49   and name HD2%)
 ASSI { 2994}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name H   ))
      3.400     1.400     1.400 peak  2994 spectrum    1 weight  0.10000E+01 volume  0.10765E-02 ppm1      4.884 ppm2      8.458 CV     1
 OR { 2994}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 51   and name H   ))
 ASSI { 3013}
   (( segid "    " and resid 178  and name HA  ))
   (  segid "    " and resid 108  and name HG2%)
      3.700     1.800     1.800 peak  3013 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      4.888 ppm2      0.886 CV     1
 OR { 3013}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 49   and name HD2%)
 ASSI { 3018}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HB3 ))
      2.500     0.800     0.800 peak  3018 spectrum    1 weight  0.10000E+01 volume  0.31718E-02 ppm1      4.876 ppm2      1.526 CV     1
 OR { 3018}
   (( segid "    " and resid 178  and name HA  ))
   (( segid "    " and resid 178  and name HG3 ))
 ASSI { 3019}
   (( segid "    " and resid 101  and name HA  ))
   (  segid "    " and resid 101  and name HE% )
      2.500     0.800     0.800 peak  3019 spectrum    1 weight  0.10000E+01 volume  0.25795E-02 ppm1      4.893 ppm2      1.715 CV     1
 OR { 3019}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI { 3035}
   (( segid "    " and resid 79   and name HG3 ))
   (  segid "    " and resid 73   and name HD1%)
      2.900     1.000     1.000 peak  3035 spectrum    1 weight  0.10000E+01 volume  0.31413E-02 ppm1      2.149 ppm2      0.866 CV     1
 OR { 3035}
   (( segid "    " and resid 79   and name HG2 ))
   (  segid "    " and resid 49   and name HD2%)
 OR { 3035}
   (( segid "    " and resid 79   and name HG3 ))
   (  segid "    " and resid 49   and name HD2%)
 ASSI { 3039}
   (( segid "    " and resid 178  and name HA  ))
   (( segid "    " and resid 178  and name HB3 ))
      3.400     1.400     1.400 peak  3039 spectrum    1 weight  0.10000E+01 volume  0.19363E-02 ppm1      4.889 ppm2      1.978 CV     1
 OR { 3039}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI { 3042}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 79   and name HA  ))
      3.100     1.200     1.200 peak  3042 spectrum    1 weight  0.10000E+01 volume  0.14793E-02 ppm1      1.824 ppm2      4.898 CV     1
 OR { 3042}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 8    and name HA  ))
 ASSI { 3043}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
      3.100     1.200     1.200 peak  3043 spectrum    1 weight  0.10000E+01 volume  0.12999E-02 ppm1      1.711 ppm2      4.895 CV     1
 OR { 3043}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 8    and name HA  ))
 ASSI { 3054}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name H   ))
      3.100     1.200     1.200 peak  3054 spectrum    1 weight  0.10000E+01 volume  0.11645E-02 ppm1      4.899 ppm2      9.049 CV     1
 OR { 3054}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 88   and name H   ))
 ASSI { 3056}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 6    and name H   ))
      2.400     2.400     3.600 peak  3056 spectrum    1 weight  0.10000E+01 volume  0.14217E-02 ppm1      1.473 ppm2      8.871 CV     1
 OR { 3056}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 19   and name H   ))
 ASSI { 3057}
   (( segid "    " and resid 1    and name HG3 ))
   (( segid "    " and resid 1    and name HB2 ))
      2.400     0.700     0.700 peak  3057 spectrum    1 weight  0.10000E+01 volume  0.11570E-01 ppm1      2.540 ppm2      2.035 CV     1
 OR { 3057}
   (( segid "    " and resid 134  and name HG3 ))
   (  segid "    " and resid 134  and name HE% )
 OR { 3057}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HB2 ))
 ASSI { 3059}
   (( segid "    " and resid 134  and name HG3 ))
   (  segid "    " and resid 134  and name HE% )
      2.300     0.600     0.600 peak  3059 spectrum    1 weight  0.10000E+01 volume  0.92685E-02 ppm1      2.537 ppm2      1.958 CV     1
 OR { 3059}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HB3 ))
 OR { 3059}
   (( segid "    " and resid 1    and name HG3 ))
   (( segid "    " and resid 1    and name HB3 ))
 ASSI { 3061}
   (( segid "    " and resid 101  and name HG2 ))
   (( segid "    " and resid 101  and name HB3 ))
      3.500     1.600     1.600 peak  3061 spectrum    1 weight  0.10000E+01 volume  0.17636E-02 ppm1      2.435 ppm2      1.571 CV     1
 OR { 3061}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 133  and name HB2 ))
 ASSI { 3069}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 135  and name HA  ))
      3.800     1.800     1.800 peak  3069 spectrum    1 weight  0.10000E+01 volume  0.11814E-02 ppm1      2.537 ppm2      4.133 CV     1
 OR { 3069}
   (( segid "    " and resid 1    and name HG3 ))
   (( segid "    " and resid 0    and name HB  ))
 ASSI { 3099}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 31   and name HB2 ))
      2.900     1.100     1.100 peak  3099 spectrum    1 weight  0.10000E+01 volume  0.32666E-02 ppm1      2.726 ppm2      2.023 CV     1
 OR { 3099}
   (( segid "    " and resid 31   and name HG2 ))
   (  segid "    " and resid 31   and name HE% )
 OR { 3099}
   (( segid "    " and resid 24   and name HG3 ))
   (  segid "    " and resid 24   and name HE% )
 ASSI { 3101}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 111  and name HB3 ))
      2.800     1.000     1.000 peak  3101 spectrum    1 weight  0.10000E+01 volume  0.21225E-02 ppm1      2.598 ppm2      2.023 CV     1
 OR { 3101}
   (( segid "    " and resid 24   and name HG2 ))
   (  segid "    " and resid 24   and name HE% )
 ASSI { 3102}
   (( segid "    " and resid 24   and name HG3 ))
   (  segid "    " and resid 67   and name HB% )
      3.700     1.700     1.700 peak  3102 spectrum    1 weight  0.10000E+01 volume  0.10866E-02 ppm1      2.732 ppm2      1.375 CV     1
 OR { 3102}
   (( segid "    " and resid 24   and name HG3 ))
   (  segid "    " and resid 23   and name HG2%)
 ASSI { 3107}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HD21))
      2.900     1.100     1.100 peak  3107 spectrum    1 weight  0.10000E+01 volume  0.25050E-02 ppm1      2.792 ppm2      7.697 CV     1
 OR { 3107}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 124  and name H   ))
 ASSI { 3134}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name HD2 ))
      2.100     0.500     0.500 peak  3134 spectrum    1 weight  0.10000E+01 volume  0.21475E-01 ppm1      4.799 ppm2      3.676 CV     1
 OR { 3134}
   (( segid "    " and resid -3   and name HA  ))
   (( segid "    " and resid -2   and name HD2 ))
 ASSI { 3137}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 111  and name H   ))
      3.100     1.200     1.200 peak  3137 spectrum    1 weight  0.10000E+01 volume  0.37339E-02 ppm1      2.671 ppm2      8.376 CV     1
 OR { 3137}
   (( segid "    " and resid -3   and name HB3 ))
   (( segid "    " and resid -3   and name H   ))
 OR { 3137}
   (( segid "    " and resid 169  and name HB3 ))
   (( segid "    " and resid 169  and name H   ))
 ASSI { 3141}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 85   and name H   ))
      3.000     1.100     1.100 peak  3141 spectrum    1 weight  0.10000E+01 volume  0.22511E-02 ppm1      3.697 ppm2      7.143 CV     1
 OR { 3141}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 61   and name HZ2 ))
 ASSI { 3147}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 105  and name H   ))
      3.700     1.700     1.700 peak  3147 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      1.044 ppm2      8.599 CV     1
 OR { 3147}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 105  and name H   ))
 OR { 3147}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 48   and name H   ))
 OR { 3147}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 48   and name H   ))
 ASSI { 3179}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 84   and name HA  ))
      4.500     2.500     1.500 peak  3179 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      2.334 ppm2      3.704 CV     1
 OR { 3179}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 105  and name HB2 ))
 ASSI { 3187}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 104  and name HB3 ))
      3.800     1.800     1.800 peak  3187 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      3.690 ppm2      2.442 CV     1
 OR { 3187}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 105  and name HB3 ))
 ASSI { 3222}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 131  and name HE  ))
      3.500     1.500     1.500 peak  3222 spectrum    1 weight  0.10000E+01 volume  0.32565E-02 ppm1      0.792 ppm2      9.028 CV     1
 OR { 3222}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 88   and name H   ))
 ASSI { 3223}
   (( segid "    " and resid 62   and name HG  ))
   (( segid "    " and resid 51   and name H   ))
      3.400     1.400     1.400 peak  3223 spectrum    1 weight  0.10000E+01 volume  0.14150E-02 ppm1      0.686 ppm2      8.464 CV     1
 OR { 3223}
   (  segid "    " and resid 88   and name HD1%)
   (( segid "    " and resid 89   and name H   ))
 ASSI { 3226}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 134  and name H   ))
      3.300     1.300     1.300 peak  3226 spectrum    1 weight  0.10000E+01 volume  0.71731E-02 ppm1      0.788 ppm2      8.194 CV     1
 OR { 3226}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 133  and name H   ))
 ASSI { 3235}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      3.700     1.800     1.800 peak  3235 spectrum    1 weight  0.10000E+01 volume  0.59238E-03 ppm1      1.842 ppm2      4.627 CV     1
 OR { 3235}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI { 3260}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 88   and name HG  ))
      2.200     0.600     0.600 peak  3260 spectrum    1 weight  0.10000E+01 volume  0.13554E-01 ppm1      0.795 ppm2      1.297 CV     1
 OR { 3260}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name HB3 ))
 ASSI { 3262}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 68   and name HB3 ))
      2.200     0.600     0.600 peak  3262 spectrum    1 weight  0.10000E+01 volume  0.63166E-02 ppm1      0.795 ppm2      1.095 CV     1
 OR { 3262}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 88   and name HB3 ))
 ASSI { 3272}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 74   and name HA  ))
      4.700     2.700     1.300 peak  3272 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      2.616 ppm2      4.446 CV     1
 OR { 3272}
   (( segid "    " and resid 172  and name HB3 ))
   (( segid "    " and resid 131  and name HA  ))
 ASSI { 3308}
   (( segid "    " and resid 189  and name HG2 ))
   (( segid "    " and resid 189  and name HA  ))
      3.600     1.600     1.600 peak  3308 spectrum    1 weight  0.10000E+01 volume  0.12085E-02 ppm1      1.849 ppm2      3.990 CV     1
 OR { 3308}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 39   and name HA  ))
 ASSI { 3324}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
      2.700     0.900     0.900 peak  3324 spectrum    1 weight  0.10000E+01 volume  0.38284E-02 ppm1      3.830 ppm2      2.062 CV     1
 OR { 3324}
   (( segid "    " and resid 187  and name HA  ))
   (( segid "    " and resid 187  and name HG2 ))
 ASSI { 3325}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB3 ))
      2.500     0.800     0.800 peak  3325 spectrum    1 weight  0.10000E+01 volume  0.64453E-02 ppm1      3.830 ppm2      1.904 CV     1
 OR { 3325}
   (( segid "    " and resid 187  and name HA  ))
   (( segid "    " and resid 187  and name HB3 ))
 OR { 3325}
   (( segid "    " and resid 187  and name HA  ))
   (( segid "    " and resid 187  and name HB2 ))
 ASSI { 3339}
   (( segid "    " and resid 58   and name HB3 ))
   (( segid "    " and resid 54   and name H   ))
      4.200     2.200     1.800 peak  3339 spectrum    1 weight  0.10000E+01 volume  0.11306E-02 ppm1      1.918 ppm2      8.274 CV     1
 OR { 3339}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 135  and name H   ))
 ASSI { 3342}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 75   and name H   ))
      2.400     0.700     0.700 peak  3342 spectrum    1 weight  0.10000E+01 volume  0.20006E-02 ppm1      1.703 ppm2      8.333 CV     1
 OR { 3342}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 169  and name H   ))
 ASSI { 3345}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name H   ))
      3.800     1.800     1.800 peak  3345 spectrum    1 weight  0.10000E+01 volume  0.26404E-02 ppm1      1.595 ppm2      8.106 CV     1
 OR { 3345}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 138  and name H   ))
 OR { 3345}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name H   ))
 OR { 3345}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 138  and name H   ))
 OR { 3345}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 138  and name H   ))
 ASSI { 3366}
   (( segid "    " and resid 58   and name HB3 ))
   (( segid "    " and resid 55   and name HB2 ))
      4.500     2.500     1.500 peak  3366 spectrum    1 weight  0.10000E+01 volume  0.11509E-02 ppm1      1.905 ppm2      2.916 CV     1
 OR { 3366}
   (( segid "    " and resid 58   and name HB3 ))
   (( segid "    " and resid 58   and name HE2 ))
 OR { 3366}
   (( segid "    " and resid 58   and name HB3 ))
   (( segid "    " and resid 58   and name HE3 ))
 ASSI { 3391}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HG2 ))
      1.800     0.400     0.400 peak  3391 spectrum    1 weight  0.10000E+01 volume  0.34568E-01 ppm1      1.592 ppm2      1.331 CV     1
 OR { 3391}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HG3 ))
 OR { 3391}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 138  and name HG3 ))
 OR { 3391}
   (( segid "    " and resid 138  and name HD3 ))
   (( segid "    " and resid 138  and name HG2 ))
 OR { 3391}
   (( segid "    " and resid 138  and name HD3 ))
   (( segid "    " and resid 138  and name HG3 ))
 OR { 3391}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 138  and name HG2 ))
 OR { 3391}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR { 3391}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HG3 ))
 ASSI { 3403}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 104  and name H   ))
      3.200     1.300     1.300 peak  3403 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      2.598 ppm2      8.406 CV     1
 OR { 3403}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 111  and name H   ))
 ASSI { 3433}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 65   and name H   ))
      3.800     1.800     1.800 peak  3433 spectrum    1 weight  0.10000E+01 volume  0.13270E-02 ppm1      0.862 ppm2      8.144 CV     1
 OR { 3433}
   (( segid "    " and resid 66   and name HD3 ))
   (( segid "    " and resid 67   and name H   ))
 ASSI { 3449}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 66   and name HE3 ))
      2.200     0.600     0.600 peak  3449 spectrum    1 weight  0.10000E+01 volume  0.47730E-02 ppm1      0.499 ppm2      2.246 CV     1
 OR { 3449}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 66   and name HE2 ))
 OR { 3449}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 63   and name HG3 ))
 ASSI { 3450}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 66   and name HB2 ))
      4.000     2.000     2.000 peak  3450 spectrum    1 weight  0.10000E+01 volume  0.11340E-02 ppm1      0.504 ppm2      2.051 CV     1
 OR { 3450}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 63   and name HB3 ))
 ASSI { 3454}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
      2.700     0.900     0.900 peak  3454 spectrum    1 weight  0.10000E+01 volume  0.21191E-02 ppm1      4.393 ppm2      2.030 CV     1
 OR { 3454}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 24   and name HE% )
 ASSI { 3455}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 63   and name HG3 ))
      4.200     2.200     1.800 peak  3455 spectrum    1 weight  0.10000E+01 volume  0.11746E-02 ppm1      4.390 ppm2      2.249 CV     1
 OR { 3455}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HE3 ))
 ASSI { 3462}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 66   and name HG3 ))
      2.300     0.700     0.700 peak  3462 spectrum    1 weight  0.10000E+01 volume  0.32160E-02 ppm1      0.500 ppm2      0.997 CV     1
 OR { 3462}
   (( segid "    " and resid 66   and name HD2 ))
   (( segid "    " and resid 66   and name HG2 ))
 OR { 3462}
   (( segid "    " and resid 66   and name HD2 ))
   (  segid "    " and resid 25   and name HG2%)
 ASSI { 3467}
   (  segid "    " and resid 25   and name HG2%)
   (  segid "    " and resid 49   and name HD1%)
      1.900     0.400     0.400 peak  3467 spectrum    1 weight  0.10000E+01 volume  0.16306E-01 ppm1      0.978 ppm2      0.755 CV     1
 OR { 3467}
   (  segid "    " and resid 25   and name HG2%)
   (  segid "    " and resid 25   and name HG1%)
 ASSI { 3469}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name H   ))
      3.200     1.300     1.300 peak  3469 spectrum    1 weight  0.10000E+01 volume  0.95799E-03 ppm1      4.923 ppm2      9.039 CV     1
 OR { 3469}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 79   and name H   ))
 ASSI { 3470}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 15   and name H   ))
      3.500     1.500     1.500 peak  3470 spectrum    1 weight  0.10000E+01 volume  0.70749E-03 ppm1      2.079 ppm2      8.885 CV     1
 OR { 3470}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 9    and name H   ))
 ASSI { 3471}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 17   and name H   ))
      3.800     1.800     1.800 peak  3471 spectrum    1 weight  0.10000E+01 volume  0.16756E-02 ppm1      0.715 ppm2      9.142 CV     1
 OR { 3471}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 80   and name H   ))
 ASSI { 3472}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 79   and name H   ))
      3.000     1.100     1.100 peak  3472 spectrum    1 weight  0.10000E+01 volume  0.38016E-02 ppm1      0.719 ppm2      9.043 CV     1
 OR { 3472}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 8    and name H   ))
 ASSI { 3479}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 81   and name HA  ))
      4.500     2.600     1.500 peak  3479 spectrum    1 weight  0.10000E+01 volume  0.82595E-03 ppm1      0.717 ppm2      5.427 CV     1
 OR { 3479}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 3485}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 8    and name HB  ))
      3.200     1.300     1.300 peak  3485 spectrum    1 weight  0.10000E+01 volume  0.47764E-02 ppm1      0.718 ppm2      2.126 CV     1
 OR { 3485}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 79   and name HG3 ))
 ASSI { 3488}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 8    and name HG13))
      2.100     0.600     0.600 peak  3488 spectrum    1 weight  0.10000E+01 volume  0.94951E-02 ppm1      0.718 ppm2      1.678 CV     1
 OR { 3488}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 79   and name HB2 ))
 ASSI { 3490}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 32   and name HG13))
      3.700     1.700     1.700 peak  3490 spectrum    1 weight  0.10000E+01 volume  0.28402E-02 ppm1      0.718 ppm2      1.000 CV     1
 OR { 3490}
   (  segid "    " and resid 8    and name HD1%)
   (  segid "    " and resid 78   and name HG2%)
 OR { 3490}
   (  segid "    " and resid 8    and name HD1%)
   (  segid "    " and resid 28   and name HB% )
 ASSI { 3493}
   (( segid "    " and resid 8    and name HB  ))
   (  segid "    " and resid 8    and name HG2%)
      2.400     0.700     0.700 peak  3493 spectrum    1 weight  0.10000E+01 volume  0.49795E-02 ppm1      2.105 ppm2      0.716 CV     1
 OR { 3493}
   (( segid "    " and resid 8    and name HB  ))
   (  segid "    " and resid 8    and name HD1%)
 OR { 3493}
   (( segid "    " and resid 132  and name HG3 ))
   (  segid "    " and resid 192  and name HD1%)
 ASSI { 3504}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name H   ))
      2.600     0.900     0.900 peak  3504 spectrum    1 weight  0.10000E+01 volume  0.38049E-02 ppm1      1.956 ppm2      7.656 CV     1
 OR { 3504}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name H   ))
 ASSI { 3520}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name HG3 ))
      2.000     0.500     0.500 peak  3520 spectrum    1 weight  0.10000E+01 volume  0.28689E-01 ppm1      1.980 ppm2      2.148 CV     1
 OR { 3520}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HG2 ))
 OR { 3520}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name HG2 ))
 ASSI { 3540}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name H   ))
      2.900     1.100     1.100 peak  3540 spectrum    1 weight  0.10000E+01 volume  0.14895E-02 ppm1      1.444 ppm2      8.644 CV     1
 OR { 3540}
   (( segid "    " and resid 194  and name HG2 ))
   (( segid "    " and resid 194  and name H   ))
 OR { 3540}
   (( segid "    " and resid 194  and name HG3 ))
   (( segid "    " and resid 194  and name H   ))
 ASSI { 3546}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 29   and name HB3 ))
      4.200     2.200     1.800 peak  3546 spectrum    1 weight  0.10000E+01 volume  0.96137E-03 ppm1      3.811 ppm2      3.220 CV     1
 OR { 3546}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HD3 ))
 ASSI { 3553}
   (( segid "    " and resid 30   and name HD3 ))
   (( segid "    " and resid 30   and name HB2 ))
      3.300     1.400     1.400 peak  3553 spectrum    1 weight  0.10000E+01 volume  0.18584E-02 ppm1      3.229 ppm2      2.093 CV     1
 OR { 3553}
   (( segid "    " and resid 181  and name HD3 ))
   (( segid "    " and resid 181  and name HB2 ))
 ASSI { 3555}
   (( segid "    " and resid 181  and name HD3 ))
   (( segid "    " and resid 181  and name HG3 ))
      2.400     0.700     0.700 peak  3555 spectrum    1 weight  0.10000E+01 volume  0.59747E-02 ppm1      3.230 ppm2      1.657 CV     1
 OR { 3555}
   (( segid "    " and resid 30   and name HD3 ))
   (( segid "    " and resid 30   and name HG3 ))
 ASSI { 3559}
   (( segid "    " and resid 30   and name HD2 ))
   (( segid "    " and resid 30   and name HB3 ))
      3.000     1.100     1.100 peak  3559 spectrum    1 weight  0.10000E+01 volume  0.41130E-02 ppm1      3.120 ppm2      1.883 CV     1
 OR { 3559}
   (( segid "    " and resid 35   and name HD3 ))
   (( segid "    " and resid 35   and name HB2 ))
 ASSI { 3566}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HG3 ))
      3.300     1.400     1.400 peak  3566 spectrum    1 weight  0.10000E+01 volume  0.25929E-02 ppm1      3.812 ppm2      1.666 CV     1
 OR { 3566}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 33   and name HB3 ))
 ASSI { 3573}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 106  and name H   ))
      4.300     2.300     1.700 peak  3573 spectrum    1 weight  0.10000E+01 volume  0.96814E-03 ppm1      2.621 ppm2      7.280 CV     1
 OR { 3573}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 85   and name HE22))
 ASSI { 3577}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 28   and name HA  ))
      3.900     1.900     1.900 peak  3577 spectrum    1 weight  0.10000E+01 volume  0.14658E-02 ppm1      2.604 ppm2      4.255 CV     1
 OR { 3577}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 174  and name HA  ))
 ASSI { 3579}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 85   and name HB3 ))
      4.400     2.400     1.600 peak  3579 spectrum    1 weight  0.10000E+01 volume  0.12051E-02 ppm1      2.607 ppm2      1.646 CV     1
 OR { 3579}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 174  and name HB3 ))
 ASSI { 3580}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 106  and name HD3 ))
      2.600     2.600     3.400 peak  3580 spectrum    1 weight  0.10000E+01 volume  0.17636E-02 ppm1      2.598 ppm2      1.532 CV     1
 OR { 3580}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 85   and name HB2 ))
 ASSI { 3581}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 83   and name HD2 ))
      3.700     1.700     1.700 peak  3581 spectrum    1 weight  0.10000E+01 volume  0.14353E-02 ppm1      2.622 ppm2      1.463 CV     1
 OR { 3581}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 106  and name HD2 ))
 ASSI { 3585}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 83   and name HG3 ))
      3.500     1.500     1.500 peak  3585 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      2.619 ppm2      0.921 CV     1
 OR { 3585}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 84   and name HB3 ))
 OR { 3585}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 3601}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 73   and name H   ))
      2.700     0.900     0.900 peak  3601 spectrum    1 weight  0.10000E+01 volume  0.34392E-02 ppm1      0.824 ppm2      6.778 CV     1
 OR { 3601}
   (( segid "    " and resid 195  and name HG3 ))
   (( segid "    " and resid 195  and name HE  ))
 OR { 3601}
   (( segid "    " and resid 195  and name HG2 ))
   (( segid "    " and resid 195  and name HE  ))
 ASSI { 3606}
   (( segid "    " and resid 181  and name HG2 ))
   (( segid "    " and resid 181  and name HD3 ))
      3.500     1.600     1.600 peak  3606 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      1.528 ppm2      3.176 CV     1
 OR { 3606}
   (( segid "    " and resid 73   and name HG  ))
   (( segid "    " and resid 71   and name HB3 ))
 ASSI { 3618}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 73   and name HB3 ))
      2.400     0.700     0.700 peak  3618 spectrum    1 weight  0.10000E+01 volume  0.43668E-02 ppm1      0.822 ppm2      1.313 CV     1
 OR { 3618}
   (( segid "    " and resid 121  and name HG13))
   (( segid "    " and resid 119  and name HG13))
 ASSI { 3619}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name HG  ))
      1.700     0.400     0.500 peak  3619 spectrum    1 weight  0.10000E+01 volume  0.32030E-01 ppm1      0.789 ppm2      1.497 CV     1
 OR { 3619}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 133  and name HG  ))
 ASSI { 3620}
   (  segid "    " and resid 73   and name HD2%)
   (( segid "    " and resid 73   and name HG  ))
      2.300     0.600     0.600 peak  3620 spectrum    1 weight  0.10000E+01 volume  0.91568E-02 ppm1      0.821 ppm2      1.487 CV     1
 OR { 3620}
   (( segid "    " and resid 195  and name HG2 ))
   (( segid "    " and resid 195  and name HB3 ))
 OR { 3620}
   (( segid "    " and resid 195  and name HG3 ))
   (( segid "    " and resid 195  and name HB3 ))
 ASSI { 3621}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HB3 ))
      2.100     0.600     0.600 peak  3621 spectrum    1 weight  0.10000E+01 volume  0.32056E-02 ppm1      1.498 ppm2      1.314 CV     1
 OR { 3621}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 60   and name HG13))
 OR { 3621}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 51   and name HG  ))
 ASSI { 3622}
   (( segid "    " and resid 73   and name HB2 ))
   (  segid "    " and resid 73   and name HD1%)
      2.700     0.900     0.900 peak  3622 spectrum    1 weight  0.10000E+01 volume  0.34901E-02 ppm1      1.493 ppm2      0.800 CV     1
 OR { 3622}
   (( segid "    " and resid 51   and name HB3 ))
   (  segid "    " and resid 51   and name HD1%)
 OR { 3622}
   (( segid "    " and resid 51   and name HB3 ))
   (  segid "    " and resid 60   and name HD1%)
 OR { 3622}
   (( segid "    " and resid 73   and name HB2 ))
   (  segid "    " and resid 73   and name HD2%)
 ASSI { 3625}
   (( segid "    " and resid 73   and name HG  ))
   (  segid "    " and resid 73   and name HD1%)
      1.900     0.500     0.500 peak  3625 spectrum    1 weight  0.10000E+01 volume  0.13348E-01 ppm1      1.508 ppm2      0.811 CV     1
 OR { 3625}
   (( segid "    " and resid 73   and name HG  ))
   (  segid "    " and resid 73   and name HD2%)
 OR { 3625}
   (( segid "    " and resid 133  and name HG  ))
   (  segid "    " and resid 133  and name HD1%)
 ASSI { 3651}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HE  ))
      3.200     1.300     1.300 peak  3651 spectrum    1 weight  0.10000E+01 volume  0.12457E-02 ppm1      3.180 ppm2      7.385 CV     1
 OR { 3651}
   (( segid "    " and resid 30   and name HD2 ))
   (( segid "    " and resid 30   and name HE  ))
 ASSI { 3654}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 74   and name HE  ))
      2.900     1.000     1.000 peak  3654 spectrum    1 weight  0.10000E+01 volume  0.35646E-02 ppm1      1.615 ppm2      7.369 CV     1
 OR { 3654}
   (( segid "    " and resid 40   and name HG  ))
   (( segid "    " and resid 40   and name H   ))
 ASSI { 3655}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 4    and name HA  ))
      4.200     2.200     1.800 peak  3655 spectrum    1 weight  0.10000E+01 volume  0.87674E-03 ppm1      4.452 ppm2      4.716 CV     1
 OR { 3655}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI { 3680}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name HB2 ))
      2.500     0.800     0.800 peak  3680 spectrum    1 weight  0.10000E+01 volume  0.65603E-02 ppm1      1.560 ppm2      1.716 CV     1
 OR { 3680}
   (( segid "    " and resid 82   and name HG3 ))
   (( segid "    " and resid 82   and name HB3 ))
 ASSI { 3694}
   (( segid "    " and resid 182  and name HA  ))
   (( segid "    " and resid 182  and name H   ))
      3.000     1.100     1.100 peak  3694 spectrum    1 weight  0.10000E+01 volume  0.21055E-02 ppm1      4.384 ppm2      8.007 CV     1
 OR { 3694}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 125  and name H   ))
 ASSI { 3704}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name HA  ))
      2.100     0.600     0.600 peak  3704 spectrum    1 weight  0.10000E+01 volume  0.14928E-01 ppm1      1.982 ppm2      4.129 CV     1
 OR { 3704}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 135  and name HA  ))
 ASSI { 3705}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 118  and name HA  ))
      2.000     0.500     0.500 peak  3705 spectrum    1 weight  0.10000E+01 volume  0.15436E-01 ppm1      1.896 ppm2      4.127 CV     1
 OR { 3705}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name HA  ))
 ASSI { 3734}
   (( segid "    " and resid 111  and name HB3 ))
   (( segid "    " and resid 111  and name H   ))
      2.800     1.000     1.000 peak  3734 spectrum    1 weight  0.10000E+01 volume  0.13777E-02 ppm1      1.991 ppm2      8.410 CV     1
 OR { 3734}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name H   ))
 ASSI { 3755}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HB3 ))
      1.800     0.400     0.400 peak  3755 spectrum    1 weight  0.10000E+01 volume  0.12288E-01 ppm1      2.013 ppm2      2.366 CV     1
 OR { 3755}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HG3 ))
 ASSI { 3765}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 174  and name HD2%)
      3.400     1.400     1.400 peak  3765 spectrum    1 weight  0.10000E+01 volume  0.18618E-02 ppm1      1.984 ppm2      0.727 CV     1
 OR { 3765}
   (( segid "    " and resid 111  and name HB3 ))
   (  segid "    " and resid 112  and name HD1%)
 OR { 3765}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 191  and name HD2%)
 ASSI { 3766}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 174  and name HD2%)
      3.500     1.500     1.500 peak  3766 spectrum    1 weight  0.10000E+01 volume  0.17298E-02 ppm1      1.995 ppm2      0.683 CV     1
 OR { 3766}
   (( segid "    " and resid 111  and name HB3 ))
   (  segid "    " and resid 115  and name HD1%)
 OR { 3766}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 174  and name HD1%)
 ASSI { 3776}
   (( segid "    " and resid 88   and name HG  ))
   (( segid "    " and resid 89   and name H   ))
      4.300     2.300     1.700 peak  3776 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      1.290 ppm2      8.447 CV     1
 OR { 3776}
   (( segid "    " and resid 51   and name HG  ))
   (( segid "    " and resid 51   and name H   ))
 ASSI { 3783}
   (( segid "    " and resid 51   and name HB3 ))
   (( segid "    " and resid 51   and name HA  ))
      3.200     1.300     1.300 peak  3783 spectrum    1 weight  0.10000E+01 volume  0.12423E-02 ppm1      1.505 ppm2      4.410 CV     1
 OR { 3783}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 3806}
   (( segid "    " and resid 51   and name HG  ))
   (  segid "    " and resid 51   and name HD1%)
      2.100     0.600     0.600 peak  3806 spectrum    1 weight  0.10000E+01 volume  0.99285E-02 ppm1      1.299 ppm2      0.770 CV     1
 OR { 3806}
   (( segid "    " and resid 51   and name HG  ))
   (  segid "    " and resid 51   and name HD2%)
 OR { 3806}
   (( segid "    " and resid 88   and name HG  ))
   (  segid "    " and resid 88   and name HD2%)
 ASSI { 3817}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 48   and name H   ))
      4.400     2.400     1.600 peak  3817 spectrum    1 weight  0.10000E+01 volume  0.70410E-03 ppm1      2.551 ppm2      8.603 CV     1
 OR { 3817}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 45   and name H   ))
 ASSI { 3823}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB3 ))
      2.900     1.000     1.000 peak  3823 spectrum    1 weight  0.10000E+01 volume  0.11983E-02 ppm1      4.881 ppm2      1.855 CV     1
 OR { 3823}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 79   and name HB3 ))
 ASSI { 3826}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HD3 ))
      3.200     1.300     1.300 peak  3826 spectrum    1 weight  0.10000E+01 volume  0.21394E-02 ppm1      1.792 ppm2      2.951 CV     1
 OR { 3826}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HD2 ))
 OR { 3826}
   (( segid "    " and resid 86   and name HB3 ))
   (( segid "    " and resid 86   and name HD3 ))
 OR { 3826}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name HE3 ))
 ASSI { 3827}
   (( segid "    " and resid 86   and name HB3 ))
   (( segid "    " and resid 86   and name HG2 ))
      2.600     0.900     0.900 peak  3827 spectrum    1 weight  0.10000E+01 volume  0.28503E-02 ppm1      1.787 ppm2      1.442 CV     1
 OR { 3827}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HG3 ))
 OR { 3827}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name HG3 ))
 OR { 3827}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HG2 ))
 OR { 3827}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name HG2 ))
 ASSI { 3839}
   (( segid "    " and resid -4   and name HG13))
   (( segid "    " and resid -4   and name HB  ))
      2.900     1.000     1.000 peak  3839 spectrum    1 weight  0.10000E+01 volume  0.35307E-02 ppm1      1.348 ppm2      1.728 CV     1
 OR { 3839}
   (( segid "    " and resid 91   and name HG3 ))
   (( segid "    " and resid 91   and name HB3 ))
 ASSI { 3848}
   (( segid "    " and resid 90   and name HG12))
   (( segid "    " and resid 90   and name HB  ))
      2.600     0.900     0.900 peak  3848 spectrum    1 weight  0.10000E+01 volume  0.27826E-02 ppm1      1.104 ppm2      1.646 CV     1
 OR { 3848}
   (( segid "    " and resid 90   and name HG12))
   (( segid "    " and resid 191  and name HB2 ))
 ASSI { 3852}
   (( segid "    " and resid 90   and name HG13))
   (  segid "    " and resid 115  and name HD1%)
      1.800     0.400     0.400 peak  3852 spectrum    1 weight  0.10000E+01 volume  0.11746E-01 ppm1      1.206 ppm2      0.635 CV     1
 OR { 3852}
   (( segid "    " and resid 90   and name HG13))
   (  segid "    " and resid 90   and name HD1%)
 OR { 3852}
   (( segid "    " and resid 90   and name HG13))
   (  segid "    " and resid 90   and name HG2%)
 ASSI { 3854}
   (( segid "    " and resid 90   and name HG13))
   (  segid "    " and resid 115  and name HG2%)
      2.600     0.900     0.900 peak  3854 spectrum    1 weight  0.10000E+01 volume  0.35713E-02 ppm1      1.212 ppm2      0.743 CV     1
 OR { 3854}
   (( segid "    " and resid 90   and name HG13))
   (( segid "    " and resid 115  and name HG12))
 OR { 3854}
   (( segid "    " and resid 119  and name HG12))
   (  segid "    " and resid 119  and name HG2%)
 ASSI { 3857}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 63   and name H   ))
      3.200     1.300     1.300 peak  3857 spectrum    1 weight  0.10000E+01 volume  0.18043E-02 ppm1      2.056 ppm2      8.448 CV     1
 OR { 3857}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 64   and name H   ))
 ASSI { 3858}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 63   and name H   ))
      3.300     1.400     1.400 peak  3858 spectrum    1 weight  0.10000E+01 volume  0.33139E-02 ppm1      2.284 ppm2      8.439 CV     1
 OR { 3858}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 64   and name H   ))
 ASSI { 3864}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 64   and name H   ))
      3.300     1.300     1.300 peak  3864 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      1.930 ppm2      8.437 CV     1
 OR { 3864}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name H   ))
 ASSI { 3883}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HG2 ))
      2.900     1.000     1.000 peak  3883 spectrum    1 weight  0.10000E+01 volume  0.23831E-02 ppm1      1.918 ppm2      2.403 CV     1
 OR { 3883}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HG2 ))
 ASSI { 3932}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 102  and name H   ))
      3.800     1.800     1.800 peak  3932 spectrum    1 weight  0.10000E+01 volume  0.71764E-03 ppm1      2.909 ppm2      8.808 CV     1
 OR { 3932}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 3947}
   (( segid "    " and resid 131  and name HD2 ))
   (  segid "    " and resid 174  and name HD1%)
      2.600     0.800     0.800 peak  3947 spectrum    1 weight  0.10000E+01 volume  0.28164E-02 ppm1      2.958 ppm2      0.699 CV     1
 OR { 3947}
   (( segid "    " and resid 131  and name HD2 ))
   (  segid "    " and resid 174  and name HD2%)
 OR { 3947}
   (( segid "    " and resid 131  and name HD2 ))
   (  segid "    " and resid 185  and name HG1%)
 ASSI { 3952}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 136  and name H   ))
      1.900     0.500     0.500 peak  3952 spectrum    1 weight  0.10000E+01 volume  0.15802E-01 ppm1      4.129 ppm2      8.367 CV     1
 OR { 3952}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name H   ))
 ASSI { 3954}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name H   ))
      2.400     0.700     0.700 peak  3954 spectrum    1 weight  0.10000E+01 volume  0.67162E-02 ppm1      4.166 ppm2      8.264 CV     1
 OR { 3954}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name H   ))
 ASSI { 3955}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 137  and name H   ))
      2.300     0.700     0.700 peak  3955 spectrum    1 weight  0.10000E+01 volume  0.13283E-01 ppm1      4.138 ppm2      8.141 CV     1
 OR { 3955}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 137  and name H   ))
 ASSI { 3957}
   (( segid "    " and resid 197  and name HB2 ))
   (  segid "    " and resid 197  and name HD% )
      2.600     0.800     0.800 peak  3957 spectrum    1 weight  0.10000E+01 volume  0.33816E-02 ppm1      2.431 ppm2      7.005 CV     1
 OR { 3957}
   (( segid "    " and resid 197  and name HB2 ))
   (  segid "    " and resid 199  and name HD% )
 ASSI { 3964}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      2.400     0.700     0.700 peak  3964 spectrum    1 weight  0.10000E+01 volume  0.83681E-02 ppm1      2.452 ppm2      4.169 CV     1
 OR { 3964}
   (( segid "    " and resid 197  and name HB2 ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 3968}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HG3 ))
      2.500     0.800     0.800 peak  3968 spectrum    1 weight  0.10000E+01 volume  0.12210E-01 ppm1      4.129 ppm2      2.148 CV     1
 OR { 3968}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HG3 ))
 ASSI { 3969}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HB2 ))
      2.100     0.500     0.500 peak  3969 spectrum    1 weight  0.10000E+01 volume  0.16953E-01 ppm1      4.131 ppm2      1.980 CV     1
 OR { 3969}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HB3 ))
 OR { 3969}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HG2 ))
 OR { 3969}
   (( segid "    " and resid 135  and name HA  ))
   (  segid "    " and resid 134  and name HE% )
 ASSI { 4012}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HB3 ))
      2.200     0.600     0.600 peak  4012 spectrum    1 weight  0.10000E+01 volume  0.77520E-02 ppm1      4.101 ppm2      1.896 CV     1
 OR { 4012}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HB2 ))
 ASSI { 4013}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB3 ))
      2.600     0.800     0.800 peak  4013 spectrum    1 weight  0.10000E+01 volume  0.38489E-02 ppm1      4.110 ppm2      1.789 CV     1
 OR { 4013}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HB3 ))
 OR { 4013}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI { 4027}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 119  and name HD1%)
      4.500     2.500     1.500 peak  4027 spectrum    1 weight  0.10000E+01 volume  0.15098E-02 ppm1      4.107 ppm2      0.619 CV     1
 OR { 4027}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 4028}
   (( segid "    " and resid 135  and name HB2 ))
   (  segid "    " and resid 133  and name HD1%)
      3.100     1.200     1.200 peak  4028 spectrum    1 weight  0.10000E+01 volume  0.18855E-02 ppm1      1.891 ppm2      0.761 CV     1
 OR { 4028}
   (( segid "    " and resid 118  and name HB3 ))
   (  segid "    " and resid 119  and name HG2%)
 ASSI { 4031}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 115  and name HG2%)
      3.500     1.500     1.500 peak  4031 spectrum    1 weight  0.10000E+01 volume  0.20209E-02 ppm1      1.956 ppm2      0.759 CV     1
 OR { 4031}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 119  and name HG2%)
 ASSI { 4035}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 85   and name HB2 ))
      1.900     0.400     0.400 peak  4035 spectrum    1 weight  0.10000E+01 volume  0.14085E-01 ppm1      1.751 ppm2      1.561 CV     1
 OR { 4035}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 101  and name HB3 ))
 ASSI { 4043}
   (  segid "    " and resid 113  and name HE% )
   (( segid "    " and resid 113  and name HB2 ))
      2.300     0.700     0.700 peak  4043 spectrum    1 weight  0.10000E+01 volume  0.18395E-01 ppm1      1.751 ppm2      1.891 CV     1
 OR { 4043}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 101  and name HB2 ))
 ASSI { 4049}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 114  and name HA  ))
      4.500     2.500     1.500 peak  4049 spectrum    1 weight  0.10000E+01 volume  0.96137E-03 ppm1      1.898 ppm2      3.835 CV     1
 OR { 4049}
   (( segid "    " and resid 87   and name HB3 ))
   (( segid "    " and resid 99   and name HB  ))
 ASSI { 4055}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 101  and name HA  ))
      2.100     0.500     0.500 peak  4055 spectrum    1 weight  0.10000E+01 volume  0.89705E-02 ppm1      1.749 ppm2      4.828 CV     1
 OR { 4055}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 4056}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 87   and name HA  ))
      2.500     0.800     0.800 peak  4056 spectrum    1 weight  0.10000E+01 volume  0.60254E-02 ppm1      1.749 ppm2      4.648 CV     1
 OR { 4056}
   (  segid "    " and resid 101  and name HE% )
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 4071}
   (( segid "    " and resid 183  and name HG2 ))
   (  segid "    " and resid 174  and name HD2%)
      4.200     2.200     1.800 peak  4071 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      2.259 ppm2      0.681 CV     1
 OR { 4071}
   (( segid "    " and resid 183  and name HG2 ))
   (  segid "    " and resid 185  and name HG1%)
 ASSI { 4094}
   (( segid "    " and resid 183  and name HG3 ))
   (  segid "    " and resid 185  and name HG1%)
      4.600     2.700     1.400 peak  4094 spectrum    1 weight  0.10000E+01 volume  0.76843E-03 ppm1      2.526 ppm2      0.680 CV     1
 OR { 4094}
   (( segid "    " and resid 183  and name HG3 ))
   (  segid "    " and resid 174  and name HD2%)
 ASSI { 4099}
   (( segid "    " and resid 192  and name HG  ))
   (( segid "    " and resid 132  and name H   ))
      3.600     1.600     1.600 peak  4099 spectrum    1 weight  0.10000E+01 volume  0.93768E-03 ppm1      1.373 ppm2      8.641 CV     1
 OR { 4099}
   (( segid "    " and resid 193  and name HG  ))
   (( segid "    " and resid 194  and name H   ))
 ASSI { 4101}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 194  and name H   ))
      2.800     1.000     1.000 peak  4101 spectrum    1 weight  0.10000E+01 volume  0.83748E-02 ppm1      0.723 ppm2      8.648 CV     1
 OR { 4101}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 132  and name H   ))
 ASSI { 4104}
   (( segid "    " and resid 91   and name HG3 ))
   (( segid "    " and resid 91   and name HA  ))
      3.200     1.200     1.200 peak  4104 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      1.373 ppm2      4.864 CV     1
 OR { 4104}
   (( segid "    " and resid 193  and name HG  ))
   (( segid "    " and resid 193  and name HA  ))
 OR { 4104}
   (( segid "    " and resid 192  and name HG  ))
   (( segid "    " and resid 191  and name HA  ))
 ASSI { 4106}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 4    and name HA  ))
      2.200     0.600     0.600 peak  4106 spectrum    1 weight  0.10000E+01 volume  0.10778E-01 ppm1      0.695 ppm2      4.712 CV     1
 OR { 4106}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 192  and name HA  ))
 ASSI { 4108}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 112  and name HB2 ))
      2.100     0.600     0.600 peak  4108 spectrum    1 weight  0.10000E+01 volume  0.12532E-01 ppm1      0.695 ppm2      1.656 CV     1
 OR { 4108}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 74   and name HB3 ))
 ASSI { 4109}
   (  segid "    " and resid 192  and name HD2%)
   (( segid "    " and resid 192  and name HG  ))
      1.800     0.400     0.400 peak  4109 spectrum    1 weight  0.10000E+01 volume  0.35067E-01 ppm1      0.695 ppm2      1.418 CV     1
 OR { 4109}
   (  segid "    " and resid 171  and name HD1%)
   (( segid "    " and resid 171  and name HG  ))
 ASSI { 4114}
   (( segid "    " and resid 192  and name HG  ))
   (  segid "    " and resid 190  and name HG2%)
      3.800     1.800     1.800 peak  4114 spectrum    1 weight  0.10000E+01 volume  0.14319E-02 ppm1      1.384 ppm2      0.956 CV     1
 OR { 4114}
   (( segid "    " and resid 193  and name HG  ))
   (  segid "    " and resid 93   and name HD1%)
 OR { 4114}
   (( segid "    " and resid 193  and name HG  ))
   (  segid "    " and resid 93   and name HD2%)
 ASSI { 4115}
   (( segid "    " and resid 192  and name HG  ))
   (  segid "    " and resid 192  and name HD2%)
      2.100     0.600     0.600 peak  4115 spectrum    1 weight  0.10000E+01 volume  0.11594E-01 ppm1      1.369 ppm2      0.712 CV     1
 OR { 4115}
   (( segid "    " and resid 192  and name HG  ))
   (  segid "    " and resid 192  and name HD1%)
 OR { 4115}
   (( segid "    " and resid 193  and name HG  ))
   (  segid "    " and resid 193  and name HD2%)
 ASSI { 4121}
   (( segid "    " and resid 191  and name HA  ))
   (  segid "    " and resid 191  and name HD2%)
      2.900     1.000     1.000 peak  4121 spectrum    1 weight  0.10000E+01 volume  0.47526E-02 ppm1      4.898 ppm2      0.755 CV     1
 OR { 4121}
   (( segid "    " and resid 191  and name HA  ))
   (  segid "    " and resid 192  and name HD1%)
 ASSI { 4131}
   (( segid "    " and resid 77   and name HB3 ))
   (  segid "    " and resid 73   and name HD2%)
      4.400     2.500     1.600 peak  4131 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      2.440 ppm2      0.822 CV     1
 OR { 4131}
   (( segid "    " and resid 77   and name HB3 ))
   (  segid "    " and resid 73   and name HD1%)
 OR { 4131}
   (( segid "    " and resid 197  and name HB2 ))
   (( segid "    " and resid 196  and name HB3 ))
 ASSI { 4136}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 61   and name HZ2 ))
      4.300     2.300     1.700 peak  4136 spectrum    1 weight  0.10000E+01 volume  0.61269E-03 ppm1      2.439 ppm2      7.160 CV     1
 OR { 4136}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 61   and name HZ2 ))
 ASSI { 4138}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 61   and name HH2 ))
      4.100     2.100     1.900 peak  4138 spectrum    1 weight  0.10000E+01 volume  0.83273E-03 ppm1      2.433 ppm2      6.490 CV     1
 OR { 4138}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 61   and name HH2 ))
 OR { 4138}
   (( segid "    " and resid 50   and name HB2 ))
   (  segid "    " and resid 50   and name HE% )
 ASSI { 4139}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 51   and name H   ))
      4.800     2.900     1.200 peak  4139 spectrum    1 weight  0.10000E+01 volume  0.60931E-03 ppm1      2.435 ppm2      8.419 CV     1
 OR { 4139}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 83   and name H   ))
 ASSI { 4146}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 50   and name HB2 ))
      1.800     0.400     0.400 peak  4146 spectrum    1 weight  0.10000E+01 volume  0.70987E-02 ppm1      2.140 ppm2      2.433 CV     1
 OR { 4146}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 82   and name HD2 ))
 OR { 4146}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 50   and name HB2 ))
 ASSI { 4148}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 80   and name HB3 ))
      3.900     1.900     1.900 peak  4148 spectrum    1 weight  0.10000E+01 volume  0.12762E-02 ppm1      2.432 ppm2      1.973 CV     1
 OR { 4148}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 80   and name HB3 ))
 OR { 4148}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI { 4149}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 80   and name HB3 ))
      2.800     1.000     1.000 peak  4149 spectrum    1 weight  0.10000E+01 volume  0.17400E-02 ppm1      2.140 ppm2      1.990 CV     1
 OR { 4149}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 80   and name HB2 ))
 OR { 4149}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 80   and name HB3 ))
 ASSI { 4155}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 82   and name HG3 ))
      3.100     1.200     1.200 peak  4155 spectrum    1 weight  0.10000E+01 volume  0.14421E-02 ppm1      2.439 ppm2      1.545 CV     1
 OR { 4155}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HG3 ))
 ASSI { 4166}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 102  and name HB  ))
      2.400     2.400     3.600 peak  4166 spectrum    1 weight  0.10000E+01 volume  0.21766E-02 ppm1      1.138 ppm2      1.966 CV     1
 OR { 4166}
   (  segid "    " and resid 0    and name HG2%)
   (( segid "    " and resid 21   and name HG3 ))
 ASSI { 4192}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 14   and name HA  ))
      4.300     2.400     1.700 peak  4192 spectrum    1 weight  0.10000E+01 volume  0.60592E-03 ppm1      1.491 ppm2      4.976 CV     1
 OR { 4192}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 16   and name HA  ))
 ASSI { 4198}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name HG2 ))
      2.300     0.600     0.600 peak  4198 spectrum    1 weight  0.10000E+01 volume  0.54602E-02 ppm1      1.510 ppm2      1.303 CV     1
 OR { 4198}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name HG2 ))
 OR { 4198}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name HG3 ))
 ASSI { 4222}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HA  ))
      3.500     1.500     1.500 peak  4222 spectrum    1 weight  0.10000E+01 volume  0.19024E-02 ppm1      1.248 ppm2      4.681 CV     1
 OR { 4222}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 4223}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 15   and name HA  ))
      2.900     1.100     1.100 peak  4223 spectrum    1 weight  0.10000E+01 volume  0.22409E-02 ppm1      1.309 ppm2      4.676 CV     1
 OR { 4223}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI { 4231}
   (( segid "    " and resid 138  and name HG3 ))
   (( segid "    " and resid 138  and name HB3 ))
      2.300     0.700     0.700 peak  4231 spectrum    1 weight  0.10000E+01 volume  0.78569E-02 ppm1      1.344 ppm2      1.789 CV     1
 OR { 4231}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HB3 ))
 OR { 4231}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 138  and name HB3 ))
 OR { 4231}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HB3 ))
 ASSI { 4232}
   (( segid "    " and resid 138  and name HG3 ))
   (( segid "    " and resid 138  and name HB3 ))
      2.200     0.600     0.600 peak  4232 spectrum    1 weight  0.10000E+01 volume  0.92922E-02 ppm1      1.314 ppm2      1.792 CV     1
 OR { 4232}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HB3 ))
 OR { 4232}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HB3 ))
 OR { 4232}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 138  and name HB3 ))
 ASSI { 4233}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 15   and name HD3 ))
      2.100     0.500     0.500 peak  4233 spectrum    1 weight  0.10000E+01 volume  0.13994E-01 ppm1      1.312 ppm2      1.690 CV     1
 OR { 4233}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 138  and name HB2 ))
 OR { 4233}
   (( segid "    " and resid 138  and name HG3 ))
   (( segid "    " and resid 138  and name HB2 ))
 OR { 4233}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HB2 ))
 ASSI { 4235}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HD3 ))
      2.000     0.500     0.500 peak  4235 spectrum    1 weight  0.10000E+01 volume  0.18357E-01 ppm1      1.318 ppm2      1.587 CV     1
 OR { 4235}
   (( segid "    " and resid 138  and name HG3 ))
   (( segid "    " and resid 138  and name HD2 ))
 OR { 4235}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 138  and name HD3 ))
 OR { 4235}
   (( segid "    " and resid 138  and name HG3 ))
   (( segid "    " and resid 138  and name HD3 ))
 OR { 4235}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 138  and name HD2 ))
 ASSI { 4236}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 36   and name HG12))
      3.000     1.100     1.100 peak  4236 spectrum    1 weight  0.10000E+01 volume  0.21868E-02 ppm1      1.255 ppm2      0.912 CV     1
 OR { 4236}
   (( segid "    " and resid 89   and name HG2 ))
   (  segid "    " and resid 99   and name HG2%)
 ASSI { 4237}
   (( segid "    " and resid 15   and name HG2 ))
   (  segid "    " and resid 13   and name HG2%)
      2.900     1.000     1.000 peak  4237 spectrum    1 weight  0.10000E+01 volume  0.44445E-02 ppm1      1.307 ppm2      0.818 CV     1
 OR { 4237}
   (( segid "    " and resid 15   and name HG2 ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 4239}
   (( segid "    " and resid 15   and name HG3 ))
   (  segid "    " and resid 36   and name HD1%)
      2.900     1.100     1.100 peak  4239 spectrum    1 weight  0.10000E+01 volume  0.28368E-02 ppm1      1.252 ppm2      0.672 CV     1
 OR { 4239}
   (( segid "    " and resid 98   and name HG2 ))
   (  segid "    " and resid 90   and name HG2%)
 ASSI { 4241}
   (( segid "    " and resid 15   and name HG2 ))
   (  segid "    " and resid 13   and name HG1%)
      3.200     1.300     1.300 peak  4241 spectrum    1 weight  0.10000E+01 volume  0.23019E-02 ppm1      1.306 ppm2      0.909 CV     1
 OR { 4241}
   (( segid "    " and resid 89   and name HG2 ))
   (  segid "    " and resid 99   and name HG2%)
 OR { 4241}
   (( segid "    " and resid 89   and name HG3 ))
   (  segid "    " and resid 99   and name HG2%)
 ASSI { 4249}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 8    and name H   ))
      3.800     1.800     1.800 peak  4249 spectrum    1 weight  0.10000E+01 volume  0.75489E-03 ppm1      1.366 ppm2      9.047 CV     1
 OR { 4249}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 79   and name H   ))
 ASSI { 4251}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 79   and name H   ))
      4.100     2.100     1.900 peak  4251 spectrum    1 weight  0.10000E+01 volume  0.75150E-03 ppm1      1.827 ppm2      9.049 CV     1
 OR { 4251}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 8    and name H   ))
 ASSI { 4266}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 16   and name HA  ))
      4.300     2.300     1.700 peak  4266 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      1.346 ppm2      4.968 CV     1
 OR { 4266}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 14   and name HA  ))
 ASSI { 4273}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 16   and name HA  ))
      3.800     1.800     1.800 peak  4273 spectrum    1 weight  0.10000E+01 volume  0.11408E-02 ppm1      1.206 ppm2      4.949 CV     1
 OR { 4273}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI { 4275}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name HA  ))
      3.300     1.400     1.400 peak  4275 spectrum    1 weight  0.10000E+01 volume  0.26539E-02 ppm1      1.140 ppm2      4.502 CV     1
 OR { 4275}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 4279}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 106  and name HE3 ))
      3.400     1.500     1.500 peak  4279 spectrum    1 weight  0.10000E+01 volume  0.23831E-02 ppm1      1.141 ppm2      2.796 CV     1
 OR { 4279}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name HE3 ))
 OR { 4279}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name HE2 ))
 ASSI { 4281}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HE2 ))
      2.000     0.500     0.500 peak  4281 spectrum    1 weight  0.10000E+01 volume  0.20619E-01 ppm1      1.460 ppm2      2.797 CV     1
 OR { 4281}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 83   and name HE2 ))
 OR { 4281}
   (( segid "    " and resid 89   and name HD2 ))
   (( segid "    " and resid 89   and name HE3 ))
 OR { 4281}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HE3 ))
 OR { 4281}
   (( segid "    " and resid 89   and name HD2 ))
   (( segid "    " and resid 89   and name HE2 ))
 OR { 4281}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HE2 ))
 OR { 4281}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HE3 ))
 OR { 4281}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 83   and name HE2 ))
 ASSI { 4283}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name HE3 ))
      3.900     1.900     1.900 peak  4283 spectrum    1 weight  0.10000E+01 volume  0.11949E-02 ppm1      1.806 ppm2      2.801 CV     1
 OR { 4283}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name HE2 ))
 OR { 4283}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HE2 ))
 ASSI { 4286}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HB2 ))
      2.700     0.900     0.900 peak  4286 spectrum    1 weight  0.10000E+01 volume  0.61135E-02 ppm1      1.463 ppm2      1.822 CV     1
 OR { 4286}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HB2 ))
 OR { 4286}
   (( segid "    " and resid 89   and name HD2 ))
   (( segid "    " and resid 89   and name HB2 ))
 ASSI { 4288}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HD3 ))
      3.100     1.200     1.200 peak  4288 spectrum    1 weight  0.10000E+01 volume  0.29281E-02 ppm1      1.826 ppm2      1.459 CV     1
 OR { 4288}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HD3 ))
 OR { 4288}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name HD2 ))
 OR { 4288}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HD2 ))
 OR { 4288}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name HD3 ))
 ASSI { 4297}
   (( segid "    " and resid 89   and name HD2 ))
   (( segid "    " and resid 89   and name HG3 ))
      2.100     0.500     0.500 peak  4297 spectrum    1 weight  0.10000E+01 volume  0.13429E-01 ppm1      1.459 ppm2      1.344 CV     1
 OR { 4297}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HB3 ))
 OR { 4297}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 83   and name HB2 ))
 OR { 4297}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HB3 ))
 ASSI { 4299}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HB3 ))
      1.900     0.500     0.500 peak  4299 spectrum    1 weight  0.10000E+01 volume  0.10257E-01 ppm1      1.803 ppm2      1.331 CV     1
 OR { 4299}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR { 4299}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name HG3 ))
 OR { 4299}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HG3 ))
 ASSI { 4300}
   (( segid "    " and resid 89   and name HB3 ))
   (  segid "    " and resid 97   and name HG2%)
      3.100     1.200     1.200 peak  4300 spectrum    1 weight  0.10000E+01 volume  0.36729E-02 ppm1      1.817 ppm2      0.702 CV     1
 OR { 4300}
   (( segid "    " and resid 7    and name HB2 ))
   (  segid "    " and resid 14   and name HG2%)
 ASSI { 4304}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name HD2 ))
      2.300     0.700     0.700 peak  4304 spectrum    1 weight  0.10000E+01 volume  0.59747E-02 ppm1      1.146 ppm2      1.460 CV     1
 OR { 4304}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name HD3 ))
 OR { 4304}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 106  and name HD2 ))
 ASSI { 4306}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 106  and name HB2 ))
      2.500     0.800     0.800 peak  4306 spectrum    1 weight  0.10000E+01 volume  0.31449E-02 ppm1      1.146 ppm2      1.832 CV     1
 OR { 4306}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name HB2 ))
 ASSI { 4308}
   (( segid "    " and resid 106  and name HG3 ))
   (  segid "    " and resid 102  and name HG1%)
      3.900     1.900     1.900 peak  4308 spectrum    1 weight  0.10000E+01 volume  0.21665E-02 ppm1      1.147 ppm2      0.712 CV     1
 OR { 4308}
   (( segid "    " and resid 7    and name HG3 ))
   (  segid "    " and resid 14   and name HG2%)
 ASSI { 4309}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HD3 ))
      2.400     0.700     0.700 peak  4309 spectrum    1 weight  0.10000E+01 volume  0.71155E-02 ppm1      1.799 ppm2      1.597 CV     1
 OR { 4309}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR { 4309}
   (( segid "    " and resid 138  and name HB3 ))
   (( segid "    " and resid 138  and name HD2 ))
 ASSI { 4310}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HD2 ))
      2.300     0.600     0.600 peak  4310 spectrum    1 weight  0.10000E+01 volume  0.96409E-02 ppm1      1.696 ppm2      1.597 CV     1
 OR { 4310}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name HD2 ))
 OR { 4310}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HD3 ))
 OR { 4310}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 58   and name HD2 ))
 OR { 4310}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 58   and name HD3 ))
 ASSI { 4340}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 43   and name HB2 ))
      1.800     0.400     0.400 peak  4340 spectrum    1 weight  0.10000E+01 volume  0.10853E-01 ppm1      2.327 ppm2      1.972 CV     1
 OR { 4340}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 21   and name HG3 ))
 OR { 4340}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 43   and name HG3 ))
 ASSI { 4345}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 17   and name HE% )
      3.700     1.700     1.700 peak  4345 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      1.567 ppm2      1.685 CV     1
 OR { 4345}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 8    and name HG13))
 ASSI { 4346}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 17   and name HE% )
      2.600     0.800     0.800 peak  4346 spectrum    1 weight  0.10000E+01 volume  0.28097E-02 ppm1      3.226 ppm2      1.688 CV     1
 OR { 4346}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI { 4347}
   (( segid "    " and resid 32   and name HG13))
   (( segid "    " and resid 8    and name HG13))
      4.100     2.100     1.900 peak  4347 spectrum    1 weight  0.10000E+01 volume  0.76166E-03 ppm1      0.976 ppm2      1.684 CV     1
 OR { 4347}
   (( segid "    " and resid 32   and name HG13))
   (  segid "    " and resid 17   and name HE% )
 OR { 4347}
   (( segid "    " and resid 32   and name HG12))
   (( segid "    " and resid 8    and name HG13))
 OR { 4347}
   (( segid "    " and resid 32   and name HG12))
   (  segid "    " and resid 17   and name HE% )
 ASSI { 4349}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 39   and name HB% )
      2.900     1.000     1.000 peak  4349 spectrum    1 weight  0.10000E+01 volume  0.32327E-02 ppm1      3.557 ppm2      1.113 CV     1
 OR { 4349}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HG3 ))
 ASSI { 4359}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 36   and name H   ))
      3.900     1.900     1.900 peak  4359 spectrum    1 weight  0.10000E+01 volume  0.65671E-03 ppm1      3.557 ppm2      7.991 CV     1
 OR { 4359}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 39   and name H   ))
 ASSI { 4394}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 44   and name HB3 ))
      3.800     1.800     1.800 peak  4394 spectrum    1 weight  0.10000E+01 volume  0.19464E-02 ppm1      3.802 ppm2      1.984 CV     1
 OR { 4394}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 43   and name HB2 ))
 ASSI { 4405}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 170  and name H   ))
      2.200     0.600     0.600 peak  4405 spectrum    1 weight  0.10000E+01 volume  0.10616E-01 ppm1      4.454 ppm2      7.889 CV     1
 OR { 4405}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name H   ))
 ASSI { 4408}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 84   and name H   ))
      4.400     2.400     1.600 peak  4408 spectrum    1 weight  0.10000E+01 volume  0.75489E-03 ppm1      4.464 ppm2      8.100 CV     1
 OR { 4408}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 138  and name H   ))
 ASSI { 4413}
   (( segid "    " and resid 84   and name HE3 ))
   (( segid "    " and resid 48   and name HA3 ))
      3.100     1.200     1.200 peak  4413 spectrum    1 weight  0.10000E+01 volume  0.18754E-02 ppm1      2.328 ppm2      4.472 CV     1
 OR { 4413}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI { 4415}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HB3 ))
      2.200     0.600     0.600 peak  4415 spectrum    1 weight  0.10000E+01 volume  0.13283E-01 ppm1      4.455 ppm2      2.644 CV     1
 OR { 4415}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 169  and name HB3 ))
 ASSI { 4416}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 103  and name HB2 ))
      2.200     0.600     0.600 peak  4416 spectrum    1 weight  0.10000E+01 volume  0.29619E-02 ppm1      2.637 ppm2      2.308 CV     1
 OR { 4416}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI { 4442}
   (( segid "    " and resid 111  and name HB3 ))
   (( segid "    " and resid 111  and name HA  ))
      3.400     1.400     1.400 peak  4442 spectrum    1 weight  0.10000E+01 volume  0.19566E-02 ppm1      2.020 ppm2      4.044 CV     1
 OR { 4442}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HD2 ))
 ASSI { 4455}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HB2 ))
      1.700     0.400     0.500 peak  4455 spectrum    1 weight  0.10000E+01 volume  0.23107E-01 ppm1      2.358 ppm2      2.018 CV     1
 OR { 4455}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HG3 ))
 OR { 4455}
   (( segid "    " and resid 72   and name HG3 ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 4458}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HD3 ))
      2.900     1.000     1.000 peak  4458 spectrum    1 weight  0.10000E+01 volume  0.26267E-02 ppm1      4.137 ppm2      1.635 CV     1
 OR { 4458}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HG2 ))
 OR { 4458}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HD2 ))
 ASSI { 4479}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 58   and name HE3 ))
      1.900     0.500     0.500 peak  4479 spectrum    1 weight  0.10000E+01 volume  0.25828E-01 ppm1      1.622 ppm2      2.921 CV     1
 OR { 4479}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 57   and name HE3 ))
 OR { 4479}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR { 4479}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 138  and name HE2 ))
 OR { 4479}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR { 4479}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 58   and name HE2 ))
 OR { 4479}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 58   and name HE3 ))
 OR { 4479}
   (( segid "    " and resid 138  and name HD3 ))
   (( segid "    " and resid 138  and name HE2 ))
 OR { 4479}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 57   and name HE2 ))
 OR { 4479}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 58   and name HE2 ))
 OR { 4479}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR { 4479}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HE3 ))
 ASSI { 4480}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 58   and name HE3 ))
      1.800     0.400     0.400 peak  4480 spectrum    1 weight  0.10000E+01 volume  0.33844E-01 ppm1      1.594 ppm2      2.902 CV     1
 OR { 4480}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR { 4480}
   (( segid "    " and resid 98   and name HD2 ))
   (( segid "    " and resid 98   and name HE2 ))
 OR { 4480}
   (( segid "    " and resid 138  and name HD3 ))
   (( segid "    " and resid 138  and name HE3 ))
 OR { 4480}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 138  and name HE2 ))
 OR { 4480}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR { 4480}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 58   and name HE2 ))
 OR { 4480}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 58   and name HE3 ))
 OR { 4480}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 138  and name HE3 ))
 OR { 4480}
   (( segid "    " and resid 138  and name HD3 ))
   (( segid "    " and resid 138  and name HE2 ))
 OR { 4480}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 58   and name HE2 ))
 OR { 4480}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR { 4480}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HE3 ))
 ASSI { 4481}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 138  and name H   ))
      3.100     1.200     1.200 peak  4481 spectrum    1 weight  0.10000E+01 volume  0.17535E-02 ppm1      2.914 ppm2      8.103 CV     1
 OR { 4481}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 137  and name H   ))
 ASSI { 4493}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 63   and name H   ))
      4.200     2.200     1.800 peak  4493 spectrum    1 weight  0.10000E+01 volume  0.75150E-03 ppm1      1.182 ppm2      8.472 CV     1
 OR { 4493}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 51   and name H   ))
 ASSI { 4503}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name H   ))
      3.400     1.500     1.500 peak  4503 spectrum    1 weight  0.10000E+01 volume  0.15064E-02 ppm1      4.373 ppm2      7.894 CV     1
 OR { 4503}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 3    and name H   ))
 ASSI { 4504}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 127  and name H   ))
      3.600     1.600     1.600 peak  4504 spectrum    1 weight  0.10000E+01 volume  0.12423E-02 ppm1      4.433 ppm2      7.831 CV     1
 OR { 4504}
   (( segid "    " and resid 1    and name HA  ))
   (( segid "    " and resid 3    and name H   ))
 ASSI { 4506}
   (( segid "    " and resid 178  and name HA  ))
   (( segid "    " and resid 177  and name HA2 ))
      4.100     2.100     1.900 peak  4506 spectrum    1 weight  0.10000E+01 volume  0.69056E-03 ppm1      4.892 ppm2      3.696 CV     1
 OR { 4506}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
 ASSI { 4522}
   (  segid "    " and resid 180  and name HD1%)
   (  segid "    " and resid 111  and name HE% )
      2.300     0.700     0.700 peak  4522 spectrum    1 weight  0.10000E+01 volume  0.64893E-02 ppm1      0.739 ppm2      1.942 CV     1
 OR { 4522}
   (  segid "    " and resid 180  and name HD1%)
   (( segid "    " and resid 180  and name HB2 ))
 ASSI { 4523}
   (  segid "    " and resid 180  and name HD2%)
   (  segid "    " and resid 111  and name HE% )
      2.600     0.900     0.900 peak  4523 spectrum    1 weight  0.10000E+01 volume  0.37235E-02 ppm1      0.595 ppm2      1.941 CV     1
 OR { 4523}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 180  and name HB2 ))
 ASSI { 4531}
   (( segid "    " and resid 181  and name HA  ))
   (( segid "    " and resid 182  and name H   ))
      3.400     1.500     1.500 peak  4531 spectrum    1 weight  0.10000E+01 volume  0.14150E-02 ppm1      3.975 ppm2      8.005 CV     1
 OR { 4531}
   (( segid "    " and resid 181  and name HA  ))
   (( segid "    " and resid 181  and name HE  ))
 ASSI { 4534}
   (( segid "    " and resid 181  and name HB2 ))
   (( segid "    " and resid 181  and name HE  ))
      3.500     1.500     1.500 peak  4534 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      2.092 ppm2      8.020 CV     1
 OR { 4534}
   (( segid "    " and resid 181  and name HB2 ))
   (( segid "    " and resid 182  and name H   ))
 ASSI { 4535}
   (( segid "    " and resid 181  and name HB3 ))
   (( segid "    " and resid 182  and name H   ))
      3.600     1.600     1.600 peak  4535 spectrum    1 weight  0.10000E+01 volume  0.10054E-02 ppm1      1.806 ppm2      8.020 CV     1
 OR { 4535}
   (( segid "    " and resid 181  and name HB3 ))
   (( segid "    " and resid 181  and name HE  ))
 ASSI { 4538}
   (( segid "    " and resid 189  and name HB3 ))
   (( segid "    " and resid 189  and name HA  ))
      3.200     1.300     1.300 peak  4538 spectrum    1 weight  0.10000E+01 volume  0.10088E-02 ppm1      1.826 ppm2      3.979 CV     1
 OR { 4538}
   (( segid "    " and resid 181  and name HB3 ))
   (( segid "    " and resid 181  and name HA  ))
 ASSI { 4546}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 174  and name H   ))
      3.600     1.600     1.600 peak  4546 spectrum    1 weight  0.10000E+01 volume  0.29314E-02 ppm1      0.664 ppm2      8.439 CV     1
 OR { 4546}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 131  and name H   ))
 ASSI { 4547}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 174  and name H   ))
      2.700     0.900     0.900 peak  4547 spectrum    1 weight  0.10000E+01 volume  0.47730E-02 ppm1      0.680 ppm2      8.441 CV     1
 OR { 4547}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 131  and name H   ))
 ASSI { 4549}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 177  and name H   ))
      3.300     1.300     1.300 peak  4549 spectrum    1 weight  0.10000E+01 volume  0.12051E-02 ppm1      0.665 ppm2      8.779 CV     1
 OR { 4549}
   (  segid "    " and resid 174  and name HD1%)
   (( segid "    " and resid 109  and name H   ))
 ASSI { 4641}
   (( segid "    " and resid 170  and name HB3 ))
   (( segid "    " and resid 171  and name H   ))
      2.400     0.700     0.700 peak  4641 spectrum    1 weight  0.10000E+01 volume  0.42008E-02 ppm1      1.936 ppm2      8.193 CV     1
 OR { 4641}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 65   and name H   ))
 ASSI { 4648}
   (( segid "    " and resid 170  and name HG2 ))
   (( segid "    " and resid 169  and name HA  ))
      4.200     2.200     1.800 peak  4648 spectrum    1 weight  0.10000E+01 volume  0.18889E-02 ppm1      2.146 ppm2      4.426 CV     1
 OR { 4648}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 169  and name HA  ))
 OR { 4648}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 169  and name HA  ))
 ASSI { 4657}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 133  and name HB2 ))
      2.800     1.000     1.000 peak  4657 spectrum    1 weight  0.10000E+01 volume  0.48474E-02 ppm1      2.140 ppm2      1.581 CV     1
 OR { 4657}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR { 4657}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 137  and name HD3 ))
 ASSI { 4659}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 137  and name HG3 ))
      3.000     1.100     1.100 peak  4659 spectrum    1 weight  0.10000E+01 volume  0.36863E-02 ppm1      2.142 ppm2      1.337 CV     1
 OR { 4659}
   (( segid "    " and resid 170  and name HG3 ))
   (( segid "    " and resid 138  and name HG2 ))
 ASSI { 4661}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 138  and name HG3 ))
      4.000     2.000     2.000 peak  4661 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      1.793 ppm2      1.359 CV     1
 OR { 4661}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 171  and name HB2 ))
 ASSI { 4667}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 25   and name HG1%)
      3.500     1.500     1.500 peak  4667 spectrum    1 weight  0.10000E+01 volume  0.11442E-02 ppm1      4.213 ppm2      0.709 CV     1
 OR { 4667}
   (( segid "    " and resid 170  and name HA  ))
   (  segid "    " and resid 171  and name HD1%)
 ASSI { 4673}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 46   and name HA  ))
      2.200     0.600     0.600 peak  4673 spectrum    1 weight  0.10000E+01 volume  0.94682E-02 ppm1      2.596 ppm2      4.453 CV     1
 OR { 4673}
   (( segid "    " and resid 169  and name HB2 ))
   (( segid "    " and resid 169  and name HA  ))
 ASSI { 4686}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 138  and name H   ))
      2.100     0.600     0.600 peak  4686 spectrum    1 weight  0.10000E+01 volume  0.54026E-02 ppm1      1.695 ppm2      8.107 CV     1
 OR { 4686}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name H   ))
 ASSI { 4690}
   (( segid "    " and resid 138  and name HG3 ))
   (( segid "    " and resid 169  and name H   ))
      4.100     2.100     1.900 peak  4690 spectrum    1 weight  0.10000E+01 volume  0.10697E-02 ppm1      1.344 ppm2      8.324 CV     1
 OR { 4690}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 169  and name H   ))
 OR { 4690}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 136  and name H   ))
 ASSI { 4692}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name H   ))
      2.800     1.000     1.000 peak  4692 spectrum    1 weight  0.10000E+01 volume  0.23865E-02 ppm1      1.345 ppm2      8.098 CV     1
 OR { 4692}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 138  and name H   ))
 OR { 4692}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 138  and name H   ))
 ASSI { 4693}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name H   ))
      3.700     1.700     1.700 peak  4693 spectrum    1 weight  0.10000E+01 volume  0.23019E-02 ppm1      1.313 ppm2      8.098 CV     1
 OR { 4693}
   (( segid "    " and resid 138  and name HG2 ))
   (( segid "    " and resid 138  and name H   ))
 OR { 4693}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 138  and name H   ))
 ASSI { 4704}
   (( segid "    " and resid 138  and name HB3 ))
   (( segid "    " and resid 138  and name HE3 ))
      4.100     2.100     1.900 peak  4704 spectrum    1 weight  0.10000E+01 volume  0.15334E-02 ppm1      1.796 ppm2      2.907 CV     1
 OR { 4704}
   (( segid "    " and resid 138  and name HB3 ))
   (( segid "    " and resid 138  and name HE2 ))
 OR { 4704}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR { 4704}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HE3 ))
 ASSI { 4705}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name HE2 ))
      3.500     1.500     1.500 peak  4705 spectrum    1 weight  0.10000E+01 volume  0.18990E-02 ppm1      1.692 ppm2      2.905 CV     1
 OR { 4705}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 55   and name HB2 ))
 OR { 4705}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR { 4705}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR { 4705}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 58   and name HE2 ))
 OR { 4705}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 58   and name HE3 ))
 ASSI { 4707}
   (( segid "    " and resid 98   and name HE2 ))
   (( segid "    " and resid 118  and name HG3 ))
      2.200     0.600     0.600 peak  4707 spectrum    1 weight  0.10000E+01 volume  0.49829E-02 ppm1      2.909 ppm2      1.787 CV     1
 OR { 4707}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HB3 ))
 ASSI { 4708}
   (( segid "    " and resid 58   and name HE3 ))
   (( segid "    " and resid 58   and name HD3 ))
      1.600     0.300     0.600 peak  4708 spectrum    1 weight  0.10000E+01 volume  0.61078E-01 ppm1      2.909 ppm2      1.597 CV     1
 OR { 4708}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HD3 ))
 OR { 4708}
   (( segid "    " and resid 138  and name HE3 ))
   (( segid "    " and resid 138  and name HD3 ))
 OR { 4708}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 138  and name HD2 ))
 OR { 4708}
   (( segid "    " and resid 137  and name HE3 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR { 4708}
   (( segid "    " and resid 58   and name HE2 ))
   (( segid "    " and resid 58   and name HD3 ))
 OR { 4708}
   (( segid "    " and resid 58   and name HE3 ))
   (( segid "    " and resid 58   and name HD2 ))
 OR { 4708}
   (( segid "    " and resid 138  and name HE3 ))
   (( segid "    " and resid 138  and name HD2 ))
 OR { 4708}
   (( segid "    " and resid 138  and name HE2 ))
   (( segid "    " and resid 138  and name HD3 ))
 OR { 4708}
   (( segid "    " and resid 58   and name HE2 ))
   (( segid "    " and resid 58   and name HD2 ))
 OR { 4708}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR { 4708}
   (( segid "    " and resid 137  and name HE3 ))
   (( segid "    " and resid 137  and name HD3 ))
 ASSI { 4710}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB3 ))
      2.300     0.700     0.700 peak  4710 spectrum    1 weight  0.10000E+01 volume  0.10890E-01 ppm1      4.197 ppm2      1.784 CV     1
 OR { 4710}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI { 4714}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 58   and name HG2 ))
      2.200     0.600     0.600 peak  4714 spectrum    1 weight  0.10000E+01 volume  0.11090E-01 ppm1      1.695 ppm2      1.332 CV     1
 OR { 4714}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HG3 ))
 OR { 4714}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name HG2 ))
 OR { 4714}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name HG3 ))
 OR { 4714}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HG2 ))
 ASSI { 4715}
   (( segid "    " and resid 98   and name HE3 ))
   (( segid "    " and resid 98   and name HG3 ))
      1.800     0.400     0.400 peak  4715 spectrum    1 weight  0.10000E+01 volume  0.29575E-01 ppm1      2.908 ppm2      1.317 CV     1
 OR { 4715}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR { 4715}
   (( segid "    " and resid 138  and name HE3 ))
   (( segid "    " and resid 138  and name HG3 ))
 ASSI { 4718}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name H   ))
      2.700     0.900     0.900 peak  4718 spectrum    1 weight  0.10000E+01 volume  0.27048E-02 ppm1      1.359 ppm2      8.122 CV     1
 OR { 4718}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 138  and name H   ))
 ASSI { 4722}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 86   and name HD3 ))
      4.600     2.600     1.400 peak  4722 spectrum    1 weight  0.10000E+01 volume  0.10629E-02 ppm1      4.258 ppm2      2.908 CV     1
 OR { 4722}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HE2 ))
 OR { 4722}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HE3 ))
 ASSI { 4727}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 138  and name H   ))
      2.000     0.500     0.500 peak  4727 spectrum    1 weight  0.10000E+01 volume  0.28707E-02 ppm1      1.982 ppm2      8.139 CV     1
 OR { 4727}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 137  and name H   ))
 ASSI { 4728}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 137  and name H   ))
      3.600     1.600     1.600 peak  4728 spectrum    1 weight  0.10000E+01 volume  0.26200E-02 ppm1      1.894 ppm2      8.139 CV     1
 OR { 4728}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 137  and name H   ))
 ASSI { 4733}
   (( segid "    " and resid 170  and name HG3 ))
   (( segid "    " and resid 170  and name HB3 ))
      1.900     0.400     0.400 peak  4733 spectrum    1 weight  0.10000E+01 volume  0.49831E-01 ppm1      2.146 ppm2      1.975 CV     1
 OR { 4733}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HB2 ))
 OR { 4733}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HB2 ))
 ASSI { 4734}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HB2 ))
      1.700     0.400     0.500 peak  4734 spectrum    1 weight  0.10000E+01 volume  0.37956E-01 ppm1      2.145 ppm2      1.906 CV     1
 OR { 4734}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HB3 ))
 OR { 4734}
   (( segid "    " and resid 170  and name HG3 ))
   (( segid "    " and resid 170  and name HB3 ))
 OR { 4734}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 135  and name HB2 ))
 ASSI { 4735}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HG2 ))
      1.900     0.400     0.400 peak  4735 spectrum    1 weight  0.10000E+01 volume  0.24481E-01 ppm1      1.897 ppm2      2.148 CV     1
 OR { 4735}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name HG2 ))
 OR { 4735}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HG3 ))
 OR { 4735}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name HG3 ))
 ASSI { 4742}
   (( segid "    " and resid 1    and name HG3 ))
   (( segid "    " and resid 1    and name HA  ))
      2.900     1.100     1.100 peak  4742 spectrum    1 weight  0.10000E+01 volume  0.46309E-02 ppm1      2.541 ppm2      4.411 CV     1
 OR { 4742}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI { 4744}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name HG3 ))
      1.500     0.300     0.700 peak  4744 spectrum    1 weight  0.10000E+01 volume  0.25510E-01 ppm1      2.411 ppm2      2.545 CV     1
 OR { 4744}
   (( segid "    " and resid 101  and name HG2 ))
   (( segid "    " and resid 101  and name HG3 ))
 ASSI { 4745}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name HB3 ))
      2.300     0.600     0.600 peak  4745 spectrum    1 weight  0.10000E+01 volume  0.59815E-02 ppm1      2.413 ppm2      1.908 CV     1
 OR { 4745}
   (( segid "    " and resid 101  and name HG2 ))
   (( segid "    " and resid 101  and name HB2 ))
 ASSI { 4748}
   (( segid "    " and resid 101  and name HG2 ))
   (  segid "    " and resid 100  and name HG2%)
      4.700     2.800     1.300 peak  4748 spectrum    1 weight  0.10000E+01 volume  0.83950E-03 ppm1      2.424 ppm2      0.692 CV     1
 OR { 4748}
   (( segid "    " and resid 101  and name HG2 ))
   (  segid "    " and resid 102  and name HG2%)
 ASSI { 4751}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 134  and name H   ))
      2.400     0.700     0.700 peak  4751 spectrum    1 weight  0.10000E+01 volume  0.38522E-02 ppm1      1.485 ppm2      8.197 CV     1
 OR { 4751}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name H   ))
 ASSI { 4753}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 134  and name H   ))
      2.200     0.600     0.600 peak  4753 spectrum    1 weight  0.10000E+01 volume  0.11513E-01 ppm1      4.301 ppm2      8.190 CV     1
 OR { 4753}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name H   ))
 ASSI { 4760}
   (( segid "    " and resid 133  and name HG  ))
   (( segid "    " and resid 133  and name HA  ))
      3.100     1.200     1.200 peak  4760 spectrum    1 weight  0.10000E+01 volume  0.30128E-02 ppm1      1.502 ppm2      4.299 CV     1
 OR { 4760}
   (( segid "    " and resid 4    and name HG  ))
   (( segid "    " and resid 3    and name HA  ))
 ASSI { 4761}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 131  and name HD3 ))
      3.900     1.900     1.900 peak  4761 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      0.826 ppm2      3.063 CV     1
 OR { 4761}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 33   and name HD2 ))
 OR { 4761}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 33   and name HD3 ))
 ASSI { 4767}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 189  and name HG3 ))
      3.400     1.400     1.400 peak  4767 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      1.484 ppm2      1.981 CV     1
 OR { 4767}
   (( segid "    " and resid 133  and name HB3 ))
   (  segid "    " and resid 134  and name HE% )
 ASSI { 4770}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 135  and name HB2 ))
      3.800     1.800     1.800 peak  4770 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      1.578 ppm2      1.905 CV     1
 OR { 4770}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 134  and name HB3 ))
 ASSI { 4771}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 131  and name HB3 ))
      1.600     0.300     0.600 peak  4771 spectrum    1 weight  0.10000E+01 volume  0.31782E-01 ppm1      0.826 ppm2      1.497 CV     1
 OR { 4771}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 133  and name HG  ))
 OR { 4771}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HB3 ))
 ASSI { 4796}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 191  and name HA  ))
      4.400     2.400     1.600 peak  4796 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      1.530 ppm2      4.863 CV     1
 OR { 4796}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 4803}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 47   and name HE% )
      3.600     1.600     1.600 peak  4803 spectrum    1 weight  0.10000E+01 volume  0.11137E-02 ppm1      3.524 ppm2      7.113 CV     1
 OR { 4803}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 85   and name H   ))
 ASSI { 4824}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HB3 ))
      2.300     0.700     0.700 peak  4824 spectrum    1 weight  0.10000E+01 volume  0.53519E-02 ppm1      0.913 ppm2      1.531 CV     1
 OR { 4824}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 85   and name HB2 ))
 OR { 4824}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 83   and name HB3 ))
 ASSI { 4834}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 82   and name HE  ))
      4.300     2.300     1.700 peak  4834 spectrum    1 weight  0.10000E+01 volume  0.77181E-03 ppm1      1.529 ppm2      6.694 CV     1
 OR { 4834}
   (( segid "    " and resid 83   and name HB3 ))
   (  segid "    " and resid 47   and name HD% )
 ASSI { 4835}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 85   and name H   ))
      3.900     1.900     1.900 peak  4835 spectrum    1 weight  0.10000E+01 volume  0.14793E-02 ppm1      1.533 ppm2      7.103 CV     1
 OR { 4835}
   (( segid "    " and resid 83   and name HB3 ))
   (  segid "    " and resid 47   and name HE% )
 ASSI { 4840}
   (( segid "    " and resid 83   and name HD3 ))
   (  segid "    " and resid 47   and name HE% )
      3.300     1.300     1.300 peak  4840 spectrum    1 weight  0.10000E+01 volume  0.28808E-02 ppm1      1.453 ppm2      7.116 CV     1
 OR { 4840}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 85   and name H   ))
 OR { 4840}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 85   and name H   ))
 ASSI { 4851}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 126  and name H   ))
      4.200     2.200     1.800 peak  4851 spectrum    1 weight  0.10000E+01 volume  0.11171E-02 ppm1      2.402 ppm2      7.677 CV     1
 OR { 4851}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 124  and name H   ))
 ASSI { 4874}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 119  and name HG13))
      3.000     1.100     1.100 peak  4874 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      2.584 ppm2      1.304 CV     1
 OR { 4874}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 98   and name HG2 ))
 ASSI { 4875}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HG  ))
      2.700     0.900     0.900 peak  4875 spectrum    1 weight  0.10000E+01 volume  0.34697E-02 ppm1      4.610 ppm2      1.293 CV     1
 OR { 4875}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HG3 ))
 ASSI { 4900}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 111  and name HB2 ))
      2.400     0.700     0.700 peak  4900 spectrum    1 weight  0.10000E+01 volume  0.56972E-02 ppm1      1.951 ppm2      1.700 CV     1
 OR { 4900}
   (  segid "    " and resid 111  and name HE% )
   (( segid "    " and resid 180  and name HG  ))
 ASSI { 4918}
   (( segid "    " and resid 87   and name HD3 ))
   (  segid "    " and resid 101  and name HE% )
      2.900     1.100     1.100 peak  4918 spectrum    1 weight  0.10000E+01 volume  0.23188E-02 ppm1      3.515 ppm2      1.749 CV     1
 OR { 4918}
   (( segid "    " and resid 87   and name HD3 ))
   (( segid "    " and resid 86   and name HB2 ))
 OR { 4918}
   (( segid "    " and resid 87   and name HD3 ))
   (( segid "    " and resid 86   and name HB3 ))
 ASSI { 4922}
   (( segid "    " and resid 91   and name HB2 ))
   (  segid "    " and resid 97   and name HG2%)
      3.300     1.400     1.400 peak  4922 spectrum    1 weight  0.10000E+01 volume  0.97830E-03 ppm1      1.375 ppm2      0.696 CV     1
 OR { 4922}
   (( segid "    " and resid 91   and name HB2 ))
   (  segid "    " and resid 192  and name HD2%)
 ASSI { 4940}
   (( segid "    " and resid 194  and name HB3 ))
   (( segid "    " and resid 173  and name HZ3 ))
      3.800     1.800     1.800 peak  4940 spectrum    1 weight  0.10000E+01 volume  0.10155E-02 ppm1      1.718 ppm2      6.714 CV     1
 OR { 4940}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 82   and name HE  ))
 ASSI { 4947}
   (( segid "    " and resid 101  and name HB3 ))
   (( segid "    " and resid 102  and name H   ))
      4.200     2.200     1.800 peak  4947 spectrum    1 weight  0.10000E+01 volume  0.79213E-03 ppm1      1.562 ppm2      8.823 CV     1
 OR { 4947}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 4951}
   (( segid "    " and resid 101  and name HB3 ))
   (( segid "    " and resid 101  and name HA  ))
      3.000     1.100     1.100 peak  4951 spectrum    1 weight  0.10000E+01 volume  0.11611E-02 ppm1      1.583 ppm2      4.875 CV     1
 OR { 4951}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI { 4964}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 127  and name H   ))
      4.300     2.300     1.700 peak  4964 spectrum    1 weight  0.10000E+01 volume  0.63978E-03 ppm1      1.839 ppm2      7.843 CV     1
 OR { 4964}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 199  and name H   ))
 ASSI { 4991}
   (( segid "    " and resid 106  and name HD2 ))
   (( segid "    " and resid 106  and name HB3 ))
      3.900     1.900     1.900 peak  4991 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      1.456 ppm2      1.937 CV     1
 OR { 4991}
   (( segid "    " and resid 106  and name HD2 ))
   (  segid "    " and resid 111  and name HE% )
 ASSI { 4992}
   (( segid "    " and resid 106  and name HD2 ))
   (( segid "    " and resid 111  and name HG3 ))
      4.000     2.000     2.000 peak  4992 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      1.464 ppm2      2.267 CV     1
 OR { 4992}
   (( segid "    " and resid 106  and name HD2 ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI { 5005}
   (( segid "    " and resid 15   and name HD2 ))
   (( segid "    " and resid 15   and name HE3 ))
      2.700     0.900     0.900 peak  5005 spectrum    1 weight  0.10000E+01 volume  0.32294E-02 ppm1      1.545 ppm2      2.750 CV     1
 OR { 5005}
   (( segid "    " and resid 106  and name HD3 ))
   (( segid "    " and resid 106  and name HE2 ))
 OR { 5005}
   (( segid "    " and resid 15   and name HD2 ))
   (( segid "    " and resid 15   and name HE2 ))
 ASSI { 5025}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 192  and name H   ))
      4.000     2.000     2.000 peak  5025 spectrum    1 weight  0.10000E+01 volume  0.66009E-03 ppm1      4.436 ppm2      9.052 CV     1
 OR { 5025}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HE  ))
 ASSI { 5068}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 91   and name HA  ))
      2.900     1.100     1.100 peak  5068 spectrum    1 weight  0.10000E+01 volume  0.24643E-02 ppm1      1.909 ppm2      4.865 CV     1
 OR { 5068}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 97   and name HA  ))
 ASSI { 5110}
   (( segid "    " and resid 33   and name HG2 ))
   (  segid "    " and resid 40   and name HD2%)
      4.100     2.100     1.900 peak  5110 spectrum    1 weight  0.10000E+01 volume  0.73457E-03 ppm1      1.151 ppm2      0.731 CV     1
 OR { 5110}
   (( segid "    " and resid 33   and name HG3 ))
   (  segid "    " and resid 32   and name HG2%)
 OR { 5110}
   (( segid "    " and resid 33   and name HG2 ))
   (  segid "    " and resid 32   and name HG2%)
 ASSI { 5120}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 21   and name HD3 ))
      3.100     1.200     1.200 peak  5120 spectrum    1 weight  0.10000E+01 volume  0.25861E-02 ppm1      2.326 ppm2      3.787 CV     1
 OR { 5120}
   (( segid "    " and resid 43   and name HB3 ))
   (( segid "    " and resid 44   and name HD2 ))
 ASSI { 5132}
   (( segid "    " and resid 89   and name HB3 ))
   (  segid "    " and resid 190  and name HG2%)
      3.400     1.400     1.400 peak  5132 spectrum    1 weight  0.10000E+01 volume  0.19194E-02 ppm1      1.824 ppm2      0.916 CV     1
 OR { 5132}
   (( segid "    " and resid 89   and name HB2 ))
   (  segid "    " and resid 190  and name HG2%)
 OR { 5132}
   (( segid "    " and resid 97   and name HB  ))
   (  segid "    " and resid 190  and name HG2%)
 ASSI { 5134}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 90   and name H   ))
      4.400     2.400     1.600 peak  5134 spectrum    1 weight  0.10000E+01 volume  0.78535E-03 ppm1      1.270 ppm2      8.812 CV     1
 OR { 5134}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 90   and name H   ))
 ASSI { 5137}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 98   and name HB3 ))
      2.200     0.600     0.600 peak  5137 spectrum    1 weight  0.10000E+01 volume  0.69023E-02 ppm1      1.279 ppm2      1.515 CV     1
 OR { 5137}
   (( segid "    " and resid 15   and name HG3 ))
   (( segid "    " and resid 15   and name HB2 ))
 OR { 5137}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 15   and name HB2 ))
 OR { 5137}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HD3 ))
 ASSI { 5138}
   (( segid "    " and resid 15   and name HG2 ))
   (( segid "    " and resid 15   and name HB2 ))
      2.300     0.700     0.700 peak  5138 spectrum    1 weight  0.10000E+01 volume  0.80463E-02 ppm1      1.319 ppm2      1.491 CV     1
 OR { 5138}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HD2 ))
 OR { 5138}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HD3 ))
 OR { 5138}
   (( segid "    " and resid 98   and name HG3 ))
   (( segid "    " and resid 98   and name HB3 ))
 ASSI { 5159}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 126  and name H   ))
      3.300     1.300     1.300 peak  5159 spectrum    1 weight  0.10000E+01 volume  0.14116E-02 ppm1      2.127 ppm2      7.676 CV     1
 OR { 5159}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 123  and name HD21))
 ASSI { 5178}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 10   and name HG2%)
      3.900     1.900     1.900 peak  5178 spectrum    1 weight  0.10000E+01 volume  0.80228E-03 ppm1      1.797 ppm2      0.905 CV     1
 OR { 5178}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 13   and name HG1%)
 ASSI { 5190}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 124  and name HD2 ))
      3.600     1.600     1.600 peak  5190 spectrum    1 weight  0.10000E+01 volume  0.84288E-03 ppm1      2.306 ppm2      7.079 CV     1
 OR { 5190}
   (( segid "    " and resid 43   and name HB3 ))
   (  segid "    " and resid 47   and name HE% )
 ASSI { 5195}
   (( segid "    " and resid 126  and name HG3 ))
   (  segid "    " and resid 199  and name HE% )
      4.600     2.700     1.400 peak  5195 spectrum    1 weight  0.10000E+01 volume  0.57887E-03 ppm1      2.126 ppm2      6.627 CV     1
 OR { 5195}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 123  and name HD22))
 ASSI { 5196}
   (( segid "    " and resid 126  and name HG2 ))
   (  segid "    " and resid 199  and name HE% )
      4.200     2.200     1.800 peak  5196 spectrum    1 weight  0.10000E+01 volume  0.59915E-03 ppm1      1.785 ppm2      6.606 CV     1
 OR { 5196}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 123  and name HD22))
 ASSI { 5198}
   (( segid "    " and resid 194  and name HG3 ))
   (( segid "    " and resid 194  and name HE  ))
      3.600     1.700     1.700 peak  5198 spectrum    1 weight  0.10000E+01 volume  0.71426E-03 ppm1      1.432 ppm2      7.331 CV     1
 OR { 5198}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HE  ))
 OR { 5198}
   (( segid "    " and resid 194  and name HG2 ))
   (( segid "    " and resid 194  and name HE  ))
 ASSI { 5233}
   (( segid "    " and resid 106  and name HG3 ))
   (( segid "    " and resid 106  and name HG2 ))
      2.000     0.500     0.500 peak  5233 spectrum    1 weight  0.10000E+01 volume  0.46208E-02 ppm1      1.143 ppm2      1.327 CV     1
 OR { 5233}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name HB3 ))
 ASSI { 5234}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HB3 ))
      2.600     0.900     0.900 peak  5234 spectrum    1 weight  0.10000E+01 volume  0.45293E-02 ppm1      1.320 ppm2      1.821 CV     1
 OR { 5234}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HB2 ))
 OR { 5234}
   (( segid "    " and resid 106  and name HG2 ))
   (( segid "    " and resid 106  and name HB2 ))
 ASSI { 5235}
   (( segid "    " and resid 106  and name HG2 ))
   (( segid "    " and resid 106  and name HB3 ))
      2.700     0.900     0.900 peak  5235 spectrum    1 weight  0.10000E+01 volume  0.23933E-02 ppm1      1.320 ppm2      1.948 CV     1
 OR { 5235}
   (( segid "    " and resid 98   and name HG3 ))
   (  segid "    " and resid 92   and name HE% )
 ASSI { 5244}
   (( segid "    " and resid 63   and name HG3 ))
   (  segid "    " and resid 25   and name HG2%)
      3.800     1.800     1.800 peak  5244 spectrum    1 weight  0.10000E+01 volume  0.20243E-02 ppm1      2.284 ppm2      0.999 CV     1
 OR { 5244}
   (( segid "    " and resid 63   and name HG3 ))
   (( segid "    " and resid 66   and name HG3 ))
 ASSI { 5251}
   (( segid "    " and resid 131  and name HD2 ))
   (( segid "    " and resid 185  and name HB  ))
      4.000     2.000     2.000 peak  5251 spectrum    1 weight  0.10000E+01 volume  0.11205E-02 ppm1      2.961 ppm2      1.655 CV     1
 OR { 5251}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 68   and name HG  ))
 ASSI { 5257}
   (( segid "    " and resid 194  and name HD3 ))
   (( segid "    " and resid 173  and name HH2 ))
      4.100     2.100     1.900 peak  5257 spectrum    1 weight  0.10000E+01 volume  0.11679E-02 ppm1      2.976 ppm2      6.841 CV     1
 OR { 5257}
   (( segid "    " and resid 91   and name HD2 ))
   (( segid "    " and resid 91   and name HH22))
 ASSI { 5279}
   (( segid "    " and resid 74   and name HB2 ))
   (  segid "    " and resid 4    and name HD2%)
      3.600     1.600     1.600 peak  5279 spectrum    1 weight  0.10000E+01 volume  0.15301E-02 ppm1      1.728 ppm2      0.705 CV     1
 OR { 5279}
   (( segid "    " and resid 111  and name HB2 ))
   (  segid "    " and resid 102  and name HG1%)
 OR { 5279}
   (( segid "    " and resid 74   and name HB2 ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 5283}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name H   ))
      3.400     1.500     1.500 peak  5283 spectrum    1 weight  0.10000E+01 volume  0.69733E-03 ppm1      1.435 ppm2      7.135 CV     1
 OR { 5283}
   (( segid "    " and resid 8    and name HG12))
   (  segid "    " and resid 19   and name HE% )
 ASSI { 5284}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 8    and name HA  ))
      3.900     1.900     1.900 peak  5284 spectrum    1 weight  0.10000E+01 volume  0.79890E-03 ppm1      5.164 ppm2      4.903 CV     1
 OR { 5284}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 79   and name HA  ))
 ASSI { 5286}
   (( segid "    " and resid 132  and name HA  ))
   (  segid "    " and resid 133  and name HD2%)
      4.000     2.000     2.000 peak  5286 spectrum    1 weight  0.10000E+01 volume  0.11814E-02 ppm1      4.120 ppm2      0.795 CV     1
 OR { 5286}
   (( segid "    " and resid 135  and name HA  ))
   (  segid "    " and resid 133  and name HD1%)
 OR { 5286}
   (( segid "    " and resid 132  and name HA  ))
   (  segid "    " and resid 133  and name HD1%)
 ASSI { 5294}
   (( segid "    " and resid 131  and name HD3 ))
   (( segid "    " and resid 131  and name HB2 ))
      2.600     0.800     0.800 peak  5294 spectrum    1 weight  0.10000E+01 volume  0.25185E-02 ppm1      3.087 ppm2      2.000 CV     1
 OR { 5294}
   (( segid "    " and resid 178  and name HD3 ))
   (( segid "    " and resid 178  and name HB3 ))
 ASSI { 5295}
   (( segid "    " and resid 131  and name HD3 ))
   (( segid "    " and resid 131  and name HB2 ))
      2.600     0.900     0.900 peak  5295 spectrum    1 weight  0.10000E+01 volume  0.23493E-02 ppm1      3.045 ppm2      1.998 CV     1
 OR { 5295}
   (( segid "    " and resid 178  and name HD2 ))
   (( segid "    " and resid 178  and name HB3 ))
 ASSI { 5336}
   (( segid "    " and resid 185  and name HB  ))
   (( segid "    " and resid 185  and name HA  ))
      3.200     1.300     1.300 peak  5336 spectrum    1 weight  0.10000E+01 volume  0.10494E-02 ppm1      1.687 ppm2      3.845 CV     1
 OR { 5336}
   (( segid "    " and resid 186  and name HB3 ))
   (( segid "    " and resid 187  and name HA  ))
 ASSI { 5355}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HG2 ))
      3.900     1.900     1.900 peak  5355 spectrum    1 weight  0.10000E+01 volume  0.94445E-03 ppm1      1.974 ppm2      2.723 CV     1
 OR { 5355}
   (( segid "    " and resid 106  and name HB3 ))
   (( segid "    " and resid 110  and name HB2 ))
 ASSI { 5356}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB2 ))
      3.100     1.200     1.200 peak  5356 spectrum    1 weight  0.10000E+01 volume  0.24542E-02 ppm1      3.873 ppm2      1.967 CV     1
 OR { 5356}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI { 5371}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 85   and name HE21))
      4.200     2.200     1.800 peak  5371 spectrum    1 weight  0.10000E+01 volume  0.59238E-03 ppm1      2.650 ppm2      6.474 CV     1
 OR { 5371}
   (( segid "    " and resid 46   and name HB3 ))
   (( segid "    " and resid 85   and name HE21))
 ASSI { 5379}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name H   ))
      3.700     1.700     1.700 peak  5379 spectrum    1 weight  0.10000E+01 volume  0.26944E-02 ppm1      0.821 ppm2      8.892 CV     1
 OR { 5379}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 10   and name H   ))
 ASSI { 5382}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 126  and name H   ))
      3.000     1.100     1.100 peak  5382 spectrum    1 weight  0.10000E+01 volume  0.15775E-02 ppm1      1.809 ppm2      7.680 CV     1
 OR { 5382}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 123  and name HD21))
 ASSI { 5394}
   (( segid "    " and resid 183  and name HB2 ))
   (( segid "    " and resid 184  and name H   ))
      3.700     1.700     1.700 peak  5394 spectrum    1 weight  0.10000E+01 volume  0.67025E-03 ppm1      2.125 ppm2      7.680 CV     1
 OR { 5394}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 126  and name H   ))
 ASSI { 5411}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name H   ))
      2.300     0.700     0.700 peak  5411 spectrum    1 weight  0.10000E+01 volume  0.24643E-02 ppm1      2.537 ppm2      8.151 CV     1
 OR { 5411}
   (( segid "    " and resid 1    and name HG3 ))
   (( segid "    " and resid 1    and name H   ))
 ASSI { 5424}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 175  and name HA  ))
      4.400     2.400     1.600 peak  5424 spectrum    1 weight  0.10000E+01 volume  0.82595E-03 ppm1      4.267 ppm2      4.652 CV     1
 OR { 5424}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 173  and name HA  ))
 ASSI { 5441}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 101  and name HB2 ))
      2.400     2.400     3.600 peak  5441 spectrum    1 weight  0.10000E+01 volume  0.15094E-01 ppm1      0.636 ppm2      1.905 CV     1
 OR { 5441}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 5475}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 53   and name HB2 ))
      4.500     2.500     1.500 peak  5475 spectrum    1 weight  0.10000E+01 volume  0.10528E-02 ppm1      3.711 ppm2      2.138 CV     1
 OR { 5475}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 5475}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 50   and name HB3 ))
 OR { 5475}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 50   and name HB3 ))
 OR { 5475}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 79   and name HG3 ))
 OR { 5475}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 79   and name HG2 ))
 OR { 5475}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 79   and name HG3 ))
 ASSI { 5476}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 174  and name HB2 ))
      4.300     2.300     1.700 peak  5476 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      3.712 ppm2      1.282 CV     1
 OR { 5476}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 106  and name HG2 ))
 OR { 5476}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 174  and name HB2 ))
 OR { 5476}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 51   and name HG  ))
 OR { 5476}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 51   and name HG  ))
 OR { 5476}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 60   and name HG13))
 ASSI { 5479}
   (( segid "    " and resid 194  and name HG2 ))
   (  segid "    " and resid 93   and name HD1%)
      4.000     2.000     2.000 peak  5479 spectrum    1 weight  0.10000E+01 volume  0.18855E-02 ppm1      1.434 ppm2      0.953 CV     1
 OR { 5479}
   (( segid "    " and resid 8    and name HG12))
   (( segid "    " and resid 32   and name HG13))
 OR { 5479}
   (( segid "    " and resid 8    and name HG12))
   (  segid "    " and resid 16   and name HG2%)
 OR { 5479}
   (( segid "    " and resid 8    and name HG12))
   (( segid "    " and resid 32   and name HG12))
 ASSI { 5480}
   (( segid "    " and resid 79   and name HG3 ))
   (  segid "    " and resid 51   and name HD2%)
      2.500     0.800     0.800 peak  5480 spectrum    1 weight  0.10000E+01 volume  0.79381E-02 ppm1      2.146 ppm2      0.726 CV     1
 OR { 5480}
   (( segid "    " and resid 79   and name HG2 ))
   (  segid "    " and resid 51   and name HD2%)
 OR { 5480}
   (( segid "    " and resid 79   and name HG2 ))
   (  segid "    " and resid 8    and name HD1%)
 OR { 5480}
   (( segid "    " and resid 79   and name HG3 ))
   (  segid "    " and resid 8    and name HD1%)
 ASSI { 5481}
   (( segid "    " and resid 186  and name HG3 ))
   (  segid "    " and resid 133  and name HD1%)
      4.000     2.000     2.000 peak  5481 spectrum    1 weight  0.10000E+01 volume  0.15233E-02 ppm1      2.397 ppm2      0.757 CV     1
 OR { 5481}
   (( segid "    " and resid 63   and name HG2 ))
   (  segid "    " and resid 25   and name HG1%)
 OR { 5481}
   (( segid "    " and resid 63   and name HG2 ))
   (  segid "    " and resid 49   and name HD1%)
 ASSI { 5482}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 51   and name HG  ))
      3.400     1.400     1.400 peak  5482 spectrum    1 weight  0.10000E+01 volume  0.17196E-02 ppm1      2.151 ppm2      1.310 CV     1
 OR { 5482}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 49   and name HB3 ))
 OR { 5482}
   (( segid "    " and resid 79   and name HG3 ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI { 5484}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 189  and name H   ))
      4.000     2.000     2.000 peak  5484 spectrum    1 weight  0.10000E+01 volume  0.17433E-02 ppm1      0.755 ppm2      6.937 CV     1
 OR { 5484}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 19   and name HZ  ))
 OR { 5484}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 19   and name HZ  ))
 ASSI { 5485}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 8    and name HA  ))
      3.800     1.800     1.800 peak  5485 spectrum    1 weight  0.10000E+01 volume  0.20107E-02 ppm1      0.744 ppm2      4.866 CV     1
 OR { 5485}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 101  and name HA  ))
 OR { 5485}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 67   and name HA  ))
 ASSI { 5487}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 63   and name HG2 ))
      4.000     2.000     2.000 peak  5487 spectrum    1 weight  0.10000E+01 volume  0.14150E-02 ppm1      0.756 ppm2      2.387 CV     1
 OR { 5487}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 84   and name HE2 ))
 OR { 5487}
   (  segid "    " and resid 185  and name HG2%)
   (( segid "    " and resid 186  and name HG3 ))
 ASSI { 5488}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 49   and name HB3 ))
      3.500     1.600     1.600 peak  5488 spectrum    1 weight  0.10000E+01 volume  0.42719E-02 ppm1      0.749 ppm2      1.259 CV     1
 OR { 5488}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 15   and name HG2 ))
 OR { 5488}
   (  segid "    " and resid 102  and name HG1%)
   (( segid "    " and resid 100  and name HG12))
 OR { 5488}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 15   and name HG3 ))
 ASSI { 5490}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 98   and name HG2 ))
      3.500     1.500     1.500 peak  5490 spectrum    1 weight  0.10000E+01 volume  0.20514E-02 ppm1      1.075 ppm2      1.281 CV     1
 OR { 5490}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 98   and name HG3 ))
 OR { 5490}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 119  and name HG13))
 ASSI { 5494}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 129  and name HB3 ))
      2.800     1.000     1.000 peak  5494 spectrum    1 weight  0.10000E+01 volume  0.69800E-02 ppm1      0.488 ppm2      1.511 CV     1
 OR { 5494}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 112  and name HG  ))
 OR { 5494}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 192  and name HB3 ))
 OR { 5494}
   (  segid "    " and resid 130  and name HG2%)
   (( segid "    " and resid 194  and name HB2 ))
 ASSI { 5495}
   (  segid "    " and resid 129  and name HD2%)
   (  segid "    " and resid 108  and name HG2%)
      3.700     1.800     1.800 peak  5495 spectrum    1 weight  0.10000E+01 volume  0.30805E-02 ppm1      0.637 ppm2      0.930 CV     1
 OR { 5495}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 196  and name HB2 ))
 OR { 5495}
   (  segid "    " and resid 112  and name HD2%)
   (  segid "    " and resid 108  and name HG2%)
 OR { 5495}
   (  segid "    " and resid 112  and name HD2%)
   (  segid "    " and resid 93   and name HD1%)
 ASSI { 5498}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 90   and name HB  ))
      3.300     1.300     1.300 peak  5498 spectrum    1 weight  0.10000E+01 volume  0.73152E-02 ppm1      0.642 ppm2      1.631 CV     1
 OR { 5498}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 112  and name HB2 ))
 OR { 5498}
   (  segid "    " and resid 115  and name HD1%)
   (( segid "    " and resid 191  and name HB2 ))
 ASSI { 5499}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 113  and name H   ))
      4.000     2.000     2.000 peak  5499 spectrum    1 weight  0.10000E+01 volume  0.19634E-02 ppm1      0.683 ppm2      7.652 CV     1
 OR { 5499}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 126  and name H   ))
 OR { 5499}
   (  segid "    " and resid 171  and name HD1%)
   (( segid "    " and resid 173  and name H   ))
 ASSI { 5500}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 3    and name H   ))
      4.000     2.000     2.000 peak  5500 spectrum    1 weight  0.10000E+01 volume  0.17230E-02 ppm1      0.746 ppm2      7.830 CV     1
 OR { 5500}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 72   and name H   ))
 OR { 5500}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 127  and name H   ))
 OR { 5500}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 124  and name HE1 ))
 ASSI { 5502}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 75   and name H   ))
      3.700     1.700     1.700 peak  5502 spectrum    1 weight  0.10000E+01 volume  0.18043E-02 ppm1      0.746 ppm2      8.352 CV     1
 OR { 5502}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 116  and name H   ))
 OR { 5502}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 68   and name H   ))
 ASSI { 5503}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 73   and name HA  ))
      4.000     2.000     2.000 peak  5503 spectrum    1 weight  0.10000E+01 volume  0.18347E-02 ppm1      0.732 ppm2      4.223 CV     1
 OR { 5503}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 28   and name HA  ))
 OR { 5503}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 63   and name HA  ))
 OR { 5503}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 114  and name HB  ))
 OR { 5503}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 5504}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 124  and name HB3 ))
      4.300     2.300     1.700 peak  5504 spectrum    1 weight  0.10000E+01 volume  0.16384E-02 ppm1      0.747 ppm2      3.050 CV     1
 OR { 5504}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 176  and name HB2 ))
 ASSI { 5506}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 66   and name HE2 ))
      4.500     2.500     1.500 peak  5506 spectrum    1 weight  0.10000E+01 volume  0.20446E-02 ppm1      0.747 ppm2      2.293 CV     1
 OR { 5506}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 66   and name HE3 ))
 OR { 5506}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 108  and name HB  ))
 ASSI { 5509}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 118  and name HB2 ))
      3.500     1.600     1.600 peak  5509 spectrum    1 weight  0.10000E+01 volume  0.48779E-02 ppm1      0.686 ppm2      1.908 CV     1
 OR { 5509}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 118  and name HB3 ))
 OR { 5509}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 101  and name HB2 ))
 OR { 5509}
   (  segid "    " and resid 100  and name HG2%)
   (  segid "    " and resid 92   and name HE% )
 ASSI { 5510}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 111  and name HG2 ))
      4.400     2.400     1.600 peak  5510 spectrum    1 weight  0.10000E+01 volume  0.13337E-02 ppm1      0.638 ppm2      2.580 CV     1
 OR { 5510}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 103  and name HB3 ))
 ASSI { 5511}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 111  and name HG3 ))
      4.100     2.100     1.900 peak  5511 spectrum    1 weight  0.10000E+01 volume  0.14048E-02 ppm1      0.636 ppm2      2.244 CV     1
 OR { 5511}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 111  and name HG3 ))
 ASSI { 5512}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 114  and name HA  ))
      4.400     2.400     1.600 peak  5512 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      0.686 ppm2      3.833 CV     1
 OR { 5512}
   (  segid "    " and resid 100  and name HG2%)
   (( segid "    " and resid 112  and name HA  ))
 ASSI { 5514}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 102  and name HA  ))
      3.000     1.100     1.100 peak  5514 spectrum    1 weight  0.10000E+01 volume  0.37574E-02 ppm1      0.635 ppm2      4.621 CV     1
 OR { 5514}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 89   and name HA  ))
 OR { 5514}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 5516}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 114  and name H   ))
      4.600     2.600     1.400 peak  5516 spectrum    1 weight  0.10000E+01 volume  0.18855E-02 ppm1      0.637 ppm2      7.460 CV     1
 OR { 5516}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 119  and name H   ))
 ASSI { 5517}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 87   and name HG2 ))
      2.300     2.300     3.700 peak  5517 spectrum    1 weight  0.10000E+01 volume  0.26642E-02 ppm1      0.905 ppm2      2.086 CV     1
 OR { 5517}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 85   and name HG3 ))
 ASSI { 5518}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 98   and name HB2 ))
      3.700     1.700     1.700 peak  5518 spectrum    1 weight  0.10000E+01 volume  0.42076E-02 ppm1      0.821 ppm2      1.651 CV     1
 OR { 5518}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name HG2 ))
 ASSI { 5519}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 194  and name HD2 ))
      3.900     1.900     1.900 peak  5519 spectrum    1 weight  0.10000E+01 volume  0.21732E-02 ppm1      0.961 ppm2      2.994 CV     1
 OR { 5519}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 116  and name HB2 ))
 OR { 5519}
   (  segid "    " and resid 93   and name HD2%)
   (( segid "    " and resid 194  and name HD3 ))
 ASSI { 5522}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 181  and name HD3 ))
      4.200     2.200     1.800 peak  5522 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      0.790 ppm2      3.166 CV     1
 OR { 5522}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 61   and name HB3 ))
 ASSI { 5523}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 21   and name HB2 ))
      3.700     1.700     1.700 peak  5523 spectrum    1 weight  0.10000E+01 volume  0.20175E-02 ppm1      0.739 ppm2      2.054 CV     1
 OR { 5523}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 72   and name HB2 ))
 OR { 5523}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 18   and name HG2 ))
 OR { 5523}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 2    and name HB  ))
 OR { 5523}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 63   and name HB3 ))
 OR { 5523}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 80   and name HG2 ))
 OR { 5523}
   (  segid "    " and resid 49   and name HD1%)
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 5525}
   (  segid "    " and resid 40   and name HD2%)
   (  segid "    " and resid 39   and name HB% )
      3.800     1.800     1.800 peak  5525 spectrum    1 weight  0.10000E+01 volume  0.48880E-02 ppm1      0.734 ppm2      1.121 CV     1
 OR { 5525}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 33   and name HG3 ))
 ASSI { 5526}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 6    and name HB2 ))
      3.500     1.600     1.600 peak  5526 spectrum    1 weight  0.10000E+01 volume  0.28671E-02 ppm1      0.835 ppm2      1.347 CV     1
 OR { 5526}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 41   and name HB% )
 OR { 5526}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 73   and name HB3 ))
 ASSI { 5527}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 20   and name HB3 ))
      4.300     2.300     1.700 peak  5527 spectrum    1 weight  0.10000E+01 volume  0.22782E-02 ppm1      1.107 ppm2      2.130 CV     1
 OR { 5527}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 21   and name HG2 ))
 OR { 5527}
   (  segid "    " and resid 3    and name HB% )
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 5528}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 81   and name HB3 ))
      2.500     2.500     3.500 peak  5528 spectrum    1 weight  0.10000E+01 volume  0.11340E-02 ppm1      0.662 ppm2      3.129 CV     1
 OR { 5528}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 35   and name HD3 ))
 ASSI { 5529}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 31   and name HB2 ))
      3.900     1.900     1.900 peak  5529 spectrum    1 weight  0.10000E+01 volume  0.28603E-02 ppm1      0.111 ppm2      1.957 CV     1
 OR { 5529}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 38   and name HB3 ))
 OR { 5529}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 80   and name HB2 ))
 OR { 5529}
   (  segid "    " and resid 32   and name HD1%)
   (( segid "    " and resid 34   and name HB2 ))
 ASSI { 5530}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 79   and name HE% )
      3.500     1.500     1.500 peak  5530 spectrum    1 weight  0.10000E+01 volume  0.37677E-02 ppm1      0.738 ppm2      1.474 CV     1
 OR { 5530}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 36   and name HG13))
 OR { 5530}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 17   and name HB3 ))
 OR { 5530}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 5533}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 32   and name HG13))
      3.100     1.200     1.200 peak  5533 spectrum    1 weight  0.10000E+01 volume  0.59915E-02 ppm1      1.683 ppm2      0.995 CV     1
 OR { 5533}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 28   and name HB% )
 OR { 5533}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 32   and name HG12))
 ASSI { 5534}
   (  segid "    " and resid 17   and name HE% )
   (( segid "    " and resid 36   and name HG12))
      3.800     1.800     1.800 peak  5534 spectrum    1 weight  0.10000E+01 volume  0.44210E-02 ppm1      1.683 ppm2      0.848 CV     1
 OR { 5534}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 36   and name HG2%)
 OR { 5534}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 49   and name HD2%)
 ASSI { 5535}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 32   and name HG2%)
      3.100     1.200     1.200 peak  5535 spectrum    1 weight  0.10000E+01 volume  0.12718E-01 ppm1      1.684 ppm2      0.728 CV     1
 OR { 5535}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 8    and name HD1%)
 OR { 5535}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 8    and name HG2%)
 ASSI { 5537}
   (  segid "    " and resid 14   and name HG1%)
   (( segid "    " and resid 16   and name HB  ))
      3.800     1.800     1.800 peak  5537 spectrum    1 weight  0.10000E+01 volume  0.15707E-02 ppm1      0.826 ppm2      3.919 CV     1
 OR { 5537}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 38   and name HA  ))
 ASSI { 5539}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 8    and name HG13))
      3.500     1.500     1.500 peak  5539 spectrum    1 weight  0.10000E+01 volume  0.40081E-02 ppm1      0.687 ppm2      1.686 CV     1
 OR { 5539}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 15   and name HB3 ))
 OR { 5539}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 15   and name HD3 ))
 OR { 5539}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 40   and name HB2 ))
 OR { 5539}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 33   and name HB3 ))
 ASSI { 5540}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 15   and name HB2 ))
      3.200     1.300     1.300 peak  5540 spectrum    1 weight  0.10000E+01 volume  0.32126E-02 ppm1      0.688 ppm2      1.480 CV     1
 OR { 5540}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 36   and name HG13))
 OR { 5540}
   (  segid "    " and resid 10   and name HD1%)
   (( segid "    " and resid 17   and name HB2 ))
 OR { 5540}
   (  segid "    " and resid 10   and name HD1%)
   (  segid "    " and resid 79   and name HE% )
 ASSI { 5541}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 38   and name HG2 ))
      3.700     1.800     1.800 peak  5541 spectrum    1 weight  0.10000E+01 volume  0.27588E-02 ppm1      0.872 ppm2      2.184 CV     1
 OR { 5541}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 13   and name HB  ))
 ASSI { 5542}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 18   and name HG3 ))
      5.500     3.700     0.500 peak  5542 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      0.705 ppm2      2.057 CV     1
 OR { 5542}
   (  segid "    " and resid 6    and name HD1%)
   (  segid "    " and resid 31   and name HE% )
 ASSI { 5543}
   (  segid "    " and resid 6    and name HD1%)
   (  segid "    " and resid 28   and name HB% )
      4.400     2.400     1.600 peak  5543 spectrum    1 weight  0.10000E+01 volume  0.16655E-02 ppm1      0.709 ppm2      0.993 CV     1
 OR { 5543}
   (  segid "    " and resid 6    and name HD1%)
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 5544}
   (( segid "    " and resid 5    and name HB3 ))
   (  segid "    " and resid 6    and name HD1%)
      4.900     3.000     1.100 peak  5544 spectrum    1 weight  0.10000E+01 volume  0.86997E-03 ppm1      3.597 ppm2      0.706 CV     1
 OR { 5544}
   (( segid "    " and resid 5    and name HB3 ))
   (  segid "    " and resid 4    and name HD1%)
 OR { 5544}
   (( segid "    " and resid 5    and name HB3 ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI { 5545}
   (( segid "    " and resid 5    and name HB2 ))
   (  segid "    " and resid 4    and name HD2%)
      4.800     2.900     1.200 peak  5545 spectrum    1 weight  0.10000E+01 volume  0.89028E-03 ppm1      3.549 ppm2      0.708 CV     1
 OR { 5545}
   (( segid "    " and resid 5    and name HB2 ))
   (  segid "    " and resid 4    and name HD1%)
 OR { 5545}
   (( segid "    " and resid 5    and name HB2 ))
   (  segid "    " and resid 6    and name HD1%)
 ASSI { 5548}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 133  and name H   ))
      2.500     2.500     3.500 peak  5548 spectrum    1 weight  0.10000E+01 volume  0.16756E-02 ppm1      0.718 ppm2      8.208 CV     1
 OR { 5548}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 171  and name H   ))
 OR { 5548}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 198  and name H   ))
 ASSI { 5549}
   (  segid "    " and resid 193  and name HD2%)
   (( segid "    " and resid 193  and name H   ))
      3.300     1.300     1.300 peak  5549 spectrum    1 weight  0.10000E+01 volume  0.61474E-02 ppm1      0.719 ppm2      7.890 CV     1
 OR { 5549}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 193  and name H   ))
 OR { 5549}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 3    and name H   ))
 ASSI { 5551}
   (  segid "    " and resid 192  and name HD1%)
   (( segid "    " and resid 190  and name HB  ))
      3.700     1.700     1.700 peak  5551 spectrum    1 weight  0.10000E+01 volume  0.20040E-02 ppm1      0.714 ppm2      3.883 CV     1
 OR { 5551}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 21   and name HD2 ))
 ASSI { 5553}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 90   and name HG13))
      2.400     2.400     3.600 peak  5553 spectrum    1 weight  0.10000E+01 volume  0.26133E-02 ppm1      0.572 ppm2      1.217 CV     1
 OR { 5553}
   (  segid "    " and resid 193  and name HD1%)
   (( segid "    " and resid 195  and name HB2 ))
 ASSI { 5555}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 8    and name H   ))
      4.000     2.000     2.000 peak  5555 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      2.798 ppm2      9.046 CV     1
 OR { 5555}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 8    and name H   ))
 OR { 5555}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 79   and name H   ))
 OR { 5555}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 79   and name H   ))
 ASSI { 5556}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 9    and name HA  ))
      4.600     2.600     1.400 peak  5556 spectrum    1 weight  0.10000E+01 volume  0.13879E-02 ppm1      2.800 ppm2      5.319 CV     1
 OR { 5556}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 78   and name HA  ))
 OR { 5556}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 78   and name HA  ))
 OR { 5556}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI { 5557}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 16   and name HA  ))
      3.500     1.500     1.500 peak  5557 spectrum    1 weight  0.10000E+01 volume  0.21495E-02 ppm1      2.798 ppm2      4.939 CV     1
 OR { 5557}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 16   and name HA  ))
 OR { 5557}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 14   and name HA  ))
 OR { 5557}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 14   and name HA  ))
 OR { 5557}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 6    and name HA  ))
 OR { 5557}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI { 5558}
   (( segid "    " and resid 7    and name HE3 ))
   (( segid "    " and resid 7    and name HA  ))
      3.300     1.300     1.300 peak  5558 spectrum    1 weight  0.10000E+01 volume  0.25795E-02 ppm1      2.808 ppm2      4.526 CV     1
 OR { 5558}
   (( segid "    " and resid 89   and name HE2 ))
   (( segid "    " and resid 188  and name HA  ))
 OR { 5558}
   (( segid "    " and resid 89   and name HE3 ))
   (( segid "    " and resid 188  and name HA  ))
 OR { 5558}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 7    and name HA  ))
 ASSI { 5559}
   (( segid "    " and resid 106  and name HE3 ))
   (( segid "    " and resid 114  and name HB  ))
      3.300     1.400     1.400 peak  5559 spectrum    1 weight  0.10000E+01 volume  0.27115E-02 ppm1      2.801 ppm2      4.252 CV     1
 OR { 5559}
   (( segid "    " and resid 106  and name HE3 ))
   (( segid "    " and resid 104  and name HA  ))
 OR { 5559}
   (( segid "    " and resid 83   and name HE2 ))
   (( segid "    " and resid 100  and name HA  ))
 OR { 5559}
   (( segid "    " and resid 7    and name HE2 ))
   (( segid "    " and resid 13   and name HA  ))
 OR { 5559}
   (( segid "    " and resid 83   and name HE3 ))
   (( segid "    " and resid 100  and name HA  ))
 OR { 5559}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 176  and name HA  ))
 ASSI { 5560}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 193  and name HB2 ))
      3.600     1.600     1.600 peak  5560 spectrum    1 weight  0.10000E+01 volume  0.30805E-02 ppm1      2.799 ppm2      1.003 CV     1
 OR { 5560}
   (( segid "    " and resid 7    and name HE2 ))
   (  segid "    " and resid 78   and name HG2%)
 OR { 5560}
   (( segid "    " and resid 7    and name HE3 ))
   (  segid "    " and resid 78   and name HG2%)
 OR { 5560}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 193  and name HB2 ))
 OR { 5560}
   (( segid "    " and resid 127  and name HB3 ))
   (  segid "    " and resid 93   and name HD2%)
 ASSI { 5561}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 28   and name HB% )
      2.500     0.800     0.800 peak  5561 spectrum    1 weight  0.10000E+01 volume  0.67906E-02 ppm1      1.471 ppm2      0.997 CV     1
 OR { 5561}
   (  segid "    " and resid 79   and name HE% )
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 5562}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 8    and name HB  ))
      2.500     2.500     3.500 peak  5562 spectrum    1 weight  0.10000E+01 volume  0.38794E-02 ppm1      1.470 ppm2      2.055 CV     1
 OR { 5562}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 80   and name HG2 ))
 ASSI { 5563}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 80   and name H   ))
      4.000     2.000     2.000 peak  5563 spectrum    1 weight  0.10000E+01 volume  0.20344E-02 ppm1      1.473 ppm2      9.147 CV     1
 OR { 5563}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 50   and name H   ))
 ASSI { 5565}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 64   and name HA  ))
      3.400     1.400     1.400 peak  5565 spectrum    1 weight  0.10000E+01 volume  0.41197E-02 ppm1      2.029 ppm2      3.911 CV     1
 OR { 5565}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 68   and name HA  ))
 OR { 5565}
   (  segid "    " and resid 24   and name HE% )
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 5567}
   (  segid "    " and resid 73   and name HD1%)
   (  segid "    " and resid 19   and name HE% )
      4.100     2.100     1.900 peak  5567 spectrum    1 weight  0.10000E+01 volume  0.12660E-02 ppm1      0.794 ppm2      7.146 CV     1
 OR { 5567}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 183  and name H   ))
 ASSI { 5568}
   (  segid "    " and resid 191  and name HD2%)
   (( segid "    " and resid 189  and name H   ))
      3.300     1.300     1.300 peak  5568 spectrum    1 weight  0.10000E+01 volume  0.20446E-02 ppm1      0.791 ppm2      6.933 CV     1
 OR { 5568}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 189  and name H   ))
 ASSI { 5569}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 183  and name HE21))
      3.600     3.600     2.400 peak  5569 spectrum    1 weight  0.10000E+01 volume  0.19295E-02 ppm1      0.796 ppm2      6.489 CV     1
 OR { 5569}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 183  and name HE21))
 OR { 5569}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 85   and name HE21))
 ASSI { 5570}
   (  segid "    " and resid 133  and name HD1%)
   (( segid "    " and resid 185  and name HA  ))
      3.100     1.200     1.200 peak  5570 spectrum    1 weight  0.10000E+01 volume  0.16892E-02 ppm1      0.794 ppm2      3.840 CV     1
 OR { 5570}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 187  and name HA  ))
 OR { 5570}
   (  segid "    " and resid 88   and name HD2%)
   (( segid "    " and resid 112  and name HA  ))
 ASSI { 5571}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 59   and name H   ))
      4.100     2.100     1.900 peak  5571 spectrum    1 weight  0.10000E+01 volume  0.12728E-02 ppm1      1.629 ppm2      7.336 CV     1
 OR { 5571}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 59   and name H   ))
 OR { 5571}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 185  and name H   ))
 OR { 5571}
   (( segid "    " and resid 57   and name HD3 ))
   (( segid "    " and resid 185  and name H   ))
 ASSI { 5573}
   (( segid "    " and resid 58   and name HD3 ))
   (( segid "    " and resid 55   and name HB3 ))
      4.100     2.100     1.900 peak  5573 spectrum    1 weight  0.10000E+01 volume  0.13236E-02 ppm1      1.581 ppm2      2.434 CV     1
 OR { 5573}
   (( segid "    " and resid 58   and name HD2 ))
   (( segid "    " and resid 55   and name HB3 ))
 OR { 5573}
   (( segid "    " and resid 98   and name HD3 ))
   (( segid "    " and resid 92   and name HG2 ))
 ASSI { 5576}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 80   and name HB2 ))
      4.200     2.300     1.800 peak  5576 spectrum    1 weight  0.10000E+01 volume  0.18043E-02 ppm1      0.718 ppm2      1.971 CV     1
 OR { 5576}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 80   and name HB3 ))
 OR { 5576}
   (  segid "    " and resid 8    and name HD1%)
   (( segid "    " and resid 31   and name HB2 ))
 ASSI { 5577}
   (( segid "    " and resid 4    and name HG  ))
   (( segid "    " and resid 5    and name H   ))
      3.800     1.800     1.800 peak  5577 spectrum    1 weight  0.10000E+01 volume  0.14996E-02 ppm1      1.475 ppm2      8.643 CV     1
 OR { 5577}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 28   and name H   ))
 OR { 5577}
   (( segid "    " and resid 133  and name HG  ))
   (( segid "    " and resid 132  and name H   ))
 ASSI { 5580}
   (( segid "    " and resid 80   and name HG3 ))
   (  segid "    " and resid 8    and name HG2%)
      4.200     2.200     1.800 peak  5580 spectrum    1 weight  0.10000E+01 volume  0.92752E-03 ppm1      2.391 ppm2      0.721 CV     1
 OR { 5580}
   (( segid "    " and resid 80   and name HG3 ))
   (  segid "    " and resid 8    and name HD1%)
 OR { 5580}
   (( segid "    " and resid 80   and name HG3 ))
   (  segid "    " and resid 10   and name HD1%)
 ASSI { 5581}
   (  segid "    " and resid 90   and name HG2%)
   (  segid "    " and resid 93   and name HD1%)
      3.700     1.700     1.700 peak  5581 spectrum    1 weight  0.10000E+01 volume  0.31684E-02 ppm1      0.641 ppm2      0.941 CV     1
 OR { 5581}
   (  segid "    " and resid 90   and name HG2%)
   (  segid "    " and resid 93   and name HD2%)
 OR { 5581}
   (  segid "    " and resid 90   and name HG2%)
   (  segid "    " and resid 190  and name HG2%)
 ASSI { 5582}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HB2 ))
      3.200     1.300     1.300 peak  5582 spectrum    1 weight  0.10000E+01 volume  0.15030E-02 ppm1      4.208 ppm2      2.631 CV     1
 OR { 5582}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 197  and name HB3 ))
 ASSI { 5583}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 104  and name H   ))
      4.500     2.500     1.500 peak  5583 spectrum    1 weight  0.10000E+01 volume  0.80905E-03 ppm1      1.892 ppm2      8.363 CV     1
 OR { 5583}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 101  and name H   ))
 ASSI { 5587}
   (( segid "    " and resid 193  and name HG  ))
   (( segid "    " and resid 130  and name H   ))
      3.700     1.700     1.700 peak  5587 spectrum    1 weight  0.10000E+01 volume  0.81244E-03 ppm1      1.370 ppm2      8.799 CV     1
 OR { 5587}
   (( segid "    " and resid 193  and name HG  ))
   (( segid "    " and resid 195  and name H   ))
 ASSI { 5588}
   (  segid "    " and resid 171  and name HD1%)
   (( segid "    " and resid 132  and name HG2 ))
      3.100     1.200     1.200 peak  5588 spectrum    1 weight  0.10000E+01 volume  0.63438E-02 ppm1      0.695 ppm2      1.998 CV     1
 OR { 5588}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 80   and name HB2 ))
 OR { 5588}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 80   and name HB3 ))
 ASSI { 5590}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 49   and name HB3 ))
      4.200     2.200     1.800 peak  5590 spectrum    1 weight  0.10000E+01 volume  0.11475E-02 ppm1      2.139 ppm2      1.291 CV     1
 OR { 5590}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 60   and name HG13))
 OR { 5590}
   (( segid "    " and resid 82   and name HD3 ))
   (( segid "    " and resid 83   and name HB2 ))
 OR { 5590}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 83   and name HB2 ))
 ASSI { 5591}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 32   and name HG2%)
      3.800     1.800     1.800 peak  5591 spectrum    1 weight  0.10000E+01 volume  0.44717E-02 ppm1      2.050 ppm2      0.720 CV     1
 OR { 5591}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 49   and name HD1%)
 OR { 5591}
   (  segid "    " and resid 31   and name HE% )
   (  segid "    " and resid 8    and name HD1%)
 ASSI { 5594}
   (( segid "    " and resid 138  and name HE3 ))
   (  segid "    " and resid 133  and name HD1%)
      2.800     1.000     1.000 peak  5594 spectrum    1 weight  0.10000E+01 volume  0.88216E-02 ppm1      2.907 ppm2      0.823 CV     1
 OR { 5594}
   (( segid "    " and resid 138  and name HE2 ))
   (  segid "    " and resid 133  and name HD1%)
 OR { 5594}
   (( segid "    " and resid 98   and name HE3 ))
   (( segid "    " and resid 115  and name HG12))
 OR { 5594}
   (( segid "    " and resid 98   and name HE2 ))
   (( segid "    " and resid 115  and name HG12))
 OR { 5594}
   (( segid "    " and resid 98   and name HE3 ))
   (( segid "    " and resid 115  and name HG13))
 OR { 5594}
   (( segid "    " and resid 98   and name HE2 ))
   (( segid "    " and resid 115  and name HG13))
 ASSI { 5595}
   (( segid "    " and resid 15   and name HD2 ))
   (( segid "    " and resid 36   and name HG12))
      3.300     1.300     1.300 peak  5595 spectrum    1 weight  0.10000E+01 volume  0.26709E-02 ppm1      1.579 ppm2      0.910 CV     1
 OR { 5595}
   (( segid "    " and resid 15   and name HD2 ))
   (  segid "    " and resid 13   and name HG1%)
 OR { 5595}
   (( segid "    " and resid 15   and name HD2 ))
   (  segid "    " and resid 16   and name HG2%)
 OR { 5595}
   (( segid "    " and resid 98   and name HD2 ))
   (  segid "    " and resid 99   and name HG2%)
 ASSI { 5596}
   (( segid "    " and resid 15   and name HD2 ))
   (  segid "    " and resid 36   and name HD1%)
      3.400     1.400     1.400 peak  5596 spectrum    1 weight  0.10000E+01 volume  0.55178E-02 ppm1      1.581 ppm2      0.652 CV     1
 OR { 5596}
   (( segid "    " and resid 98   and name HD3 ))
   (  segid "    " and resid 100  and name HG2%)
 OR { 5596}
   (( segid "    " and resid 98   and name HD2 ))
   (  segid "    " and resid 100  and name HG2%)
 OR { 5596}
   (( segid "    " and resid 98   and name HD3 ))
   (  segid "    " and resid 90   and name HG2%)
 OR { 5596}
   (( segid "    " and resid 98   and name HD3 ))
   (  segid "    " and resid 100  and name HD1%)
 OR { 5596}
   (( segid "    " and resid 98   and name HD2 ))
   (  segid "    " and resid 90   and name HG2%)
 OR { 5596}
   (( segid "    " and resid 98   and name HD2 ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 5597}
   (( segid "    " and resid 89   and name HD3 ))
   (( segid "    " and resid 100  and name HA  ))
      3.800     1.800     1.800 peak  5597 spectrum    1 weight  0.10000E+01 volume  0.82595E-03 ppm1      1.462 ppm2      4.250 CV     1
 OR { 5597}
   (( segid "    " and resid 89   and name HD2 ))
   (( segid "    " and resid 100  and name HA  ))
 OR { 5597}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 76   and name HA3 ))
 OR { 5597}
   (( segid "    " and resid 83   and name HD3 ))
   (( segid "    " and resid 100  and name HA  ))
 OR { 5597}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 100  and name HA  ))
 OR { 5597}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 13   and name HA  ))
 OR { 5597}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 13   and name HA  ))
 OR { 5597}
   (( segid "    " and resid 83   and name HD2 ))
   (( segid "    " and resid 104  and name HA  ))
 ASSI { 5598}
   (( segid "    " and resid 17   and name HG3 ))
   (  segid "    " and resid 8    and name HD1%)
      3.800     1.800     1.800 peak  5598 spectrum    1 weight  0.10000E+01 volume  0.23865E-02 ppm1      2.072 ppm2      0.724 CV     1
 OR { 5598}
   (( segid "    " and resid 17   and name HG3 ))
   (  segid "    " and resid 8    and name HG2%)
 OR { 5598}
   (( segid "    " and resid 17   and name HG3 ))
   (  segid "    " and resid 32   and name HG2%)
 ASSI { 5603}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 71   and name HA  ))
      4.000     2.000     2.000 peak  5603 spectrum    1 weight  0.10000E+01 volume  0.10697E-02 ppm1      0.831 ppm2      3.969 CV     1
 OR { 5603}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 5604}
   (  segid "    " and resid 109  and name HG2%)
   (( segid "    " and resid 108  and name H   ))
      4.300     2.300     1.700 peak  5604 spectrum    1 weight  0.10000E+01 volume  0.18212E-02 ppm1      1.178 ppm2      7.904 CV     1
 OR { 5604}
   (  segid "    " and resid 0    and name HG2%)
   (( segid "    " and resid 3    and name H   ))
 ASSI { 5605}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 106  and name HD2 ))
      3.000     1.100     1.100 peak  5605 spectrum    1 weight  0.10000E+01 volume  0.14251E-02 ppm1      0.595 ppm2      1.503 CV     1
 OR { 5605}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 178  and name HG3 ))
 OR { 5605}
   (  segid "    " and resid 180  and name HD2%)
   (( segid "    " and resid 131  and name HB3 ))
 ASSI { 5607}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 177  and name H   ))
      3.800     1.900     1.900 peak  5607 spectrum    1 weight  0.10000E+01 volume  0.11171E-02 ppm1      0.683 ppm2      8.791 CV     1
 OR { 5607}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 186  and name H   ))
 OR { 5607}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 109  and name H   ))
 ASSI { 5611}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 129  and name HB3 ))
      4.200     2.200     1.800 peak  5611 spectrum    1 weight  0.10000E+01 volume  0.13642E-02 ppm1      0.678 ppm2      1.485 CV     1
 OR { 5611}
   (  segid "    " and resid 174  and name HD2%)
   (( segid "    " and resid 131  and name HB3 ))
 ASSI { 5613}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 194  and name HD3 ))
      4.300     2.300     1.700 peak  5613 spectrum    1 weight  0.10000E+01 volume  0.17772E-02 ppm1      0.616 ppm2      2.995 CV     1
 OR { 5613}
   (  segid "    " and resid 171  and name HD2%)
   (( segid "    " and resid 173  and name HB2 ))
 ASSI { 5619}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 134  and name HG3 ))
      3.500     1.500     1.500 peak  5619 spectrum    1 weight  0.10000E+01 volume  0.24813E-02 ppm1      2.140 ppm2      2.557 CV     1
 OR { 5619}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 134  and name HG3 ))
 OR { 5619}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 169  and name HB2 ))
 OR { 5619}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 169  and name HB2 ))
 ASSI { 5621}
   (( segid "    " and resid 135  and name HG2 ))
   (  segid "    " and resid 185  and name HG1%)
      3.600     1.700     1.700 peak  5621 spectrum    1 weight  0.10000E+01 volume  0.29146E-02 ppm1      2.147 ppm2      0.708 CV     1
 OR { 5621}
   (( segid "    " and resid 135  and name HG3 ))
   (  segid "    " and resid 185  and name HG1%)
 OR { 5621}
   (( segid "    " and resid 170  and name HG3 ))
   (  segid "    " and resid 171  and name HD1%)
 OR { 5621}
   (( segid "    " and resid 170  and name HG2 ))
   (  segid "    " and resid 171  and name HD1%)
 OR { 5621}
   (( segid "    " and resid 135  and name HG3 ))
   (  segid "    " and resid 185  and name HG2%)
 ASSI { 5624}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 135  and name HB3 ))
      3.600     1.600     1.600 peak  5624 spectrum    1 weight  0.10000E+01 volume  0.23188E-02 ppm1      1.319 ppm2      1.977 CV     1
 OR { 5624}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 136  and name HB2 ))
 OR { 5624}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 135  and name HB3 ))
 ASSI { 5626}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 132  and name HB2 ))
      3.400     1.400     1.400 peak  5626 spectrum    1 weight  0.10000E+01 volume  0.32126E-02 ppm1      0.831 ppm2      1.920 CV     1
 OR { 5626}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 44   and name HG3 ))
 OR { 5626}
   (  segid "    " and resid 6    and name HD2%)
   (( segid "    " and resid 68   and name HB2 ))
 OR { 5626}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 135  and name HB2 ))
 OR { 5626}
   (  segid "    " and resid 133  and name HD2%)
   (( segid "    " and resid 134  and name HB3 ))
 ASSI { 5633}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 119  and name HA  ))
      4.500     2.500     1.500 peak  5633 spectrum    1 weight  0.10000E+01 volume  0.14454E-02 ppm1      1.913 ppm2      4.308 CV     1
 OR { 5633}
   (  segid "    " and resid 92   and name HE% )
   (( segid "    " and resid 95   and name HA2 ))
 ASSI { 5636}
   (( segid "    " and resid 98   and name HG3 ))
   (( segid "    " and resid 99   and name H   ))
      3.600     1.600     1.600 peak  5636 spectrum    1 weight  0.10000E+01 volume  0.16959E-02 ppm1      1.289 ppm2      8.427 CV     1
 OR { 5636}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 99   and name H   ))
 OR { 5636}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 191  and name H   ))
 ASSI { 5639}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 111  and name HG2 ))
      4.100     2.100     1.900 peak  5639 spectrum    1 weight  0.10000E+01 volume  0.13337E-02 ppm1      0.638 ppm2      2.580 CV     1
 OR { 5639}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 111  and name HG2 ))
 ASSI { 5643}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 132  and name HG2 ))
      3.900     1.900     1.900 peak  5643 spectrum    1 weight  0.10000E+01 volume  0.11272E-02 ppm1      0.232 ppm2      1.993 CV     1
 OR { 5643}
   (  segid "    " and resid 130  and name HG1%)
   (( segid "    " and resid 131  and name HB2 ))
 ASSI { 5644}
   (( segid "    " and resid 98   and name HB2 ))
   (  segid "    " and resid 119  and name HD1%)
      4.100     2.100     1.900 peak  5644 spectrum    1 weight  0.10000E+01 volume  0.25895E-02 ppm1      1.643 ppm2      0.638 CV     1
 OR { 5644}
   (( segid "    " and resid 98   and name HB2 ))
   (  segid "    " and resid 100  and name HG2%)
 OR { 5644}
   (( segid "    " and resid 98   and name HB2 ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 5646}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 28   and name H   ))
      4.500     2.500     1.500 peak  5646 spectrum    1 weight  0.10000E+01 volume  0.79551E-03 ppm1      1.629 ppm2      8.634 CV     1
 OR { 5646}
   (( segid "    " and resid 8    and name HG13))
   (( segid "    " and resid 16   and name H   ))
 OR { 5646}
   (( segid "    " and resid 8    and name HG13))
   (( segid "    " and resid 7    and name H   ))
 OR { 5646}
   (( segid "    " and resid 8    and name HG13))
   (( segid "    " and resid 82   and name H   ))
 ASSI { 5647}
   (  segid "    " and resid 190  and name HG2%)
   (  segid "    " and resid 97   and name HG1%)
      2.200     2.200     3.800 peak  5647 spectrum    1 weight  0.10000E+01 volume  0.80024E-02 ppm1      0.926 ppm2      0.829 CV     1
 OR { 5647}
   (  segid "    " and resid 190  and name HG2%)
   (  segid "    " and resid 133  and name HD2%)
 ASSI { 5650}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 101  and name HA  ))
      4.700     2.700     1.300 peak  5650 spectrum    1 weight  0.10000E+01 volume  0.66686E-03 ppm1      2.074 ppm2      4.848 CV     1
 OR { 5650}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 5657}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 36   and name HD1%)
      3.100     1.200     1.200 peak  5657 spectrum    1 weight  0.10000E+01 volume  0.99962E-02 ppm1      1.683 ppm2      0.672 CV     1
 OR { 5657}
   (  segid "    " and resid 17   and name HE% )
   (  segid "    " and resid 8    and name HD1%)
 ASSI { 5658}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 122  and name HA  ))
      3.700     1.700     1.700 peak  5658 spectrum    1 weight  0.10000E+01 volume  0.12627E-02 ppm1      1.473 ppm2      4.231 CV     1
 OR { 5658}
   (  segid "    " and resid 117  and name HB% )
   (( segid "    " and resid 122  and name HB  ))
 OR { 5658}
   (  segid "    " and resid 79   and name HE% )
   (( segid "    " and resid 40   and name HA  ))
 ASSI { 5660}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 98   and name HB2 ))
      3.900     1.900     1.900 peak  5660 spectrum    1 weight  0.10000E+01 volume  0.17873E-02 ppm1      1.071 ppm2      1.639 CV     1
 OR { 5660}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 91   and name HG2 ))
 ASSI { 5661}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 7    and name H   ))
      3.000     3.000     3.000 peak  5661 spectrum    1 weight  0.10000E+01 volume  0.14319E-02 ppm1      0.934 ppm2      8.659 CV     1
 OR { 5661}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 5    and name H   ))
 ASSI { 5664}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name H   ))
      2.800     1.000     1.000 peak  5664 spectrum    1 weight  0.10000E+01 volume  0.32700E-02 ppm1      2.189 ppm2      8.367 CV     1
 OR { 5664}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name H   ))
 OR { 5664}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 169  and name H   ))
 OR { 5664}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 169  and name H   ))
 ASSI {   66}
   (( segid "    " and resid 1    and name H   ))
   (  segid "    " and resid 2    and name HG1%)
      3.300     1.400     1.400 peak    66 spectrum    1 weight  0.10000E+01 volume  0.26583E-02 ppm1      8.145 ppm2      0.865 CV     1
 OR {   66}
   (( segid "    " and resid 1    and name H   ))
   (  segid "    " and resid 2    and name HG2%)
 OR {   66}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name HD3 ))
 ASSI {   77}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name HA  ))
      2.100     0.500     0.500 peak    77 spectrum    1 weight  0.10000E+01 volume  0.10761E-01 ppm1      8.145 ppm2      4.399 CV     1
 OR {   77}
   (( segid "    " and resid 1    and name H   ))
   (( segid "    " and resid 1    and name HA  ))
 ASSI {  102}
   (( segid "    " and resid 198  and name H   ))
   (( segid "    " and resid 197  and name HB3 ))
      2.300     0.700     0.700 peak   102 spectrum    1 weight  0.10000E+01 volume  0.57300E-02 ppm1      8.148 ppm2      2.687 CV     1
 OR {  102}
   (( segid "    " and resid 198  and name H   ))
   (( segid "    " and resid 198  and name HB2 ))
 ASSI {  168}
   (( segid "    " and resid 195  and name H   ))
   (( segid "    " and resid 194  and name HD2 ))
      4.300     2.300     1.700 peak   168 spectrum    1 weight  0.10000E+01 volume  0.10404E-02 ppm1      8.782 ppm2      3.005 CV     1
 OR {  168}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name HB2 ))
 ASSI {  173}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 194  and name HG2 ))
      3.200     1.300     1.300 peak   173 spectrum    1 weight  0.10000E+01 volume  0.12939E-02 ppm1      8.645 ppm2      1.409 CV     1
 OR {  173}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 193  and name HG  ))
 OR {  173}
   (( segid "    " and resid 194  and name H   ))
   (( segid "    " and resid 194  and name HG3 ))
 ASSI {  179}
   (( segid "    " and resid 195  and name H   ))
   (( segid "    " and resid 195  and name HB2 ))
      2.700     0.900     0.900 peak   179 spectrum    1 weight  0.10000E+01 volume  0.22123E-02 ppm1      8.782 ppm2      1.189 CV     1
 OR {  179}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  197}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 191  and name HB2 ))
      3.600     1.700     1.700 peak   197 spectrum    1 weight  0.10000E+01 volume  0.13530E-02 ppm1      9.084 ppm2      1.644 CV     1
 OR {  197}
   (( segid "    " and resid 192  and name H   ))
   (( segid "    " and resid 130  and name HB  ))
 ASSI {  212}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 192  and name HB2 ))
      3.700     1.700     1.700 peak   212 spectrum    1 weight  0.10000E+01 volume  0.18331E-02 ppm1      7.884 ppm2      1.380 CV     1
 OR {  212}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI {  238}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 109  and name HB  ))
      2.300     0.700     0.700 peak   238 spectrum    1 weight  0.10000E+01 volume  0.51030E-02 ppm1      7.021 ppm2      4.014 CV     1
 OR {  238}
   (( segid "    " and resid 189  and name H   ))
   (( segid "    " and resid 189  and name HA  ))
 ASSI {  300}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 180  and name HA  ))
      4.700     2.800     1.300 peak   300 spectrum    1 weight  0.10000E+01 volume  0.47069E-03 ppm1      7.703 ppm2      3.842 CV     1
 OR {  300}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 185  and name HA  ))
 ASSI {  343}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 57   and name HB2 ))
      3.000     1.200     1.200 peak   343 spectrum    1 weight  0.10000E+01 volume  0.12100E-02 ppm1      7.991 ppm2      1.792 CV     1
 OR {  343}
   (( segid "    " and resid 182  and name H   ))
   (( segid "    " and resid 181  and name HB3 ))
 ASSI {  347}
   (( segid "    " and resid 182  and name H   ))
   (  segid "    " and resid 179  and name HG2%)
      3.200     1.300     1.300 peak   347 spectrum    1 weight  0.10000E+01 volume  0.14139E-02 ppm1      8.021 ppm2      1.190 CV     1
 OR {  347}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 58   and name HG3 ))
 ASSI {  356}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 182  and name HB3 ))
      5.100     3.300     0.900 peak   356 spectrum    1 weight  0.10000E+01 volume  0.36395E-03 ppm1      8.749 ppm2      2.325 CV     1
 OR {  356}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 113  and name HG3 ))
 ASSI {  377}
   (( segid "    " and resid 180  and name H   ))
   (( segid "    " and resid 180  and name HB3 ))
      3.800     1.800     1.800 peak   377 spectrum    1 weight  0.10000E+01 volume  0.13987E-02 ppm1      8.964 ppm2      1.176 CV     1
 OR {  377}
   (( segid "    " and resid 180  and name H   ))
   (  segid "    " and resid 179  and name HG2%)
 ASSI {  458}
   (( segid "    " and resid 173  and name H   ))
   (  segid "    " and resid 174  and name HD2%)
      4.800     2.800     1.200 peak   458 spectrum    1 weight  0.10000E+01 volume  0.57548E-03 ppm1      7.716 ppm2      0.686 CV     1
 OR {  458}
   (( segid "    " and resid 173  and name H   ))
   (  segid "    " and resid 171  and name HD1%)
 ASSI {  483}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 170  and name HG3 ))
      4.200     2.200     1.800 peak   483 spectrum    1 weight  0.10000E+01 volume  0.14501E-02 ppm1      8.208 ppm2      2.121 CV     1
 OR {  483}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 170  and name HG2 ))
 OR {  483}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 132  and name HG3 ))
 ASSI {  544}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HB3 ))
      2.600     0.800     0.800 peak   544 spectrum    1 weight  0.10000E+01 volume  0.89560E-02 ppm1      8.082 ppm2      1.789 CV     1
 OR {  544}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 137  and name HB3 ))
 ASSI {  588}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 131  and name H   ))
      4.600     2.700     1.400 peak   588 spectrum    1 weight  0.10000E+01 volume  0.33728E-03 ppm1      8.668 ppm2      8.427 CV     1
 OR {  588}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 191  and name H   ))
 ASSI {  600}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 132  and name HG2 ))
      3.500     1.500     1.500 peak   600 spectrum    1 weight  0.10000E+01 volume  0.16274E-02 ppm1      8.664 ppm2      1.998 CV     1
 OR {  600}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 131  and name HB2 ))
 ASSI {  706}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 127  and name HB3 ))
      4.800     2.900     1.200 peak   706 spectrum    1 weight  0.10000E+01 volume  0.50689E-03 ppm1      7.706 ppm2      2.789 CV     1
 OR {  706}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 123  and name HB2 ))
 ASSI {  726}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 7    and name HB3 ))
      3.700     1.700     1.700 peak   726 spectrum    1 weight  0.10000E+01 volume  0.19818E-02 ppm1      8.677 ppm2      1.324 CV     1
 OR {  726}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI {  728}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 7    and name HG3 ))
      3.200     1.300     1.300 peak   728 spectrum    1 weight  0.10000E+01 volume  0.16235E-02 ppm1      8.684 ppm2      1.145 CV     1
 OR {  728}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 122  and name HG2%)
 ASSI {  750}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 121  and name HB  ))
      2.500     0.800     0.800 peak   750 spectrum    1 weight  0.10000E+01 volume  0.40913E-02 ppm1      7.936 ppm2      1.225 CV     1
 OR {  750}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 119  and name HG12))
 ASSI {  787}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 119  and name H   ))
      3.900     1.900     1.900 peak   787 spectrum    1 weight  0.10000E+01 volume  0.74889E-03 ppm1      7.755 ppm2      7.476 CV     1
 OR {  787}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 114  and name H   ))
 ASSI {  817}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 112  and name HA  ))
      3.200     1.300     1.300 peak   817 spectrum    1 weight  0.10000E+01 volume  0.11738E-02 ppm1      8.534 ppm2      3.845 CV     1
 OR {  817}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI {  862}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 17   and name HB3 ))
      2.800     1.000     1.000 peak   862 spectrum    1 weight  0.10000E+01 volume  0.51203E-02 ppm1      7.657 ppm2      1.466 CV     1
 OR {  862}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HB3 ))
 ASSI {  873}
   (( segid "    " and resid 113  and name H   ))
   (  segid "    " and resid 112  and name HD2%)
      4.600     2.600     1.400 peak   873 spectrum    1 weight  0.10000E+01 volume  0.99280E-03 ppm1      7.650 ppm2      0.655 CV     1
 OR {  873}
   (( segid "    " and resid 113  and name H   ))
   (  segid "    " and resid 115  and name HD1%)
 ASSI {  951}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 103  and name HB3 ))
      3.900     1.900     1.900 peak   951 spectrum    1 weight  0.10000E+01 volume  0.63836E-03 ppm1      8.597 ppm2      2.616 CV     1
 OR {  951}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 104  and name HB2 ))
 ASSI {  978}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 104  and name HB2 ))
      3.200     1.300     1.300 peak   978 spectrum    1 weight  0.10000E+01 volume  0.12424E-02 ppm1      8.395 ppm2      2.625 CV     1
 OR {  978}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 103  and name HB3 ))
 ASSI {  985}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 106  and name HG3 ))
      4.700     2.700     1.300 peak   985 spectrum    1 weight  0.10000E+01 volume  0.65361E-03 ppm1      8.022 ppm2      1.160 CV     1
 OR {  985}
   (( segid "    " and resid 103  and name H   ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 1012}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 100  and name H   ))
      4.000     2.000     2.000 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.11319E-02 ppm1      8.413 ppm2      9.148 CV     1
 OR { 1012}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name H   ))
 ASSI { 1018}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 89   and name HA  ))
      3.700     1.700     1.700 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.16178E-02 ppm1      9.165 ppm2      4.637 CV     1
 OR { 1018}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI { 1024}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 30   and name HD3 ))
      4.500     2.600     1.500 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.69744E-03 ppm1      8.328 ppm2      3.220 CV     1
 OR { 1024}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI { 1031}
   (( segid "    " and resid 98   and name H   ))
   (( segid "    " and resid 98   and name HB2 ))
      3.400     1.500     1.500 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.17055E-02 ppm1      9.132 ppm2      1.641 CV     1
 OR { 1031}
   (( segid "    " and resid 98   and name H   ))
   (( segid "    " and resid 90   and name HB  ))
 ASSI { 1060}
   (( segid "    " and resid 100  and name H   ))
   (  segid "    " and resid 100  and name HG2%)
      2.700     0.900     0.900 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.26926E-02 ppm1      9.132 ppm2      0.686 CV     1
 OR { 1060}
   (( segid "    " and resid 98   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI { 1129}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      4.600     2.700     1.400 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.31632E-03 ppm1      9.214 ppm2      4.559 CV     1
 OR { 1129}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 190  and name HA  ))
 ASSI { 1136}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 90   and name HB  ))
      3.800     1.800     1.800 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.11586E-02 ppm1      9.215 ppm2      1.654 CV     1
 OR { 1136}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 191  and name HB2 ))
 ASSI { 1161}
   (( segid "    " and resid 89   and name H   ))
   (  segid "    " and resid 99   and name HG2%)
      4.300     2.300     1.700 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.53736E-03 ppm1      8.484 ppm2      0.915 CV     1
 OR { 1161}
   (( segid "    " and resid 89   and name H   ))
   (  segid "    " and resid 190  and name HG2%)
 ASSI { 1211}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 85   and name HB2 ))
      3.500     1.600     1.600 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.10671E-02 ppm1      9.302 ppm2      1.562 CV     1
 OR { 1211}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 101  and name HB3 ))
 ASSI { 1214}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 46   and name HB2 ))
      5.100     3.300     0.900 peak  1214 spectrum    1 weight  0.10000E+01 volume  0.29728E-03 ppm1      8.101 ppm2      2.325 CV     1
 OR { 1214}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 84   and name HE3 ))
 ASSI { 1231}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 84   and name HB3 ))
      3.600     1.600     1.600 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.13720E-02 ppm1      8.103 ppm2      0.928 CV     1
 OR { 1231}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 1260}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 50   and name HB2 ))
      4.500     2.500     1.500 peak  1260 spectrum    1 weight  0.10000E+01 volume  0.72793E-03 ppm1      8.678 ppm2      2.433 CV     1
 OR { 1260}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 1270}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 81   and name HA  ))
      4.400     2.400     1.600 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.39827E-03 ppm1      9.174 ppm2      5.429 CV     1
 OR { 1270}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 1311}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 79   and name HA  ))
      2.900     1.100     1.100 peak  1311 spectrum    1 weight  0.10000E+01 volume  0.15835E-02 ppm1      9.052 ppm2      4.906 CV     1
 OR { 1311}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 8    and name HA  ))
 ASSI { 1318}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 79   and name HB3 ))
      3.300     1.300     1.300 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.13663E-02 ppm1      9.053 ppm2      1.821 CV     1
 OR { 1318}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 7    and name HB2 ))
 ASSI { 1322}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 6    and name HB2 ))
      4.400     2.400     1.600 peak  1322 spectrum    1 weight  0.10000E+01 volume  0.67265E-03 ppm1      9.051 ppm2      1.334 CV     1
 OR { 1322}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 7    and name HB3 ))
 ASSI { 1372}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HA  ))
      3.400     1.400     1.400 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.11872E-02 ppm1      8.364 ppm2      4.719 CV     1
 OR { 1372}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 4    and name HA  ))
 ASSI { 1441}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 70   and name HA  ))
      3.300     1.300     1.300 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.15073E-02 ppm1      7.557 ppm2      3.925 CV     1
 OR { 1441}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 1459}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 32   and name H   ))
      3.000     1.100     1.100 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.11110E-02 ppm1      8.345 ppm2      8.084 CV     1
 OR { 1459}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 69   and name H   ))
 ASSI { 1485}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 68   and name HG  ))
      2.600     0.800     0.800 peak  1485 spectrum    1 weight  0.10000E+01 volume  0.23286E-02 ppm1      8.350 ppm2      1.657 CV     1
 OR { 1485}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 30   and name HG3 ))
 ASSI { 1518}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 24   and name HE% )
      3.000     1.100     1.100 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.41654E-02 ppm1      7.469 ppm2      2.048 CV     1
 OR { 1518}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 1587}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 60   and name HG12))
      3.000     1.100     1.100 peak  1587 spectrum    1 weight  0.10000E+01 volume  0.24982E-02 ppm1      7.231 ppm2      0.929 CV     1
 OR { 1587}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 51   and name HB2 ))
 ASSI { 1617}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 125  and name HB3 ))
      3.500     1.600     1.600 peak  1617 spectrum    1 weight  0.10000E+01 volume  0.13377E-02 ppm1      8.026 ppm2      2.452 CV     1
 OR { 1617}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 55   and name HB3 ))
 ASSI { 1644}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HD3 ))
      3.600     1.600     1.600 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.22428E-02 ppm1      8.133 ppm2      1.638 CV     1
 OR { 1644}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HD2 ))
 OR { 1644}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 58   and name HD2 ))
 ASSI { 1671}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 59   and name HA3 ))
      3.000     1.200     1.200 peak  1671 spectrum    1 weight  0.10000E+01 volume  0.59569E-02 ppm1      8.027 ppm2      3.709 CV     1
 OR { 1671}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 52   and name HB3 ))
 ASSI { 1713}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 60   and name HG13))
      3.600     1.600     1.600 peak  1713 spectrum    1 weight  0.10000E+01 volume  0.14006E-02 ppm1      8.431 ppm2      1.306 CV     1
 OR { 1713}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 51   and name HG  ))
 ASSI { 1724}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 49   and name HA  ))
      2.700     0.900     0.900 peak  1724 spectrum    1 weight  0.10000E+01 volume  0.18198E-02 ppm1      9.124 ppm2      5.427 CV     1
 OR { 1724}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 81   and name HA  ))
 ASSI { 1756}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 49   and name HA  ))
      4.300     2.300     1.700 peak  1756 spectrum    1 weight  0.10000E+01 volume  0.42303E-03 ppm1      8.610 ppm2      5.417 CV     1
 OR { 1756}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 81   and name HA  ))
 ASSI { 1843}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 40   and name HB2 ))
      3.200     1.300     1.300 peak  1843 spectrum    1 weight  0.10000E+01 volume  0.42533E-02 ppm1      7.365 ppm2      1.701 CV     1
 OR { 1843}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 33   and name HB3 ))
 ASSI { 1872}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 38   and name HG2 ))
      3.100     1.200     1.200 peak  1872 spectrum    1 weight  0.10000E+01 volume  0.24010E-02 ppm1      9.469 ppm2      2.243 CV     1
 OR { 1872}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 37   and name HB3 ))
 ASSI { 1879}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 36   and name HB  ))
      2.500     0.800     0.800 peak  1879 spectrum    1 weight  0.10000E+01 volume  0.43370E-02 ppm1      7.977 ppm2      1.873 CV     1
 OR { 1879}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 36   and name HB  ))
 ASSI { 1905}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 37   and name HD3 ))
      3.900     1.900     1.900 peak  1905 spectrum    1 weight  0.10000E+01 volume  0.97755E-03 ppm1      7.981 ppm2      3.760 CV     1
 OR { 1905}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 37   and name HD2 ))
 OR { 1905}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 37   and name HD2 ))
 ASSI { 1956}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 32   and name HG12))
      4.200     2.200     1.800 peak  1956 spectrum    1 weight  0.10000E+01 volume  0.99089E-03 ppm1      8.088 ppm2      0.986 CV     1
 OR { 1956}
   (( segid "    " and resid 32   and name H   ))
   (  segid "    " and resid 28   and name HB% )
 ASSI { 2007}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 23   and name HB  ))
      4.400     2.400     1.600 peak  2007 spectrum    1 weight  0.10000E+01 volume  0.83464E-03 ppm1      8.611 ppm2      3.913 CV     1
 OR { 2007}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI { 2020}
   (( segid "    " and resid 28   and name H   ))
   (  segid "    " and resid 49   and name HD1%)
      4.000     2.000     2.000 peak  2020 spectrum    1 weight  0.10000E+01 volume  0.11376E-02 ppm1      8.611 ppm2      0.750 CV     1
 OR { 2020}
   (( segid "    " and resid 28   and name H   ))
   (  segid "    " and resid 25   and name HG1%)
 ASSI { 2052}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 25   and name HB  ))
      2.900     1.100     1.100 peak  2052 spectrum    1 weight  0.10000E+01 volume  0.20866E-02 ppm1      8.697 ppm2      2.741 CV     1
 OR { 2052}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 24   and name HG3 ))
 ASSI { 2078}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 25   and name HB  ))
      2.700     0.900     0.900 peak  2078 spectrum    1 weight  0.10000E+01 volume  0.17131E-02 ppm1      9.462 ppm2      2.748 CV     1
 OR { 2078}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 24   and name HG3 ))
 ASSI { 2111}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 20   and name HB3 ))
      2.800     1.000     1.000 peak  2111 spectrum    1 weight  0.10000E+01 volume  0.22333E-02 ppm1      7.377 ppm2      2.125 CV     1
 OR { 2111}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 21   and name HG2 ))
 ASSI { 2115}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 23   and name HG2%)
      3.000     1.100     1.100 peak  2115 spectrum    1 weight  0.10000E+01 volume  0.21095E-02 ppm1      7.709 ppm2      1.370 CV     1
 OR { 2115}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 67   and name HB% )
 ASSI { 2202}
   (( segid "    " and resid 14   and name H   ))
   (  segid "    " and resid 13   and name HG2%)
      2.300     0.600     0.600 peak  2202 spectrum    1 weight  0.10000E+01 volume  0.52441E-02 ppm1      8.202 ppm2      0.803 CV     1
 OR { 2202}
   (( segid "    " and resid 14   and name H   ))
   (  segid "    " and resid 14   and name HG1%)
 ASSI { 2227}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name H   ))
      4.100     2.100     1.900 peak  2227 spectrum    1 weight  0.10000E+01 volume  0.63456E-03 ppm1      8.885 ppm2      8.664 CV     1
 OR { 2227}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 7    and name H   ))
 ASSI { 2242}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 17   and name HB3 ))
      3.900     1.900     1.900 peak  2242 spectrum    1 weight  0.10000E+01 volume  0.79081E-03 ppm1      8.883 ppm2      1.471 CV     1
 OR { 2242}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 17   and name HB2 ))
 OR { 2242}
   (( segid "    " and resid 6    and name H   ))
   (  segid "    " and resid 79   and name HE% )
 ASSI { 2250}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 79   and name H   ))
      4.000     2.000     2.000 peak  2250 spectrum    1 weight  0.10000E+01 volume  0.61169E-03 ppm1      8.855 ppm2      9.039 CV     1
 OR { 2250}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 8    and name H   ))
 ASSI { 2265}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 79   and name HB3 ))
      4.900     3.000     1.100 peak  2265 spectrum    1 weight  0.10000E+01 volume  0.40016E-03 ppm1      8.854 ppm2      1.814 CV     1
 OR { 2265}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 14   and name HB  ))
 ASSI { 2270}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 15   and name HB2 ))
      3.900     1.900     1.900 peak  2270 spectrum    1 weight  0.10000E+01 volume  0.81368E-03 ppm1      9.021 ppm2      1.469 CV     1
 OR { 2270}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 2276}
   (( segid "    " and resid 8    and name H   ))
   (  segid "    " and resid 14   and name HG2%)
      3.200     1.300     1.300 peak  2276 spectrum    1 weight  0.10000E+01 volume  0.24429E-02 ppm1      9.025 ppm2      0.721 CV     1
 OR { 2276}
   (( segid "    " and resid 8    and name H   ))
   (  segid "    " and resid 8    and name HD1%)
 ASSI { 2292}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HA  ))
      2.500     0.800     0.800 peak  2292 spectrum    1 weight  0.10000E+01 volume  0.28469E-02 ppm1      8.655 ppm2      4.720 CV     1
 OR { 2292}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI { 2301}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 21   and name HB3 ))
      4.800     2.800     1.200 peak  2301 spectrum    1 weight  0.10000E+01 volume  0.48020E-03 ppm1      8.726 ppm2      2.347 CV     1
 OR { 2301}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 20   and name HG2 ))
 ASSI { 2312}
   (( segid "    " and resid 5    and name H   ))
   (  segid "    " and resid 4    and name HD1%)
      3.700     1.800     1.800 peak  2312 spectrum    1 weight  0.10000E+01 volume  0.28622E-02 ppm1      8.655 ppm2      0.706 CV     1
 OR { 2312}
   (( segid "    " and resid 5    and name H   ))
   (  segid "    " and resid 6    and name HD1%)
 ASSI { 2325}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 21   and name HB3 ))
      4.900     3.000     1.100 peak  2325 spectrum    1 weight  0.10000E+01 volume  0.48782E-03 ppm1      7.851 ppm2      2.358 CV     1
 OR { 2325}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 20   and name HG2 ))
 OR { 2325}
   (( segid "    " and resid 3    and name H   ))
   (( segid "    " and resid 20   and name HG3 ))
 ASSI { 2445}
   (( segid "    " and resid 123  and name HD22))
   (( segid "    " and resid 123  and name HA  ))
      5.100     3.200     0.900 peak  2445 spectrum    1 weight  0.10000E+01 volume  0.71268E-03 ppm1      6.688 ppm2      4.897 CV     1
 OR { 2445}
   (( segid "    " and resid 18   and name HE22))
   (( segid "    " and resid 5    and name HA  ))
 ASSI { 2477}
   (( segid "    " and resid 85   and name HE22))
   (  segid "    " and resid 114  and name HG2%)
      4.300     2.300     1.700 peak  2477 spectrum    1 weight  0.10000E+01 volume  0.76605E-03 ppm1      7.282 ppm2      1.160 CV     1
 OR { 2477}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 2496}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 102  and name HA  ))
      4.100     2.100     1.900 peak  2496 spectrum    1 weight  0.10000E+01 volume  0.72793E-03 ppm1      7.283 ppm2      4.655 CV     1
 OR { 2496}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 2504}
   (( segid "    " and resid 91   and name HE  ))
   (  segid "    " and resid 97   and name HG2%)
      3.100     1.200     1.200 peak  2504 spectrum    1 weight  0.10000E+01 volume  0.19932E-02 ppm1      7.935 ppm2      0.702 CV     1
 OR { 2504}
   (( segid "    " and resid 91   and name HE  ))
   (  segid "    " and resid 192  and name HD2%)
 ASSI { 2512}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 44   and name HA  ))
      4.800     2.900     1.200 peak  2512 spectrum    1 weight  0.10000E+01 volume  0.46686E-03 ppm1      7.669 ppm2      4.222 CV     1
 OR { 2512}
   (( segid "    " and resid 33   and name HE  ))
   (( segid "    " and resid 40   and name HA  ))
 ASSI { 2527}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 178  and name HG3 ))
      3.200     1.300     1.300 peak  2527 spectrum    1 weight  0.10000E+01 volume  0.30281E-02 ppm1      7.408 ppm2      1.523 CV     1
 OR { 2527}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 86   and name HG3 ))
 ASSI { 2610}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 50   and name HB2 ))
      4.100     2.100     1.900 peak  2610 spectrum    1 weight  0.10000E+01 volume  0.68601E-03 ppm1     10.989 ppm2      2.420 CV     1
 OR { 2610}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 105  and name HB3 ))
 ASSI { 2614}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 86   and name HG3 ))
      6.000     4.600     0.000 peak  2614 spectrum    1 weight  0.10000E+01 volume  0.23820E-03 ppm1     10.990 ppm2      1.526 CV     1
 OR { 2614}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 82   and name HG3 ))
 ASSI { 2627}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HA  ))
      2.100     0.600     0.600 peak  2627 spectrum    1 weight  0.10000E+01 volume  0.13476E-01 ppm1      8.081 ppm2      4.210 CV     1
 OR { 2627}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI { 2657}
   (( segid "    " and resid 181  and name H   ))
   (( segid "    " and resid 181  and name HA  ))
      3.200     1.300     1.300 peak  2657 spectrum    1 weight  0.10000E+01 volume  0.13472E-02 ppm1      8.746 ppm2      3.988 CV     1
 OR { 2657}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 2700}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 132  and name HG2 ))
      2.800     2.800     3.200 peak  2700 spectrum    1 weight  0.10000E+01 volume  0.58119E-03 ppm1     10.155 ppm2      1.981 CV     1
 OR { 2700}
   (( segid "    " and resid 173  and name HE1 ))
   (( segid "    " and resid 170  and name HB3 ))
 ASSI { 2702}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 133  and name HG  ))
      4.100     2.100     1.900 peak  2702 spectrum    1 weight  0.10000E+01 volume  0.17112E-02 ppm1      9.030 ppm2      1.463 CV     1
 OR { 2702}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 133  and name HB3 ))
 OR { 2702}
   (( segid "    " and resid 131  and name HE  ))
   (( segid "    " and resid 129  and name HB3 ))
 ASSI { 2703}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 197  and name HB3 ))
      4.300     2.300     1.700 peak  2703 spectrum    1 weight  0.10000E+01 volume  0.82701E-03 ppm1      8.238 ppm2      2.688 CV     1
 OR { 2703}
   (( segid "    " and resid 200  and name H   ))
   (( segid "    " and resid 201  and name HB3 ))
 ASSI { 2704}
   (( segid "    " and resid 194  and name H   ))
   (  segid "    " and resid 129  and name HD2%)
      2.600     2.600     3.400 peak  2704 spectrum    1 weight  0.10000E+01 volume  0.84797E-03 ppm1      8.641 ppm2      0.637 CV     1
 OR { 2704}
   (( segid "    " and resid 194  and name H   ))
   (  segid "    " and resid 112  and name HD2%)
 OR { 2704}
   (( segid "    " and resid 194  and name H   ))
   (  segid "    " and resid 90   and name HG2%)
 ASSI { 2705}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 91   and name HB3 ))
      3.800     1.800     1.800 peak  2705 spectrum    1 weight  0.10000E+01 volume  0.63265E-03 ppm1      7.886 ppm2      1.656 CV     1
 OR { 2705}
   (( segid "    " and resid 193  and name H   ))
   (( segid "    " and resid 90   and name HB  ))
 ASSI { 2706}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 91   and name HB2 ))
      3.900     1.900     1.900 peak  2706 spectrum    1 weight  0.10000E+01 volume  0.63073E-03 ppm1      8.422 ppm2      1.361 CV     1
 OR { 2706}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 192  and name HG  ))
 OR { 2706}
   (( segid "    " and resid 191  and name H   ))
   (( segid "    " and resid 192  and name HB2 ))
 ASSI { 2707}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 106  and name HB3 ))
      3.300     1.400     1.400 peak  2707 spectrum    1 weight  0.10000E+01 volume  0.36338E-02 ppm1      7.022 ppm2      1.908 CV     1
 OR { 2707}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 2707}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 111  and name HE% )
 ASSI { 2708}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 112  and name HD2%)
      4.500     2.600     1.500 peak  2708 spectrum    1 weight  0.10000E+01 volume  0.66694E-03 ppm1      7.022 ppm2      0.685 CV     1
 OR { 2708}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 115  and name HD1%)
 OR { 2708}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 129  and name HD1%)
 OR { 2708}
   (( segid "    " and resid 189  and name H   ))
   (  segid "    " and resid 90   and name HD1%)
 OR { 2708}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 102  and name HG2%)
 OR { 2708}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 174  and name HD1%)
 OR { 2708}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 88   and name HD1%)
 OR { 2708}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 129  and name HD2%)
 OR { 2708}
   (( segid "    " and resid 189  and name H   ))
   (  segid "    " and resid 192  and name HD2%)
 ASSI { 2714}
   (( segid "    " and resid 186  and name H   ))
   (  segid "    " and resid 185  and name HG2%)
      3.500     1.500     1.500 peak  2714 spectrum    1 weight  0.10000E+01 volume  0.20428E-02 ppm1      8.813 ppm2      0.758 CV     1
 OR { 2714}
   (( segid "    " and resid 186  and name H   ))
   (  segid "    " and resid 133  and name HD1%)
 ASSI { 2715}
   (( segid "    " and resid 185  and name H   ))
   (  segid "    " and resid 180  and name HD2%)
      3.000     3.000     3.000 peak  2715 spectrum    1 weight  0.10000E+01 volume  0.82701E-03 ppm1      7.337 ppm2      0.602 CV     1
 OR { 2715}
   (( segid "    " and resid 185  and name H   ))
   (  segid "    " and resid 90   and name HD1%)
 ASSI { 2716}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 57   and name HB3 ))
      3.000     3.000     3.000 peak  2716 spectrum    1 weight  0.10000E+01 volume  0.52023E-03 ppm1      7.699 ppm2      1.790 CV     1
 OR { 2716}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 181  and name HB3 ))
 OR { 2716}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 57   and name HB2 ))
 OR { 2716}
   (( segid "    " and resid 184  and name H   ))
   (( segid "    " and resid 189  and name HB2 ))
 ASSI { 2718}
   (( segid "    " and resid 112  and name H   ))
   (  segid "    " and resid 115  and name HD1%)
      3.900     1.900     1.900 peak  2718 spectrum    1 weight  0.10000E+01 volume  0.20256E-02 ppm1      8.752 ppm2      0.683 CV     1
 OR { 2718}
   (( segid "    " and resid 112  and name H   ))
   (  segid "    " and resid 112  and name HD2%)
 ASSI { 2722}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 133  and name HB3 ))
      5.100     3.300     0.900 peak  2722 spectrum    1 weight  0.10000E+01 volume  0.51260E-03 ppm1      7.909 ppm2      1.441 CV     1
 OR { 2722}
   (( segid "    " and resid 170  and name H   ))
   (( segid "    " and resid 171  and name HG  ))
 ASSI { 2723}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HA  ))
      2.000     0.500     0.500 peak  2723 spectrum    1 weight  0.10000E+01 volume  0.19433E-01 ppm1      8.083 ppm2      4.252 CV     1
 OR { 2723}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
 OR { 2723}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 2727}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 135  and name HB2 ))
      2.900     1.100     1.100 peak  2727 spectrum    1 weight  0.10000E+01 volume  0.34586E-02 ppm1      8.132 ppm2      1.896 CV     1
 OR { 2727}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 135  and name HB2 ))
 OR { 2727}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 136  and name HB3 ))
 ASSI { 2728}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HG2 ))
      3.000     1.100     1.100 peak  2728 spectrum    1 weight  0.10000E+01 volume  0.72201E-02 ppm1      8.083 ppm2      1.325 CV     1
 OR { 2728}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 137  and name HG3 ))
 OR { 2728}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HG3 ))
 OR { 2728}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 137  and name HG2 ))
 ASSI { 2729}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 169  and name HA  ))
      3.900     1.900     1.900 peak  2729 spectrum    1 weight  0.10000E+01 volume  0.93943E-03 ppm1      8.207 ppm2      4.437 CV     1
 OR { 2729}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 134  and name HA  ))
 OR { 2729}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 131  and name HA  ))
 OR { 2729}
   (( segid "    " and resid 171  and name H   ))
   (( segid "    " and resid 169  and name HA  ))
 ASSI { 2731}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 132  and name H   ))
      4.500     2.500     1.500 peak  2731 spectrum    1 weight  0.10000E+01 volume  0.47069E-03 ppm1      8.420 ppm2      8.706 CV     1
 OR { 2731}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 26   and name H   ))
 ASSI { 2732}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 125  and name HB3 ))
      4.500     2.600     1.500 peak  2732 spectrum    1 weight  0.10000E+01 volume  0.47257E-03 ppm1      7.806 ppm2      2.450 CV     1
 OR { 2732}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 197  and name HB2 ))
 ASSI { 2733}
   (( segid "    " and resid 127  and name H   ))
   (  segid "    " and resid 112  and name HD1%)
      4.400     2.400     1.600 peak  2733 spectrum    1 weight  0.10000E+01 volume  0.11833E-02 ppm1      7.807 ppm2      0.734 CV     1
 OR { 2733}
   (( segid "    " and resid 127  and name H   ))
   (  segid "    " and resid 193  and name HD2%)
 ASSI { 2736}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 119  and name HG12))
      4.200     2.200     1.800 peak  2736 spectrum    1 weight  0.10000E+01 volume  0.77176E-03 ppm1      7.686 ppm2      1.255 CV     1
 OR { 2736}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 119  and name HG13))
 OR { 2736}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 100  and name HG12))
 ASSI { 2737}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 115  and name HG2%)
      4.500     2.600     1.500 peak  2737 spectrum    1 weight  0.10000E+01 volume  0.11872E-02 ppm1      7.688 ppm2      0.758 CV     1
 OR { 2737}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 115  and name HG13))
 OR { 2737}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 119  and name HG2%)
 OR { 2737}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 115  and name HG12))
 ASSI { 2738}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 131  and name HB3 ))
      4.600     2.700     1.400 peak  2738 spectrum    1 weight  0.10000E+01 volume  0.62311E-03 ppm1      8.674 ppm2      1.558 CV     1
 OR { 2738}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 4    and name HB2 ))
 OR { 2738}
   (( segid "    " and resid 190  and name H   ))
   (( segid "    " and resid 192  and name HB3 ))
 OR { 2738}
   (( segid "    " and resid 7    and name H   ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI { 2739}
   (( segid "    " and resid 121  and name H   ))
   (  segid "    " and resid 117  and name HB% )
      3.300     3.300     2.700 peak  2739 spectrum    1 weight  0.10000E+01 volume  0.48973E-03 ppm1      7.939 ppm2      1.437 CV     1
 OR { 2739}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 193  and name HG  ))
 ASSI { 2740}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 117  and name HA  ))
      3.100     1.200     1.200 peak  2740 spectrum    1 weight  0.10000E+01 volume  0.22257E-02 ppm1      7.546 ppm2      4.112 CV     1
 OR { 2740}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 118  and name HA  ))
 OR { 2740}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 2742}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 119  and name HG12))
      4.200     2.200     1.800 peak  2742 spectrum    1 weight  0.10000E+01 volume  0.74698E-03 ppm1      7.754 ppm2      1.221 CV     1
 OR { 2742}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 121  and name HB  ))
 ASSI { 2744}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 118  and name HB2 ))
      4.900     3.000     1.100 peak  2744 spectrum    1 weight  0.10000E+01 volume  0.52594E-03 ppm1      8.348 ppm2      1.936 CV     1
 OR { 2744}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 2744}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 119  and name HB  ))
 OR { 2744}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 2745}
   (( segid "    " and resid 93   and name H   ))
   (  segid "    " and resid 92   and name HE% )
      5.100     3.200     0.900 peak  2745 spectrum    1 weight  0.10000E+01 volume  0.49164E-03 ppm1      8.533 ppm2      1.922 CV     1
 OR { 2745}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 2745}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 118  and name HB2 ))
 OR { 2745}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 119  and name HB  ))
 OR { 2745}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 2746}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 112  and name HB3 ))
      2.600     0.800     0.800 peak  2746 spectrum    1 weight  0.10000E+01 volume  0.25477E-02 ppm1      7.651 ppm2      1.805 CV     1
 OR { 2746}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 126  and name HG2 ))
 ASSI { 2747}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 112  and name HB3 ))
      4.400     2.400     1.600 peak  2747 spectrum    1 weight  0.10000E+01 volume  0.83464E-03 ppm1      7.488 ppm2      1.803 CV     1
 OR { 2747}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 118  and name HG3 ))
 OR { 2747}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 2748}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 112  and name HB2 ))
      4.400     2.500     1.600 peak  2748 spectrum    1 weight  0.10000E+01 volume  0.79272E-03 ppm1      7.487 ppm2      1.631 CV     1
 OR { 2748}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 35   and name HG3 ))
 OR { 2748}
   (( segid "    " and resid 33   and name H   ))
   (  segid "    " and resid 17   and name HE% )
 OR { 2748}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 40   and name HG  ))
 OR { 2748}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 118  and name HG2 ))
 OR { 2748}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI { 2749}
   (( segid "    " and resid 111  and name H   ))
   (  segid "    " and resid 115  and name HD1%)
      5.200     3.300     0.800 peak  2749 spectrum    1 weight  0.10000E+01 volume  0.59644E-03 ppm1      8.415 ppm2      0.656 CV     1
 OR { 2749}
   (( segid "    " and resid 111  and name H   ))
   (  segid "    " and resid 112  and name HD2%)
 OR { 2749}
   (( segid "    " and resid 111  and name H   ))
   (  segid "    " and resid 88   and name HD1%)
 OR { 2749}
   (( segid "    " and resid 111  and name H   ))
   (  segid "    " and resid 174  and name HD1%)
 ASSI { 2750}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 103  and name HB3 ))
      4.100     2.200     1.900 peak  2750 spectrum    1 weight  0.10000E+01 volume  0.10100E-02 ppm1      7.227 ppm2      2.606 CV     1
 OR { 2750}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 110  and name HB3 ))
 ASSI { 2751}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 102  and name HB  ))
      4.500     2.600     1.500 peak  2751 spectrum    1 weight  0.10000E+01 volume  0.46877E-03 ppm1      8.399 ppm2      1.952 CV     1
 OR { 2751}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 106  and name HB3 ))
 OR { 2751}
   (( segid "    " and resid 104  and name H   ))
   (  segid "    " and resid 111  and name HE% )
 OR { 2751}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI { 2753}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 90   and name HG12))
      4.800     2.800     1.200 peak  2753 spectrum    1 weight  0.10000E+01 volume  0.43065E-03 ppm1      8.414 ppm2      1.081 CV     1
 OR { 2753}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 100  and name HG13))
 ASSI { 2754}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 100  and name HG2%)
      4.400     2.500     1.600 peak  2754 spectrum    1 weight  0.10000E+01 volume  0.82130E-03 ppm1      8.415 ppm2      0.669 CV     1
 OR { 2754}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 100  and name HD1%)
 OR { 2754}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 90   and name HG2%)
 ASSI { 2757}
   (( segid "    " and resid 95   and name H   ))
   (  segid "    " and resid 193  and name HD2%)
      4.700     2.800     1.300 peak  2757 spectrum    1 weight  0.10000E+01 volume  0.52403E-03 ppm1      7.981 ppm2      0.711 CV     1
 OR { 2757}
   (( segid "    " and resid 95   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI { 2758}
   (( segid "    " and resid 96   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
      5.000     3.200     1.000 peak  2758 spectrum    1 weight  0.10000E+01 volume  0.34111E-03 ppm1      8.048 ppm2      0.681 CV     1
 OR { 2758}
   (( segid "    " and resid 96   and name H   ))
   (  segid "    " and resid 193  and name HD2%)
 ASSI { 2759}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 91   and name HB3 ))
      4.500     2.500     1.500 peak  2759 spectrum    1 weight  0.10000E+01 volume  0.74318E-03 ppm1      8.936 ppm2      1.646 CV     1
 OR { 2759}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 90   and name HB  ))
 ASSI { 2760}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name H   ))
      4.700     2.800     1.300 peak  2760 spectrum    1 weight  0.10000E+01 volume  0.42494E-03 ppm1      8.810 ppm2      8.446 CV     1
 OR { 2760}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 99   and name H   ))
 ASSI { 2762}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 85   and name HG2 ))
      4.400     2.400     1.600 peak  2762 spectrum    1 weight  0.10000E+01 volume  0.99280E-03 ppm1      9.303 ppm2      1.882 CV     1
 OR { 2762}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 88   and name HB2 ))
 OR { 2762}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 101  and name HB2 ))
 OR { 2762}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 87   and name HG3 ))
 ASSI { 2763}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 8    and name HG2%)
      2.800     2.800     3.200 peak  2763 spectrum    1 weight  0.10000E+01 volume  0.56786E-03 ppm1      8.681 ppm2      0.739 CV     1
 OR { 2763}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 49   and name HD1%)
 OR { 2763}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 8    and name HD1%)
 OR { 2763}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
 OR { 2763}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 25   and name HG1%)
 ASSI { 2764}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 7    and name HD3 ))
      4.100     2.100     1.900 peak  2764 spectrum    1 weight  0.10000E+01 volume  0.35253E-03 ppm1      8.156 ppm2      1.459 CV     1
 OR { 2764}
   (( segid "    " and resid 78   and name H   ))
   (  segid "    " and resid 79   and name HE% )
 OR { 2764}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 8    and name HG12))
 ASSI { 2765}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 73   and name HB3 ))
      5.000     3.100     1.000 peak  2765 spectrum    1 weight  0.10000E+01 volume  0.38874E-03 ppm1      8.160 ppm2      1.336 CV     1
 OR { 2765}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 51   and name HG  ))
 OR { 2765}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 7    and name HB3 ))
 ASSI { 2767}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 74   and name HG3 ))
      3.700     1.700     1.700 peak  2767 spectrum    1 weight  0.10000E+01 volume  0.87084E-03 ppm1      8.070 ppm2      1.617 CV     1
 OR { 2767}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 6    and name HB3 ))
 OR { 2767}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 58   and name HD3 ))
 OR { 2767}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 58   and name HD2 ))
 ASSI { 2769}
   (( segid "    " and resid 73   and name H   ))
   (  segid "    " and resid 51   and name HD2%)
      4.200     2.200     1.800 peak  2769 spectrum    1 weight  0.10000E+01 volume  0.17207E-02 ppm1      6.773 ppm2      0.708 CV     1
 OR { 2769}
   (( segid "    " and resid 73   and name H   ))
   (  segid "    " and resid 4    and name HD2%)
 OR { 2769}
   (( segid "    " and resid 73   and name H   ))
   (  segid "    " and resid 6    and name HD1%)
 ASSI { 2770}
   (( segid "    " and resid 72   and name H   ))
   (  segid "    " and resid 51   and name HD2%)
      5.700     4.000     0.300 peak  2770 spectrum    1 weight  0.10000E+01 volume  0.34491E-03 ppm1      7.824 ppm2      0.718 CV     1
 OR { 2770}
   (( segid "    " and resid 72   and name H   ))
   (  segid "    " and resid 6    and name HD1%)
 ASSI { 2772}
   (( segid "    " and resid 71   and name H   ))
   (  segid "    " and resid 4    and name HD2%)
      4.900     3.100     1.100 peak  2772 spectrum    1 weight  0.10000E+01 volume  0.52974E-03 ppm1      7.557 ppm2      0.721 CV     1
 OR { 2772}
   (( segid "    " and resid 71   and name H   ))
   (  segid "    " and resid 6    and name HD1%)
 OR { 2772}
   (( segid "    " and resid 71   and name H   ))
   (  segid "    " and resid 4    and name HD1%)
 OR { 2772}
   (( segid "    " and resid 71   and name H   ))
   (  segid "    " and resid 51   and name HD2%)
 ASSI { 2773}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 73   and name HG  ))
      4.600     2.600     1.400 peak  2773 spectrum    1 weight  0.10000E+01 volume  0.49353E-03 ppm1      8.077 ppm2      1.498 CV     1
 OR { 2773}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 4    and name HG  ))
 OR { 2773}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 2774}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 66   and name HG2 ))
      5.000     3.200     1.000 peak  2774 spectrum    1 weight  0.10000E+01 volume  0.42494E-03 ppm1      8.081 ppm2      0.988 CV     1
 OR { 2774}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 28   and name HB% )
 OR { 2774}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 66   and name HG3 ))
 ASSI { 2775}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 66   and name HD3 ))
      5.100     3.300     0.900 peak  2775 spectrum    1 weight  0.10000E+01 volume  0.38111E-03 ppm1      8.337 ppm2      0.877 CV     1
 OR { 2775}
   (( segid "    " and resid 31   and name H   ))
   (  segid "    " and resid 49   and name HD2%)
 OR { 2775}
   (( segid "    " and resid 68   and name H   ))
   (  segid "    " and resid 6    and name HD2%)
 OR { 2775}
   (( segid "    " and resid 68   and name H   ))
   (  segid "    " and resid 49   and name HD2%)
 OR { 2775}
   (( segid "    " and resid 31   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 2784}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 73   and name HB3 ))
      5.100     3.200     0.900 peak  2784 spectrum    1 weight  0.10000E+01 volume  0.45732E-03 ppm1      8.028 ppm2      1.306 CV     1
 OR { 2784}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 60   and name HG13))
 OR { 2784}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 51   and name HG  ))
 OR { 2784}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 58   and name HG2 ))
 ASSI { 2786}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 84   and name HB3 ))
      5.300     3.600     0.700 peak  2786 spectrum    1 weight  0.10000E+01 volume  0.45161E-03 ppm1      8.609 ppm2      0.906 CV     1
 OR { 2786}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 83   and name HG3 ))
 OR { 2786}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2787}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 82   and name HB2 ))
      5.000     3.100     1.000 peak  2787 spectrum    1 weight  0.10000E+01 volume  0.45544E-03 ppm1      8.608 ppm2      1.461 CV     1
 OR { 2787}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 82   and name HG2 ))
 OR { 2787}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 49   and name HB2 ))
 OR { 2787}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 83   and name HD2 ))
 OR { 2787}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 83   and name HD3 ))
 ASSI { 2788}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HG2 ))
      4.800     2.800     1.200 peak  2788 spectrum    1 weight  0.10000E+01 volume  0.55261E-03 ppm1      7.850 ppm2      1.868 CV     1
 OR { 2788}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 2788}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 2790}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 44   and name HB3 ))
      4.500     2.500     1.500 peak  2790 spectrum    1 weight  0.10000E+01 volume  0.10900E-02 ppm1      7.584 ppm2      1.967 CV     1
 OR { 2790}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name HG2 ))
 OR { 2790}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name HG3 ))
 ASSI { 2791}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name HB3 ))
      5.000     3.200     1.000 peak  2791 spectrum    1 weight  0.10000E+01 volume  0.45732E-03 ppm1      7.584 ppm2      2.318 CV     1
 OR { 2791}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI { 2793}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 20   and name HG2 ))
      4.700     2.700     1.300 peak  2793 spectrum    1 weight  0.10000E+01 volume  0.49353E-03 ppm1      7.973 ppm2      2.353 CV     1
 OR { 2793}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 21   and name HB3 ))
 OR { 2793}
   (( segid "    " and resid 2    and name H   ))
   (( segid "    " and resid 20   and name HG3 ))
 ASSI { 2796}
   (( segid "    " and resid 30   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
      4.100     2.100     1.900 peak  2796 spectrum    1 weight  0.10000E+01 volume  0.65552E-03 ppm1      7.176 ppm2      0.744 CV     1
 OR { 2796}
   (( segid "    " and resid 30   and name H   ))
   (  segid "    " and resid 49   and name HD1%)
 ASSI { 2797}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 30   and name H   ))
      4.300     2.300     1.700 peak  2797 spectrum    1 weight  0.10000E+01 volume  0.52023E-03 ppm1      8.610 ppm2      7.144 CV     1
 OR { 2797}
   (( segid "    " and resid 28   and name H   ))
   (  segid "    " and resid 19   and name HE% )
 ASSI { 2799}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 23   and name HA  ))
      4.400     2.400     1.600 peak  2799 spectrum    1 weight  0.10000E+01 volume  0.71648E-03 ppm1      6.716 ppm2      3.911 CV     1
 OR { 2799}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 23   and name HB  ))
 OR { 2799}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI { 2802}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 20   and name HB2 ))
      3.600     1.600     1.600 peak  2802 spectrum    1 weight  0.10000E+01 volume  0.96230E-03 ppm1      7.377 ppm2      1.923 CV     1
 OR { 2802}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 21   and name HG3 ))
 ASSI { 2805}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 8    and name HG13))
      4.500     2.500     1.500 peak  2805 spectrum    1 weight  0.10000E+01 volume  0.79081E-03 ppm1      9.133 ppm2      1.673 CV     1
 OR { 2805}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 17   and name HE% )
 ASSI { 2808}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 4    and name HB2 ))
      4.500     2.500     1.500 peak  2808 spectrum    1 weight  0.10000E+01 volume  0.12005E-02 ppm1      8.886 ppm2      1.563 CV     1
 OR { 2808}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI { 2811}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 18   and name HG2 ))
      4.400     2.500     1.600 peak  2811 spectrum    1 weight  0.10000E+01 volume  0.45924E-03 ppm1      8.726 ppm2      2.031 CV     1
 OR { 2811}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 18   and name HG3 ))
 OR { 2811}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 2    and name HB  ))
 ASSI { 2813}
   (( segid "    " and resid 172  and name HD22))
   (  segid "    " and resid 185  and name HG1%)
      2.600     2.600     3.400 peak  2813 spectrum    1 weight  0.10000E+01 volume  0.73173E-03 ppm1      6.980 ppm2      0.677 CV     1
 OR { 2813}
   (( segid "    " and resid 172  and name HD22))
   (  segid "    " and resid 174  and name HD2%)
 ASSI { 2814}
   (( segid "    " and resid 172  and name HD21))
   (  segid "    " and resid 185  and name HG1%)
      2.600     2.600     3.400 peak  2814 spectrum    1 weight  0.10000E+01 volume  0.73935E-03 ppm1      7.388 ppm2      0.687 CV     1
 OR { 2814}
   (( segid "    " and resid 172  and name HD21))
   (  segid "    " and resid 174  and name HD2%)
 ASSI { 2817}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 131  and name HB3 ))
      4.000     2.000     2.000 peak  2817 spectrum    1 weight  0.10000E+01 volume  0.83081E-03 ppm1      7.389 ppm2      1.564 CV     1
 OR { 2817}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 133  and name HB2 ))
 OR { 2817}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 138  and name HD3 ))
 ASSI { 2818}
   (( segid "    " and resid 172  and name HD21))
   (( segid "    " and resid 131  and name HB2 ))
      3.300     1.300     1.300 peak  2818 spectrum    1 weight  0.10000E+01 volume  0.98709E-03 ppm1      7.390 ppm2      1.996 CV     1
 OR { 2818}
   (( segid "    " and resid 202  and name HE22))
   (( segid "    " and resid 202  and name HB2 ))
 ASSI { 2821}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 84   and name HB3 ))
      5.000     3.100     1.000 peak  2821 spectrum    1 weight  0.10000E+01 volume  0.51640E-03 ppm1      7.283 ppm2      0.927 CV     1
 OR { 2821}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2822}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HB2 ))
      4.500     2.500     1.500 peak  2822 spectrum    1 weight  0.10000E+01 volume  0.11071E-02 ppm1      7.284 ppm2      1.560 CV     1
 OR { 2822}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 101  and name HB3 ))
 ASSI { 2825}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 178  and name HB3 ))
      3.600     1.600     1.600 peak  2825 spectrum    1 weight  0.10000E+01 volume  0.12996E-02 ppm1      7.409 ppm2      1.982 CV     1
 OR { 2825}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 187  and name HG2 ))
 ASSI { 2826}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 183  and name HG3 ))
      3.600     1.600     1.600 peak  2826 spectrum    1 weight  0.10000E+01 volume  0.23076E-02 ppm1      7.408 ppm2      2.594 CV     1
 OR { 2826}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 104  and name HB2 ))
 OR { 2826}
   (( segid "    " and resid 178  and name HE  ))
   (( segid "    " and resid 182  and name HG2 ))
 ASSI { 2827}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 88   and name HA  ))
      3.900     1.900     1.900 peak  2827 spectrum    1 weight  0.10000E+01 volume  0.62311E-03 ppm1      7.402 ppm2      4.629 CV     1
 OR { 2827}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 87   and name HA  ))
 OR { 2827}
   (( segid "    " and resid 86   and name HE  ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 2829}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 82   and name HD3 ))
      5.100     3.300     0.900 peak  2829 spectrum    1 weight  0.10000E+01 volume  0.23629E-03 ppm1     10.987 ppm2      2.178 CV     1
 OR { 2829}
   (( segid "    " and resid 61   and name HE1 ))
   (( segid "    " and resid 50   and name HB3 ))
 ASSI { 2830}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 91   and name HB3 ))
      4.600     2.600     1.400 peak  2830 spectrum    1 weight  0.10000E+01 volume  0.45732E-03 ppm1      8.936 ppm2      1.715 CV     1
 OR { 2830}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 93   and name HB2 ))
 ASSI { 2834}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 22   and name HB2 ))
      3.100     3.100     2.900 peak  2834 spectrum    1 weight  0.10000E+01 volume  0.30679E-03 ppm1      8.076 ppm2      3.795 CV     1
 OR { 2834}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 21   and name HD3 ))
 ASSI { 2835}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 98   and name HG3 ))
      3.900     1.900     1.900 peak  2835 spectrum    1 weight  0.10000E+01 volume  0.11624E-02 ppm1      8.806 ppm2      1.293 CV     1
 OR { 2835}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HG2 ))
 OR { 2835}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 98   and name HG2 ))
 OR { 2835}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HG3 ))
 ASSI { 2836}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
      4.100     2.100     1.900 peak  2836 spectrum    1 weight  0.10000E+01 volume  0.11167E-02 ppm1      9.212 ppm2      0.694 CV     1
 OR { 2836}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 192  and name HD1%)
 OR { 2836}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 193  and name HD2%)
 OR { 2836}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 192  and name HD2%)
 OR { 2836}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 115  and name HG2%)
 OR { 2836}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 115  and name HD1%)
 ASSI { 2838}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 102  and name HA  ))
      3.800     1.800     1.800 peak  2838 spectrum    1 weight  0.10000E+01 volume  0.39827E-03 ppm1      8.779 ppm2      4.608 CV     1
 OR { 2838}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI { 2839}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 125  and name HA  ))
      3.800     1.800     1.800 peak  2839 spectrum    1 weight  0.10000E+01 volume  0.79272E-03 ppm1      7.806 ppm2      4.417 CV     1
 OR { 2839}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI { 2845}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 127  and name HE% )
      5.300     3.600     0.700 peak  2845 spectrum    1 weight  0.10000E+01 volume  0.36207E-03 ppm1      8.688 ppm2      6.648 CV     1
 OR { 2845}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 123  and name HD22))
 ASSI { 2846}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 19   and name HD% )
      5.800     4.300     0.200 peak  2846 spectrum    1 weight  0.10000E+01 volume  0.32775E-03 ppm1      7.709 ppm2      7.061 CV     1
 OR { 2846}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 26   and name HD% )
 ASSI {    1}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 60   and name HG13))
      3.800     1.900     1.900 peak     1 spectrum    1 weight  0.10000E+01 volume  0.17038E-02 ppm1      5.489 ppm2      1.288 CV     1
 OR {    1}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 49   and name HB3 ))
 OR {    1}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 51   and name HG  ))
 ASSI {    5}
   (  segid "    " and resid 81   and name HD% )
   (( segid "    " and resid 47   and name HB3 ))
      3.600     1.600     1.600 peak     5 spectrum    1 weight  0.10000E+01 volume  0.19476E-02 ppm1      6.811 ppm2      1.785 CV     1
 OR {    5}
   (  segid "    " and resid 81   and name HD% )
   (( segid "    " and resid 49   and name HG  ))
 ASSI {    9}
   (  segid "    " and resid 19   and name HE% )
   (  segid "    " and resid 49   and name HD2%)
      3.900     1.900     1.900 peak     9 spectrum    1 weight  0.10000E+01 volume  0.23615E-02 ppm1      7.114 ppm2      0.877 CV     1
 OR {    9}
   (  segid "    " and resid 19   and name HE% )
   (  segid "    " and resid 6    and name HD2%)
 OR {    9}
   (  segid "    " and resid 19   and name HE% )
   (  segid "    " and resid 73   and name HD1%)
 OR {    9}
   (  segid "    " and resid 19   and name HE% )
   (  segid "    " and resid 36   and name HG2%)
 ASSI {   16}
   (  segid "    " and resid 19   and name HD% )
   (  segid "    " and resid 6    and name HD1%)
      2.400     0.700     0.700 peak    16 spectrum    1 weight  0.10000E+01 volume  0.76589E-02 ppm1      7.053 ppm2      0.710 CV     1
 OR {   16}
   (  segid "    " and resid 19   and name HD% )
   (  segid "    " and resid 8    and name HD1%)
 ASSI {   19}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 17   and name HB3 ))
      3.000     1.100     1.100 peak    19 spectrum    1 weight  0.10000E+01 volume  0.34558E-02 ppm1      7.053 ppm2      1.466 CV     1
 OR {   19}
   (  segid "    " and resid 19   and name HD% )
   (  segid "    " and resid 79   and name HE% )
 ASSI {   40}
   (  segid "    " and resid 26   and name HD% )
   (( segid "    " and resid 27   and name HB2 ))
      2.700     0.900     0.900 peak    40 spectrum    1 weight  0.10000E+01 volume  0.31379E-02 ppm1      7.064 ppm2      2.599 CV     1
 OR {   40}
   (  segid "    " and resid 26   and name HD% )
   (( segid "    " and resid 24   and name HG2 ))
 ASSI {   41}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 27   and name HB2 ))
      2.700     0.900     0.900 peak    41 spectrum    1 weight  0.10000E+01 volume  0.32374E-02 ppm1      6.778 ppm2      2.593 CV     1
 OR {   41}
   (  segid "    " and resid 26   and name HE% )
   (( segid "    " and resid 24   and name HG2 ))
 ASSI {   68}
   (  segid "    " and resid 47   and name HE% )
   (( segid "    " and resid 83   and name HB2 ))
      2.800     1.000     1.000 peak    68 spectrum    1 weight  0.10000E+01 volume  0.29456E-02 ppm1      7.075 ppm2      1.344 CV     1
 OR {   68}
   (  segid "    " and resid 47   and name HE% )
   (  segid "    " and resid 41   and name HB% )
 ASSI {   82}
   (  segid "    " and resid 50   and name HE% )
   (( segid "    " and resid 52   and name HB3 ))
      3.300     1.400     1.400 peak    82 spectrum    1 weight  0.10000E+01 volume  0.24353E-02 ppm1      6.499 ppm2      3.701 CV     1
 OR {   82}
   (  segid "    " and resid 50   and name HE% )
   (( segid "    " and resid 59   and name HA3 ))
 ASSI {   87}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 61   and name HA  ))
      3.400     1.500     1.500 peak    87 spectrum    1 weight  0.10000E+01 volume  0.99466E-03 ppm1      5.505 ppm2      4.882 CV     1
 OR {   87}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 79   and name HA  ))
 ASSI {   98}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 80   and name H   ))
      4.100     2.100     1.900 peak    98 spectrum    1 weight  0.10000E+01 volume  0.10941E-02 ppm1      5.497 ppm2      9.133 CV     1
 OR {   98}
   (  segid "    " and resid 50   and name HD% )
   (( segid "    " and resid 50   and name H   ))
 ASSI {  174}
   (  segid "    " and resid 81   and name HD% )
   (( segid "    " and resid 81   and name HA  ))
      3.100     1.200     1.200 peak   174 spectrum    1 weight  0.10000E+01 volume  0.28012E-02 ppm1      6.809 ppm2      5.407 CV     1
 OR {  174}
   (  segid "    " and resid 81   and name HD% )
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  213}
   (  segid "    " and resid 127  and name HE% )
   (( segid "    " and resid 124  and name HA  ))
      3.800     1.800     1.800 peak   213 spectrum    1 weight  0.10000E+01 volume  0.12161E-02 ppm1      6.624 ppm2      4.386 CV     1
 OR {  213}
   (  segid "    " and resid 199  and name HE% )
   (( segid "    " and resid 200  and name HA  ))
 ASSI {  232}
   (( segid "    " and resid 173  and name HH2 ))
   (( segid "    " and resid 194  and name HE  ))
      2.600     0.900     0.900 peak   232 spectrum    1 weight  0.10000E+01 volume  0.30738E-02 ppm1      6.848 ppm2      7.327 CV     1
 OR {  232}
   (( segid "    " and resid 173  and name HH2 ))
   (( segid "    " and resid 173  and name HZ2 ))
 ASSI {  271}
   (( segid "    " and resid 19   and name HZ  ))
   (( segid "    " and resid 32   and name HG13))
      3.500     1.500     1.500 peak   271 spectrum    1 weight  0.10000E+01 volume  0.15369E-02 ppm1      6.963 ppm2      0.989 CV     1
 OR {  271}
   (( segid "    " and resid 19   and name HZ  ))
   (  segid "    " and resid 28   and name HB% )
 ASSI {  272}
   (( segid "    " and resid 19   and name HZ  ))
   (( segid "    " and resid 17   and name HB3 ))
      3.000     1.100     1.100 peak   272 spectrum    1 weight  0.10000E+01 volume  0.19540E-02 ppm1      6.957 ppm2      1.460 CV     1
 OR {  272}
   (( segid "    " and resid 19   and name HZ  ))
   (( segid "    " and resid 17   and name HB2 ))
 OR {  272}
   (( segid "    " and resid 19   and name HZ  ))
   (( segid "    " and resid 8    and name HG12))
 ASSI {  273}
   (( segid "    " and resid 19   and name HZ  ))
   (( segid "    " and resid 8    and name HG13))
      2.900     1.000     1.000 peak   273 spectrum    1 weight  0.10000E+01 volume  0.22845E-02 ppm1      6.963 ppm2      1.674 CV     1
 OR {  273}
   (( segid "    " and resid 19   and name HZ  ))
   (  segid "    " and resid 17   and name HE% )
 ASSI {  275}
   (( segid "    " and resid 19   and name HZ  ))
   (  segid "    " and resid 19   and name HE% )
      2.400     0.700     0.700 peak   275 spectrum    1 weight  0.10000E+01 volume  0.75403E-02 ppm1      6.960 ppm2      7.114 CV     1
 OR {  275}
   (( segid "    " and resid 197  and name HZ  ))
   (  segid "    " and resid 197  and name HE% )
 ASSI {  280}
   (  segid "    " and resid 198  and name HD% )
   (( segid "    " and resid 198  and name HB2 ))
      2.600     0.800     0.800 peak   280 spectrum    1 weight  0.10000E+01 volume  0.56920E-02 ppm1      6.962 ppm2      2.685 CV     1
 OR {  280}
   (  segid "    " and resid 197  and name HD% )
   (( segid "    " and resid 197  and name HB3 ))
 ASSI {  282}
   (  segid "    " and resid 198  and name HE% )
   (( segid "    " and resid 195  and name HD3 ))
      3.500     1.500     1.500 peak   282 spectrum    1 weight  0.10000E+01 volume  0.12321E-02 ppm1      7.096 ppm2      2.685 CV     1
 OR {  282}
   (  segid "    " and resid 198  and name HE% )
   (( segid "    " and resid 198  and name HB2 ))
 ASSI {  283}
   (  segid "    " and resid 198  and name HD% )
   (( segid "    " and resid 198  and name H   ))
      3.800     1.800     1.800 peak   283 spectrum    1 weight  0.10000E+01 volume  0.13540E-02 ppm1      6.961 ppm2      8.155 CV     1
 OR {  283}
   (  segid "    " and resid 197  and name HD% )
   (( segid "    " and resid 198  and name H   ))
 ASSI {  304}
   (  segid "    " and resid 19   and name HE% )
   (( segid "    " and resid 17   and name HB3 ))
      2.600     0.900     0.900 peak   304 spectrum    1 weight  0.10000E+01 volume  0.51563E-02 ppm1      7.120 ppm2      1.468 CV     1
 OR {  304}
   (  segid "    " and resid 19   and name HE% )
   (( segid "    " and resid 17   and name HB2 ))
 OR {  304}
   (  segid "    " and resid 19   and name HE% )
   (  segid "    " and resid 79   and name HE% )
 OR {  304}
   (  segid "    " and resid 47   and name HE% )
   (( segid "    " and resid 83   and name HD3 ))
 ASSI {  305}
   (  segid "    " and resid 19   and name HE% )
   (  segid "    " and resid 17   and name HE% )
      2.800     1.000     1.000 peak   305 spectrum    1 weight  0.10000E+01 volume  0.37540E-02 ppm1      7.122 ppm2      1.660 CV     1
 OR {  305}
   (  segid "    " and resid 19   and name HE% )
   (( segid "    " and resid 8    and name HG13))

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY  -5           H1       GLY  -5 -27.063 -14.799   1.588
    2    H2   GLY  -5           H2       GLY  -5 -26.896 -16.324   2.312
    3    H3   GLY  -5           H3       GLY  -5 -27.319 -14.981   3.254
    4    HA2  GLY  -5           HA2      GLY  -5 -28.983 -16.203   1.119
    5    HA3  GLY  -5           HA3      GLY  -5 -29.259 -16.354   2.848
    6    H    ILE  -4           H        ILE  -4 -31.130 -15.259   3.177
    7    HA   ILE  -4           HA       ILE  -4 -31.482 -12.640   1.952
    8    HB   ILE  -4           HB       ILE  -4 -33.314 -13.924   3.981
    9   HG12  ILE  -4          HG12      ILE  -4 -33.441 -14.149   0.963
   10   HG13  ILE  -4          HG13      ILE  -4 -32.975 -15.450   2.055
   11   HG21  ILE  -4          HG21      ILE  -4 -33.759 -11.817   1.867
   12   HG22  ILE  -4          HG22      ILE  -4 -35.001 -12.473   2.934
   13   HG23  ILE  -4          HG23      ILE  -4 -33.660 -11.545   3.607
   14   HD11  ILE  -4          HD11      ILE  -4 -35.273 -15.693   1.311
   15   HD12  ILE  -4          HD12      ILE  -4 -35.203 -15.408   3.050
   16   HD13  ILE  -4          HD13      ILE  -4 -35.665 -14.100   1.961
   17    H    ASP  -3           H        ASP  -3 -29.587 -11.779   3.006
   18    HA   ASP  -3           HA       ASP  -3 -29.540 -11.556   5.867
   19    HB2  ASP  -3           HB2      ASP  -3 -27.825 -10.284   3.726
   20    HB3  ASP  -3           HB3      ASP  -3 -27.539 -10.114   5.456
   21    HA   PRO  -2           HA       PRO  -2 -31.920  -7.907   6.189
   22    HB2  PRO  -2           HB2      PRO  -2 -31.142  -7.015   8.606
   23    HB3  PRO  -2           HB3      PRO  -2 -32.095  -8.490   8.408
   24    HG2  PRO  -2           HG2      PRO  -2 -29.168  -8.173   8.904
   25    HG3  PRO  -2           HG3      PRO  -2 -30.295  -9.371   9.565
   26    HD2  PRO  -2           HD2      PRO  -2 -28.567  -9.843   7.473
   27    HD3  PRO  -2           HD3      PRO  -2 -30.063 -10.749   7.762
   28    H    PHE  -1           H        PHE  -1 -31.463  -6.286   4.834
   29    HA   PHE  -1           HA       PHE  -1 -29.208  -4.540   5.520
   30    HB2  PHE  -1           HB2      PHE  -1 -30.353  -5.188   2.801
   31    HB3  PHE  -1           HB3      PHE  -1 -29.200  -3.898   3.100
   32    HD1  PHE  -1           HD1      PHE  -1 -27.016  -4.646   4.364
   33    HD2  PHE  -1           HD2      PHE  -1 -29.573  -7.235   2.161
   34    HE1  PHE  -1           HE1      PHE  -1 -25.162  -6.245   4.101
   35    HE2  PHE  -1           HE2      PHE  -1 -27.725  -8.842   1.896
   36    HZ   PHE  -1           HZ       PHE  -1 -25.517  -8.353   2.906
   37    H    THR   0           H        THR   0 -30.722  -3.513   6.949
   38    HA   THR   0           HA       THR   0 -32.900  -2.038   5.778
   39    HB   THR   0           HB       THR   0 -33.095  -1.021   8.060
   40    HG1  THR   0           HG1      THR   0 -31.051  -2.877   8.782
   41   HG21  THR   0          HG21      THR   0 -33.809  -3.082   9.188
   42   HG22  THR   0          HG22      THR   0 -32.952  -4.036   7.978
   43   HG23  THR   0          HG23      THR   0 -34.334  -3.048   7.504
   44    H    MET   1           H        MET   1 -32.176   0.324   7.615
   45    HA   MET   1           HA       MET   1 -30.704   1.762   5.577
   46    HB2  MET   1           HB2      MET   1 -32.750   2.675   6.755
   47    HB3  MET   1           HB3      MET   1 -31.768   2.817   8.203
   48    HG2  MET   1           HG2      MET   1 -31.940   4.954   7.129
   49    HG3  MET   1           HG3      MET   1 -30.281   4.377   7.021
   50    HE1  MET   1           HE1      MET   1 -29.613   3.888   3.333
   51    HE2  MET   1           HE2      MET   1 -28.952   4.407   4.883
   52    HE3  MET   1           HE3      MET   1 -29.635   2.790   4.712
   53    H    VAL   2           H        VAL   2 -29.202  -0.171   6.706
   54    HA   VAL   2           HA       VAL   2 -27.097   1.387   7.995
   55    HB   VAL   2           HB       VAL   2 -26.466  -0.681   9.328
   56   HG11  VAL   2          HG11      VAL   2 -29.047   0.714  10.012
   57   HG12  VAL   2          HG12      VAL   2 -28.022  -0.168  11.145
   58   HG13  VAL   2          HG13      VAL   2 -27.419   1.295  10.368
   59   HG21  VAL   2          HG21      VAL   2 -27.841  -2.315   8.173
   60   HG22  VAL   2          HG22      VAL   2 -28.283  -2.239   9.878
   61   HG23  VAL   2          HG23      VAL   2 -29.304  -1.463   8.667
   62    H    ALA   3           H        ALA   3 -26.789   1.309   5.557
   63    HA   ALA   3           HA       ALA   3 -24.683  -0.626   5.091
   64    HB1  ALA   3           HB1      ALA   3 -26.611  -1.734   4.083
   65    HB2  ALA   3           HB2      ALA   3 -26.945  -0.289   3.126
   66    HB3  ALA   3           HB3      ALA   3 -25.462  -1.202   2.853
   67    H    LEU   4           H        LEU   4 -23.481   1.241   5.434
   68    HA   LEU   4           HA       LEU   4 -23.375   3.637   4.406
   69    HB2  LEU   4           HB2      LEU   4 -20.965   1.861   4.168
   70    HB3  LEU   4           HB3      LEU   4 -21.012   3.575   4.524
   71    HG   LEU   4           HG       LEU   4 -21.874   1.338   6.357
   72   HD11  LEU   4          HD11      LEU   4 -19.480   1.545   6.172
   73   HD12  LEU   4          HD12      LEU   4 -19.581   3.279   6.488
   74   HD13  LEU   4          HD13      LEU   4 -20.022   2.124   7.747
   75   HD21  LEU   4          HD21      LEU   4 -23.337   3.254   6.660
   76   HD22  LEU   4          HD22      LEU   4 -22.241   3.093   8.032
   77   HD23  LEU   4          HD23      LEU   4 -21.942   4.320   6.802
   78    H    SER   5           H        SER   5 -23.129   4.696   2.592
   79    HA   SER   5           HA       SER   5 -23.095   3.148   0.108
   80    HB2  SER   5           HB2      SER   5 -24.040   5.178  -0.942
   81    HB3  SER   5           HB3      SER   5 -25.019   4.635   0.418
   82    HG   SER   5           HG       SER   5 -24.688   6.896   0.440
   83    H    LEU   6           H        LEU   6 -21.088   2.900  -0.663
   84    HA   LEU   6           HA       LEU   6 -19.182   5.097  -0.187
   85    HB2  LEU   6           HB2      LEU   6 -18.510   2.166  -0.441
   86    HB3  LEU   6           HB3      LEU   6 -17.436   3.468   0.052
   87    HG   LEU   6           HG       LEU   6 -19.774   2.383   1.628
   88   HD11  LEU   6          HD11      LEU   6 -18.045   1.664   3.207
   89   HD12  LEU   6          HD12      LEU   6 -17.854   0.901   1.628
   90   HD13  LEU   6          HD13      LEU   6 -16.800   2.236   2.096
   91   HD21  LEU   6          HD21      LEU   6 -19.001   3.892   3.411
   92   HD22  LEU   6          HD22      LEU   6 -17.851   4.610   2.282
   93   HD23  LEU   6          HD23      LEU   6 -19.586   4.763   1.992
   94    H    LYS   7           H        LYS   7 -18.174   5.925  -1.905
   95    HA   LYS   7           HA       LYS   7 -18.592   4.706  -4.512
   96    HB2  LYS   7           HB2      LYS   7 -17.471   7.333  -3.600
   97    HB3  LYS   7           HB3      LYS   7 -17.141   6.749  -5.225
   98    HG2  LYS   7           HG2      LYS   7 -19.625   6.538  -5.538
   99    HG3  LYS   7           HG3      LYS   7 -19.807   7.406  -4.010
  100    HD2  LYS   7           HD2      LYS   7 -18.638   9.312  -4.893
  101    HD3  LYS   7           HD3      LYS   7 -18.248   8.437  -6.374
  102    HE2  LYS   7           HE2      LYS   7 -20.084   9.951  -6.778
  103    HE3  LYS   7           HE3      LYS   7 -20.644   8.284  -6.892
  104    HZ1  LYS   7           HZ1      LYS   7 -20.987  10.060  -4.531
  105    HZ2  LYS   7           HZ2      LYS   7 -21.552   8.464  -4.661
  106    HZ3  LYS   7           HZ3      LYS   7 -22.196   9.676  -5.654
  107    H    ILE   8           H        ILE   8 -17.293   3.123  -5.066
  108    HA   ILE   8           HA       ILE   8 -14.583   3.027  -4.009
  109    HB   ILE   8           HB       ILE   8 -16.342   1.037  -5.401
  110   HG12  ILE   8          HG12      ILE   8 -15.620  -0.402  -3.515
  111   HG13  ILE   8          HG13      ILE   8 -14.609   0.907  -2.920
  112   HG21  ILE   8          HG21      ILE   8 -14.244   0.954  -6.639
  113   HG22  ILE   8          HG22      ILE   8 -13.352   0.760  -5.131
  114   HG23  ILE   8          HG23      ILE   8 -14.467  -0.498  -5.665
  115   HD11  ILE   8          HD11      ILE   8 -16.555   2.254  -2.474
  116   HD12  ILE   8          HD12      ILE   8 -17.600   1.024  -3.177
  117   HD13  ILE   8          HD13      ILE   8 -16.717   0.682  -1.691
  118    H    SER   9           H        SER   9 -13.061   4.041  -5.061
  119    HA   SER   9           HA       SER   9 -13.317   4.464  -7.940
  120    HB2  SER   9           HB2      SER   9 -11.385   6.040  -7.585
  121    HB3  SER   9           HB3      SER   9 -12.840   6.467  -6.683
  122    HG   SER   9           HG       SER   9 -10.698   4.956  -5.596
  123    H    ILE  10           H        ILE  10 -12.407   3.002  -9.212
  124    HA   ILE  10           HA       ILE  10  -9.984   1.618  -8.252
  125    HB   ILE  10           HB       ILE  10 -11.892   0.680 -10.407
  126   HG12  ILE  10          HG12      ILE  10 -11.587  -0.311  -7.562
  127   HG13  ILE  10          HG13      ILE  10 -12.918   0.684  -8.141
  128   HG21  ILE  10          HG21      ILE  10 -10.682  -1.447 -10.211
  129   HG22  ILE  10          HG22      ILE  10  -9.613  -0.131 -10.698
  130   HG23  ILE  10          HG23      ILE  10  -9.593  -0.713  -9.033
  131   HD11  ILE  10          HD11      ILE  10 -13.595  -1.098  -9.656
  132   HD12  ILE  10          HD12      ILE  10 -12.253  -2.093  -9.090
  133   HD13  ILE  10          HD13      ILE  10 -13.554  -1.654  -7.983
  134    H    GLY  11           H        GLY  11  -8.527   3.162  -8.931
  135    HA2  GLY  11           HA2      GLY  11  -7.141   4.260 -10.392
  136    HA3  GLY  11           HA3      GLY  11  -7.709   3.155 -11.636
  137    H    ASN  12           H        ASN  12  -9.412   3.744 -12.956
  138    HA   ASN  12           HA       ASN  12  -9.906   6.635 -13.044
  139    HB2  ASN  12           HB2      ASN  12  -8.925   5.740 -15.065
  140    HB3  ASN  12           HB3      ASN  12 -10.159   4.488 -15.160
  141   HD21  ASN  12          HD21      ASN  12 -10.938   5.045 -17.129
  142   HD22  ASN  12          HD22      ASN  12 -11.808   6.513 -17.421
  143    H    VAL  13           H        VAL  13 -11.543   3.520 -12.999
  144    HA   VAL  13           HA       VAL  13 -14.129   4.683 -13.511
  145    HB   VAL  13           HB       VAL  13 -13.614   2.481 -14.404
  146   HG11  VAL  13          HG11      VAL  13 -12.091   1.688 -12.708
  147   HG12  VAL  13          HG12      VAL  13 -13.408   1.585 -11.539
  148   HG13  VAL  13          HG13      VAL  13 -13.395   0.525 -12.950
  149   HG21  VAL  13          HG21      VAL  13 -15.772   2.375 -12.302
  150   HG22  VAL  13          HG22      VAL  13 -15.947   2.957 -13.957
  151   HG23  VAL  13          HG23      VAL  13 -15.607   1.253 -13.652
  152    H    VAL  14           H        VAL  14 -15.874   4.771 -12.110
  153    HA   VAL  14           HA       VAL  14 -15.246   4.478  -9.248
  154    HB   VAL  14           HB       VAL  14 -15.320   6.838  -9.626
  155   HG11  VAL  14          HG11      VAL  14 -17.232   7.980 -10.646
  156   HG12  VAL  14          HG12      VAL  14 -16.445   6.876 -11.773
  157   HG13  VAL  14          HG13      VAL  14 -17.966   6.417 -11.007
  158   HG21  VAL  14          HG21      VAL  14 -17.262   7.528  -8.258
  159   HG22  VAL  14          HG22      VAL  14 -17.940   5.912  -8.448
  160   HG23  VAL  14          HG23      VAL  14 -16.417   6.132  -7.589
  161    H    LYS  15           H        LYS  15 -16.442   3.017  -8.307
  162    HA   LYS  15           HA       LYS  15 -19.067   2.337  -9.469
  163    HB2  LYS  15           HB2      LYS  15 -17.076   0.647  -7.946
  164    HB3  LYS  15           HB3      LYS  15 -18.711   0.120  -8.321
  165    HG2  LYS  15           HG2      LYS  15 -16.737   0.949 -10.430
  166    HG3  LYS  15           HG3      LYS  15 -16.903  -0.711  -9.854
  167    HD2  LYS  15           HD2      LYS  15 -19.290  -0.657 -10.491
  168    HD3  LYS  15           HD3      LYS  15 -19.054   0.965 -11.143
  169    HE2  LYS  15           HE2      LYS  15 -17.491   0.136 -12.775
  170    HE3  LYS  15           HE3      LYS  15 -17.548  -1.477 -12.063
  171    HZ1  LYS  15           HZ1      LYS  15 -19.857  -1.660 -12.693
  172    HZ2  LYS  15           HZ2      LYS  15 -18.920  -1.300 -14.059
  173    HZ3  LYS  15           HZ3      LYS  15 -19.853  -0.087 -13.325
  174    H    THR  16           H        THR  16 -20.831   2.097  -8.077
  175    HA   THR  16           HA       THR  16 -20.412   3.243  -5.403
  176    HB   THR  16           HB       THR  16 -23.030   2.891  -6.875
  177    HG1  THR  16           HG1      THR  16 -21.020   4.722  -7.191
  178   HG21  THR  16          HG21      THR  16 -23.847   4.561  -5.271
  179   HG22  THR  16          HG22      THR  16 -22.263   4.592  -4.498
  180   HG23  THR  16          HG23      THR  16 -23.241   3.126  -4.445
  181    H    MET  17           H        MET  17 -20.457   1.898  -3.703
  182    HA   MET  17           HA       MET  17 -21.995  -0.590  -3.919
  183    HB2  MET  17           HB2      MET  17 -19.091  -0.279  -3.280
  184    HB3  MET  17           HB3      MET  17 -20.004  -1.516  -2.433
  185    HG2  MET  17           HG2      MET  17 -20.029  -1.333  -5.419
  186    HG3  MET  17           HG3      MET  17 -18.733  -2.159  -4.558
  187    HE1  MET  17           HE1      MET  17 -20.337  -3.446  -2.063
  188    HE2  MET  17           HE2      MET  17 -20.640  -5.051  -2.737
  189    HE3  MET  17           HE3      MET  17 -19.088  -4.259  -3.007
  190    H    GLN  18           H        GLN  18 -22.981  -1.211  -2.045
  191    HA   GLN  18           HA       GLN  18 -22.592   0.570   0.258
  192    HB2  GLN  18           HB2      GLN  18 -24.982  -0.908  -0.776
  193    HB3  GLN  18           HB3      GLN  18 -24.882  -0.475   0.929
  194    HG2  GLN  18           HG2      GLN  18 -24.927   1.786   0.500
  195    HG3  GLN  18           HG3      GLN  18 -24.414   1.584  -1.176
  196   HE21  GLN  18          HE21      GLN  18 -25.915   0.997  -2.724
  197   HE22  GLN  18          HE22      GLN  18 -27.620   1.107  -2.447
  198    H    PHE  19           H        PHE  19 -22.182  -0.273   2.270
  199    HA   PHE  19           HA       PHE  19 -21.783  -3.167   2.447
  200    HB2  PHE  19           HB2      PHE  19 -19.825  -1.008   3.286
  201    HB3  PHE  19           HB3      PHE  19 -19.677  -2.707   3.711
  202    HD1  PHE  19           HD1      PHE  19 -19.016  -4.350   2.057
  203    HD2  PHE  19           HD2      PHE  19 -19.350  -0.227   1.074
  204    HE1  PHE  19           HE1      PHE  19 -17.765  -4.754  -0.024
  205    HE2  PHE  19           HE2      PHE  19 -18.101  -0.621  -1.013
  206    HZ   PHE  19           HZ       PHE  19 -17.239  -2.903  -1.517
  207    H    GLU  20           H        GLU  20 -21.886  -3.910   4.652
  208    HA   GLU  20           HA       GLU  20 -23.737  -2.552   6.295
  209    HB2  GLU  20           HB2      GLU  20 -21.774  -4.751   6.982
  210    HB3  GLU  20           HB3      GLU  20 -23.113  -4.237   7.999
  211    HG2  GLU  20           HG2      GLU  20 -24.716  -5.038   6.471
  212    HG3  GLU  20           HG3      GLU  20 -23.509  -5.243   5.201
  213    HA   PRO  21           HA       PRO  21 -21.345   0.312   8.736
  214    HB2  PRO  21           HB2      PRO  21 -22.173  -1.130  11.185
  215    HB3  PRO  21           HB3      PRO  21 -22.378   0.570  10.762
  216    HG2  PRO  21           HG2      PRO  21 -24.413  -1.212  10.729
  217    HG3  PRO  21           HG3      PRO  21 -24.350   0.191   9.649
  218    HD2  PRO  21           HD2      PRO  21 -23.933  -2.671   9.053
  219    HD3  PRO  21           HD3      PRO  21 -24.450  -1.354   7.987
  220    H    SER  22           H        SER  22 -21.270  -3.025   9.944
  221    HA   SER  22           HA       SER  22 -18.572  -2.794  10.843
  222    HB2  SER  22           HB2      SER  22 -20.109  -5.345  10.326
  223    HB3  SER  22           HB3      SER  22 -18.739  -5.115  11.413
  224    HG   SER  22           HG       SER  22 -21.120  -5.081  12.188
  225    H    THR  23           H        THR  23 -19.982  -4.952   8.387
  226    HA   THR  23           HA       THR  23 -19.095  -6.120   6.696
  227    HB   THR  23           HB       THR  23 -17.725  -3.487   6.157
  228    HG1  THR  23           HG1      THR  23 -20.117  -4.643   5.115
  229   HG21  THR  23          HG21      THR  23 -16.661  -5.319   4.941
  230   HG22  THR  23          HG22      THR  23 -17.583  -4.290   3.844
  231   HG23  THR  23          HG23      THR  23 -18.235  -5.848   4.354
  232    H    MET  24           H        MET  24 -16.366  -4.084   7.651
  233    HA   MET  24           HA       MET  24 -14.231  -4.532   8.216
  234    HB2  MET  24           HB2      MET  24 -15.479  -6.687   9.290
  235    HB3  MET  24           HB3      MET  24 -14.418  -7.475   8.130
  236    HG2  MET  24           HG2      MET  24 -12.505  -6.727   9.175
  237    HG3  MET  24           HG3      MET  24 -13.348  -5.408   9.994
  238    HE1  MET  24           HE1      MET  24 -12.462  -7.180  13.192
  239    HE2  MET  24           HE2      MET  24 -11.526  -6.589  11.817
  240    HE3  MET  24           HE3      MET  24 -12.876  -5.635  12.442
  241    H    VAL  25           H        VAL  25 -12.522  -4.576   7.003
  242    HA   VAL  25           HA       VAL  25 -12.658  -4.353   4.327
  243    HB   VAL  25           HB       VAL  25 -10.274  -5.246   5.929
  244   HG11  VAL  25          HG11      VAL  25  -9.922  -5.890   3.594
  245   HG12  VAL  25          HG12      VAL  25 -10.360  -4.263   3.073
  246   HG13  VAL  25          HG13      VAL  25  -8.899  -4.519   4.026
  247   HG21  VAL  25          HG21      VAL  25 -11.154  -2.587   4.820
  248   HG22  VAL  25          HG22      VAL  25 -11.215  -3.085   6.511
  249   HG23  VAL  25          HG23      VAL  25  -9.658  -2.885   5.706
  250    H    TYR  26           H        TYR  26 -11.878  -7.425   5.970
  251    HA   TYR  26           HA       TYR  26 -11.274  -8.757   3.557
  252    HB2  TYR  26           HB2      TYR  26 -11.160 -10.796   4.812
  253    HB3  TYR  26           HB3      TYR  26 -10.409  -9.505   5.731
  254    HD1  TYR  26           HD1      TYR  26 -11.683  -8.528   7.701
  255    HD2  TYR  26           HD2      TYR  26 -12.913 -12.061   5.680
  256    HE1  TYR  26           HE1      TYR  26 -13.033  -9.173   9.655
  257    HE2  TYR  26           HE2      TYR  26 -14.257 -12.715   7.623
  258    HH   TYR  26           HH       TYR  26 -15.080 -10.653  10.096
  259    H    ASP  27           H        ASP  27 -14.298  -8.322   5.267
  260    HA   ASP  27           HA       ASP  27 -15.735 -10.150   3.558
  261    HB2  ASP  27           HB2      ASP  27 -16.630  -9.711   5.773
  262    HB3  ASP  27           HB3      ASP  27 -16.731  -7.992   5.425
  263    H    ALA  28           H        ALA  28 -15.011  -6.713   3.613
  264    HA   ALA  28           HA       ALA  28 -16.772  -5.929   1.572
  265    HB1  ALA  28           HB1      ALA  28 -15.680  -4.342   3.085
  266    HB2  ALA  28           HB2      ALA  28 -14.123  -4.707   2.341
  267    HB3  ALA  28           HB3      ALA  28 -15.391  -3.928   1.394
  268    H    CYS  29           H        CYS  29 -13.351  -6.821   1.495
  269    HA   CYS  29           HA       CYS  29 -12.985  -6.404  -1.246
  270    HB2  CYS  29           HB2      CYS  29 -10.938  -7.739  -0.973
  271    HB3  CYS  29           HB3      CYS  29 -11.107  -6.511   0.263
  272    HG   CYS  29           HG       CYS  29 -11.632  -9.874   0.653
  273    H    ARG  30           H        ARG  30 -14.396  -9.111   0.436
  274    HA   ARG  30           HA       ARG  30 -14.042 -10.932  -1.758
  275    HB2  ARG  30           HB2      ARG  30 -15.321 -12.504  -0.534
  276    HB3  ARG  30           HB3      ARG  30 -14.368 -11.635   0.657
  277    HG2  ARG  30           HG2      ARG  30 -16.324 -10.278   1.234
  278    HG3  ARG  30           HG3      ARG  30 -17.269 -11.147   0.024
  279    HD2  ARG  30           HD2      ARG  30 -17.699 -12.018   2.250
  280    HD3  ARG  30           HD3      ARG  30 -16.929 -13.232   1.231
  281    HE   ARG  30           HE       ARG  30 -14.801 -12.390   2.450
  282   HH11  ARG  30          HH11      ARG  30 -17.981 -12.514   3.881
  283   HH12  ARG  30          HH12      ARG  30 -17.398 -12.972   5.455
  284   HH21  ARG  30          HH21      ARG  30 -14.021 -13.010   4.504
  285   HH22  ARG  30          HH22      ARG  30 -15.152 -13.275   5.804
  286    H    MET  31           H        MET  31 -16.612  -8.797  -0.622
  287    HA   MET  31           HA       MET  31 -18.520  -9.753  -2.533
  288    HB2  MET  31           HB2      MET  31 -18.598  -7.232  -0.873
  289    HB3  MET  31           HB3      MET  31 -19.948  -7.978  -1.713
  290    HG2  MET  31           HG2      MET  31 -19.791  -9.935  -0.299
  291    HG3  MET  31           HG3      MET  31 -18.405  -9.239   0.532
  292    HE1  MET  31           HE1      MET  31 -19.869  -6.253   2.449
  293    HE2  MET  31           HE2      MET  31 -18.450  -7.246   2.090
  294    HE3  MET  31           HE3      MET  31 -19.143  -6.211   0.838
  295    H    ILE  32           H        ILE  32 -16.442  -6.890  -2.278
  296    HA   ILE  32           HA       ILE  32 -17.538  -5.558  -4.505
  297    HB   ILE  32           HB       ILE  32 -16.142  -4.398  -2.873
  298   HG12  ILE  32          HG12      ILE  32 -14.979  -4.350  -5.666
  299   HG13  ILE  32          HG13      ILE  32 -16.403  -3.465  -5.131
  300   HG21  ILE  32          HG21      ILE  32 -13.701  -4.640  -2.896
  301   HG22  ILE  32          HG22      ILE  32 -14.508  -6.133  -2.413
  302   HG23  ILE  32          HG23      ILE  32 -13.851  -5.972  -4.042
  303   HD11  ILE  32          HD11      ILE  32 -15.052  -2.165  -3.610
  304   HD12  ILE  32          HD12      ILE  32 -13.620  -3.084  -4.076
  305   HD13  ILE  32          HD13      ILE  32 -14.427  -2.053  -5.256
  306    H    ARG  33           H        ARG  33 -14.834  -7.809  -4.223
  307    HA   ARG  33           HA       ARG  33 -14.100  -7.904  -6.928
  308    HB2  ARG  33           HB2      ARG  33 -12.538  -8.914  -5.592
  309    HB3  ARG  33           HB3      ARG  33 -13.743  -9.618  -4.531
  310    HG2  ARG  33           HG2      ARG  33 -14.196 -11.365  -6.122
  311    HG3  ARG  33           HG3      ARG  33 -13.112 -10.617  -7.297
  312    HD2  ARG  33           HD2      ARG  33 -12.140 -12.555  -6.036
  313    HD3  ARG  33           HD3      ARG  33 -11.207 -11.063  -5.953
  314    HE   ARG  33           HE       ARG  33 -12.403 -10.766  -3.715
  315   HH11  ARG  33          HH11      ARG  33 -11.663 -13.897  -5.082
  316   HH12  ARG  33          HH12      ARG  33 -11.378 -14.652  -3.542
  317   HH21  ARG  33          HH21      ARG  33 -12.048 -11.753  -1.675
  318   HH22  ARG  33          HH22      ARG  33 -11.635 -13.437  -1.599
  319    H    GLU  34           H        GLU  34 -16.748  -9.237  -5.216
  320    HA   GLU  34           HA       GLU  34 -17.347 -11.378  -7.024
  321    HB2  GLU  34           HB2      GLU  34 -18.050 -11.550  -4.739
  322    HB3  GLU  34           HB3      GLU  34 -18.928 -10.034  -4.838
  323    HG2  GLU  34           HG2      GLU  34 -20.376 -11.168  -6.587
  324    HG3  GLU  34           HG3      GLU  34 -19.633 -12.678  -6.052
  325    H    ARG  35           H        ARG  35 -19.134  -8.361  -6.294
  326    HA   ARG  35           HA       ARG  35 -20.653  -8.692  -8.726
  327    HB2  ARG  35           HB2      ARG  35 -21.610  -6.370  -7.949
  328    HB3  ARG  35           HB3      ARG  35 -22.094  -7.868  -7.174
  329    HG2  ARG  35           HG2      ARG  35 -19.768  -6.501  -5.992
  330    HG3  ARG  35           HG3      ARG  35 -21.321  -5.675  -5.844
  331    HD2  ARG  35           HD2      ARG  35 -21.659  -8.462  -5.277
  332    HD3  ARG  35           HD3      ARG  35 -20.338  -7.818  -4.302
  333    HE   ARG  35           HE       ARG  35 -22.403  -5.997  -4.089
  334   HH11  ARG  35          HH11      ARG  35 -22.012  -9.426  -3.406
  335   HH12  ARG  35          HH12      ARG  35 -23.049  -9.381  -2.004
  336   HH21  ARG  35          HH21      ARG  35 -23.744  -5.945  -2.253
  337   HH22  ARG  35          HH22      ARG  35 -24.029  -7.404  -1.346
  338    H    ILE  36           H        ILE  36 -17.908  -6.774  -7.762
  339    HA   ILE  36           HA       ILE  36 -18.134  -5.243 -10.261
  340    HB   ILE  36           HB       ILE  36 -16.276  -4.754  -7.930
  341   HG12  ILE  36          HG12      ILE  36 -18.791  -3.295  -8.776
  342   HG13  ILE  36          HG13      ILE  36 -18.642  -4.346  -7.370
  343   HG21  ILE  36          HG21      ILE  36 -16.840  -3.101 -10.392
  344   HG22  ILE  36          HG22      ILE  36 -15.832  -2.604  -9.032
  345   HG23  ILE  36          HG23      ILE  36 -15.346  -3.969 -10.039
  346   HD11  ILE  36          HD11      ILE  36 -17.186  -1.752  -7.814
  347   HD12  ILE  36          HD12      ILE  36 -18.545  -2.019  -6.724
  348   HD13  ILE  36          HD13      ILE  36 -16.999  -2.806  -6.413
  349    HA   PRO  37           HA       PRO  37 -15.071  -8.244 -11.694
  350    HB2  PRO  37           HB2      PRO  37 -15.650  -7.050 -14.306
  351    HB3  PRO  37           HB3      PRO  37 -15.862  -8.718 -13.765
  352    HG2  PRO  37           HG2      PRO  37 -17.956  -7.089 -14.241
  353    HG3  PRO  37           HG3      PRO  37 -17.992  -8.331 -12.976
  354    HD2  PRO  37           HD2      PRO  37 -17.524  -5.381 -12.726
  355    HD3  PRO  37           HD3      PRO  37 -18.508  -6.457 -11.707
  356    H    GLU  38           H        GLU  38 -15.215  -4.801 -12.102
  357    HA   GLU  38           HA       GLU  38 -12.644  -4.535 -13.353
  358    HB2  GLU  38           HB2      GLU  38 -14.430  -2.523 -11.978
  359    HB3  GLU  38           HB3      GLU  38 -12.909  -2.106 -12.750
  360    HG2  GLU  38           HG2      GLU  38 -14.649  -1.570 -14.259
  361    HG3  GLU  38           HG3      GLU  38 -13.834  -2.998 -14.886
  362    H    ALA  39           H        ALA  39 -13.533  -5.397 -10.279
  363    HA   ALA  39           HA       ALA  39 -11.619  -3.859  -8.796
  364    HB1  ALA  39           HB1      ALA  39 -13.700  -4.642  -7.773
  365    HB2  ALA  39           HB2      ALA  39 -13.167  -6.312  -7.971
  366    HB3  ALA  39           HB3      ALA  39 -12.285  -5.224  -6.896
  367    H    LEU  40           H        LEU  40 -11.671  -7.052 -10.274
  368    HA   LEU  40           HA       LEU  40  -9.078  -7.569  -9.041
  369    HB2  LEU  40           HB2      LEU  40  -9.532  -9.987  -9.878
  370    HB3  LEU  40           HB3      LEU  40 -10.244  -9.397  -8.401
  371    HG   LEU  40           HG       LEU  40 -11.747 -10.806  -9.801
  372   HD11  LEU  40          HD11      LEU  40 -12.656  -7.980  -9.342
  373   HD12  LEU  40          HD12      LEU  40 -13.707  -9.377  -9.578
  374   HD13  LEU  40          HD13      LEU  40 -12.661  -9.289  -8.160
  375   HD21  LEU  40          HD21      LEU  40 -12.817  -9.747 -11.763
  376   HD22  LEU  40          HD22      LEU  40 -11.601  -8.468 -11.686
  377   HD23  LEU  40          HD23      LEU  40 -11.112 -10.132 -12.009
  378    H    ALA  41           H        ALA  41  -8.223  -6.049 -10.621
  379    HA   ALA  41           HA       ALA  41  -7.945  -6.891 -13.335
  380    HB1  ALA  41           HB1      ALA  41  -6.329  -5.064 -13.517
  381    HB2  ALA  41           HB2      ALA  41  -7.798  -4.532 -12.695
  382    HB3  ALA  41           HB3      ALA  41  -6.340  -4.874 -11.762
  383    H    GLY  42           H        GLY  42  -6.777  -8.114 -10.558
  384    HA2  GLY  42           HA2      GLY  42  -4.818  -9.737 -11.908
  385    HA3  GLY  42           HA3      GLY  42  -4.150  -8.690 -10.658
  386    HA   PRO  43           HA       PRO  43  -5.588 -12.227  -8.205
  387    HB2  PRO  43           HB2      PRO  43  -3.452 -11.795  -6.372
  388    HB3  PRO  43           HB3      PRO  43  -3.599 -13.079  -7.575
  389    HG2  PRO  43           HG2      PRO  43  -1.723 -11.021  -7.636
  390    HG3  PRO  43           HG3      PRO  43  -2.170 -12.054  -9.004
  391    HD2  PRO  43           HD2      PRO  43  -3.039  -9.276  -8.358
  392    HD3  PRO  43           HD3      PRO  43  -2.770 -10.042  -9.939
  393    HA   PRO  44           HA       PRO  44  -7.970  -9.532  -5.586
  394    HB2  PRO  44           HB2      PRO  44  -8.780 -11.558  -3.860
  395    HB3  PRO  44           HB3      PRO  44  -9.587 -11.112  -5.366
  396    HG2  PRO  44           HG2      PRO  44  -7.601 -13.292  -4.850
  397    HG3  PRO  44           HG3      PRO  44  -9.077 -13.328  -5.840
  398    HD2  PRO  44           HD2      PRO  44  -6.695 -13.113  -6.992
  399    HD3  PRO  44           HD3      PRO  44  -8.065 -12.150  -7.590
  400    H    ASN  45           H        ASN  45  -5.581 -11.782  -4.312
  401    HA   ASN  45           HA       ASN  45  -5.595 -10.819  -1.647
  402    HB2  ASN  45           HB2      ASN  45  -3.725 -12.212  -1.280
  403    HB3  ASN  45           HB3      ASN  45  -4.664 -13.035  -2.520
  404   HD21  ASN  45          HD21      ASN  45  -3.893 -13.162  -4.601
  405   HD22  ASN  45          HD22      ASN  45  -2.247 -12.802  -4.997
  406    H    ASP  46           H        ASP  46  -4.233  -9.604  -4.547
  407    HA   ASP  46           HA       ASP  46  -2.260  -7.968  -3.164
  408    HB2  ASP  46           HB2      ASP  46  -2.924  -8.323  -6.088
  409    HB3  ASP  46           HB3      ASP  46  -1.744  -7.152  -5.502
  410    H    PHE  47           H        PHE  47  -5.476  -7.733  -3.588
  411    HA   PHE  47           HA       PHE  47  -5.384  -4.820  -4.020
  412    HB2  PHE  47           HB2      PHE  47  -7.569  -6.809  -4.627
  413    HB3  PHE  47           HB3      PHE  47  -7.827  -5.068  -4.633
  414    HD1  PHE  47           HD1      PHE  47  -6.419  -3.665  -6.213
  415    HD2  PHE  47           HD2      PHE  47  -6.735  -7.896  -6.508
  416    HE1  PHE  47           HE1      PHE  47  -5.662  -3.554  -8.550
  417    HE2  PHE  47           HE2      PHE  47  -5.978  -7.792  -8.844
  418    HZ   PHE  47           HZ       PHE  47  -5.440  -5.620  -9.869
  419    H    GLY  48           H        GLY  48  -6.006  -3.533  -2.424
  420    HA2  GLY  48           HA2      GLY  48  -7.710  -4.659  -0.300
  421    HA3  GLY  48           HA3      GLY  48  -6.232  -3.813   0.114
  422    H    LEU  49           H        LEU  49  -8.056  -2.669   1.361
  423    HA   LEU  49           HA       LEU  49  -9.478  -0.737  -0.316
  424    HB2  LEU  49           HB2      LEU  49  -9.856  -1.390   2.604
  425    HB3  LEU  49           HB3      LEU  49 -10.865  -0.322   1.648
  426    HG   LEU  49           HG       LEU  49 -10.582  -3.305   1.280
  427   HD11  LEU  49          HD11      LEU  49 -11.881  -2.698   3.240
  428   HD12  LEU  49          HD12      LEU  49 -12.877  -1.618   2.264
  429   HD13  LEU  49          HD13      LEU  49 -12.924  -3.357   1.980
  430   HD21  LEU  49          HD21      LEU  49 -10.895  -2.174  -0.861
  431   HD22  LEU  49          HD22      LEU  49 -12.339  -3.075  -0.399
  432   HD23  LEU  49          HD23      LEU  49 -12.298  -1.322  -0.212
  433    H    PHE  50           H        PHE  50  -8.377   1.035  -0.646
  434    HA   PHE  50           HA       PHE  50  -6.944   2.298   1.588
  435    HB2  PHE  50           HB2      PHE  50  -5.670   2.057  -0.502
  436    HB3  PHE  50           HB3      PHE  50  -6.900   2.972  -1.366
  437    HD1  PHE  50           HD1      PHE  50  -4.212   3.192   1.161
  438    HD2  PHE  50           HD2      PHE  50  -6.953   5.343  -1.294
  439    HE1  PHE  50           HE1      PHE  50  -3.020   5.281   1.660
  440    HE2  PHE  50           HE2      PHE  50  -5.761   7.435  -0.793
  441    HZ   PHE  50           HZ       PHE  50  -3.791   7.405   0.684
  442    H    LEU  51           H        LEU  51  -7.819   3.980   2.623
  443    HA   LEU  51           HA       LEU  51 -10.296   5.091   1.547
  444    HB2  LEU  51           HB2      LEU  51  -9.843   4.294   4.024
  445    HB3  LEU  51           HB3      LEU  51  -9.140   5.888   4.193
  446    HG   LEU  51           HG       LEU  51 -11.493   5.743   4.972
  447   HD11  LEU  51          HD11      LEU  51 -10.602   7.895   4.282
  448   HD12  LEU  51          HD12      LEU  51 -11.067   7.567   2.613
  449   HD13  LEU  51          HD13      LEU  51 -12.309   7.754   3.853
  450   HD21  LEU  51          HD21      LEU  51 -13.295   5.549   3.365
  451   HD22  LEU  51          HD22      LEU  51 -12.133   5.326   2.058
  452   HD23  LEU  51          HD23      LEU  51 -12.277   4.109   3.325
  453    H    SER  52           H        SER  52 -10.058   6.734   0.233
  454    HA   SER  52           HA       SER  52  -7.651   8.352   0.374
  455    HB2  SER  52           HB2      SER  52  -8.298   7.456  -1.796
  456    HB3  SER  52           HB3      SER  52  -9.857   8.268  -1.696
  457    HG   SER  52           HG       SER  52  -8.894  10.191  -2.005
  458    H    ASP  53           H        ASP  53  -7.641  10.093   1.516
  459    HA   ASP  53           HA       ASP  53 -10.135  11.512   2.096
  460    HB2  ASP  53           HB2      ASP  53  -8.753  11.013   4.032
  461    HB3  ASP  53           HB3      ASP  53  -7.350  11.745   3.263
  462    H    ASP  54           H        ASP  54  -6.798  12.373   1.372
  463    HA   ASP  54           HA       ASP  54  -7.039  13.862  -0.905
  464    HB2  ASP  54           HB2      ASP  54  -8.610  15.367   0.214
  465    HB3  ASP  54           HB3      ASP  54  -7.479  15.600   1.545
  466    H    ASP  55           H        ASP  55  -5.815  14.395   2.355
  467    HA   ASP  55           HA       ASP  55  -3.172  15.058   1.407
  468    HB2  ASP  55           HB2      ASP  55  -4.034  16.294   3.281
  469    HB3  ASP  55           HB3      ASP  55  -4.400  14.812   4.158
  470    HA   PRO  56           HA       PRO  56  -1.479  10.969   1.378
  471    HB2  PRO  56           HB2      PRO  56   1.092  11.641   2.171
  472    HB3  PRO  56           HB3      PRO  56   0.482  11.721   0.516
  473    HG2  PRO  56           HG2      PRO  56   0.742  13.898   2.548
  474    HG3  PRO  56           HG3      PRO  56   1.081  13.941   0.808
  475    HD2  PRO  56           HD2      PRO  56  -1.158  14.999   1.794
  476    HD3  PRO  56           HD3      PRO  56  -1.171  14.116   0.252
  477    H    LYS  57           H        LYS  57  -1.066  13.015   4.233
  478    HA   LYS  57           HA       LYS  57  -0.208  10.794   5.876
  479    HB2  LYS  57           HB2      LYS  57  -1.057  13.564   6.739
  480    HB3  LYS  57           HB3      LYS  57  -0.207  12.381   7.715
  481    HG2  LYS  57           HG2      LYS  57   0.878  13.706   5.256
  482    HG3  LYS  57           HG3      LYS  57   1.261  14.137   6.925
  483    HD2  LYS  57           HD2      LYS  57   1.945  11.673   7.177
  484    HD3  LYS  57           HD3      LYS  57   1.965  11.655   5.411
  485    HE2  LYS  57           HE2      LYS  57   4.153  12.176   5.988
  486    HE3  LYS  57           HE3      LYS  57   3.421  13.733   5.605
  487    HZ1  LYS  57           HZ1      LYS  57   3.243  14.277   7.872
  488    HZ2  LYS  57           HZ2      LYS  57   4.806  13.643   7.687
  489    HZ3  LYS  57           HZ3      LYS  57   3.582  12.688   8.371
  490    H    LYS  58           H        LYS  58  -3.127  12.717   5.375
  491    HA   LYS  58           HA       LYS  58  -4.642  11.446   7.423
  492    HB2  LYS  58           HB2      LYS  58  -5.517  13.022   5.000
  493    HB3  LYS  58           HB3      LYS  58  -6.587  12.516   6.302
  494    HG2  LYS  58           HG2      LYS  58  -5.379  13.862   7.887
  495    HG3  LYS  58           HG3      LYS  58  -4.180  14.285   6.664
  496    HD2  LYS  58           HD2      LYS  58  -5.725  16.112   6.928
  497    HD3  LYS  58           HD3      LYS  58  -5.958  15.369   5.346
  498    HE2  LYS  58           HE2      LYS  58  -8.097  15.884   6.393
  499    HE3  LYS  58           HE3      LYS  58  -7.891  14.145   6.197
  500    HZ1  LYS  58           HZ1      LYS  58  -7.375  15.618   8.725
  501    HZ2  LYS  58           HZ2      LYS  58  -7.357  13.936   8.509
  502    HZ3  LYS  58           HZ3      LYS  58  -8.813  14.792   8.374
  503    H    GLY  59           H        GLY  59  -3.953  10.699   4.101
  504    HA2  GLY  59           HA2      GLY  59  -6.025   8.773   3.737
  505    HA3  GLY  59           HA3      GLY  59  -4.553   8.908   2.781
  506    H    ILE  60           H        ILE  60  -6.003   6.552   4.022
  507    HA   ILE  60           HA       ILE  60  -3.683   5.374   5.315
  508    HB   ILE  60           HB       ILE  60  -5.264   4.363   7.088
  509   HG12  ILE  60          HG12      ILE  60  -6.952   6.227   7.806
  510   HG13  ILE  60          HG13      ILE  60  -6.880   6.693   6.111
  511   HG21  ILE  60          HG21      ILE  60  -3.411   5.794   7.639
  512   HG22  ILE  60          HG22      ILE  60  -4.374   7.228   7.281
  513   HG23  ILE  60          HG23      ILE  60  -4.805   6.192   8.643
  514   HD11  ILE  60          HD11      ILE  60  -7.617   4.464   5.464
  515   HD12  ILE  60          HD12      ILE  60  -7.694   3.997   7.163
  516   HD13  ILE  60          HD13      ILE  60  -8.771   5.249   6.544
  517    H    TRP  61           H        TRP  61  -3.878   3.059   5.577
  518    HA   TRP  61           HA       TRP  61  -5.544   1.885   3.487
  519    HB2  TRP  61           HB2      TRP  61  -3.154   0.896   5.018
  520    HB3  TRP  61           HB3      TRP  61  -4.198  -0.223   4.146
  521    HD1  TRP  61           HD1      TRP  61  -1.471   2.319   3.627
  522    HE1  TRP  61           HE1      TRP  61  -0.784   2.354   1.151
  523    HE3  TRP  61           HE3      TRP  61  -5.222  -0.577   1.737
  524    HZ2  TRP  61           HZ2      TRP  61  -1.721   1.275  -1.289
  525    HZ3  TRP  61           HZ3      TRP  61  -5.255  -1.036  -0.678
  526    HH2  TRP  61           HH2      TRP  61  -3.540  -0.128  -2.157
  527    H    LEU  62           H        LEU  62  -7.149   0.510   3.887
  528    HA   LEU  62           HA       LEU  62  -8.047   0.321   6.647
  529    HB2  LEU  62           HB2      LEU  62  -9.402  -0.581   4.097
  530    HB3  LEU  62           HB3      LEU  62 -10.146  -0.441   5.681
  531    HG   LEU  62           HG       LEU  62  -9.026   1.903   4.142
  532   HD11  LEU  62          HD11      LEU  62 -11.883   0.993   4.411
  533   HD12  LEU  62          HD12      LEU  62 -11.332   2.486   3.650
  534   HD13  LEU  62          HD13      LEU  62 -10.910   0.928   2.941
  535   HD21  LEU  62          HD21      LEU  62 -10.811   1.740   6.559
  536   HD22  LEU  62          HD22      LEU  62  -9.109   2.208   6.555
  537   HD23  LEU  62          HD23      LEU  62 -10.303   3.220   5.739
  538    H    GLU  63           H        GLU  63  -7.214  -1.344   7.771
  539    HA   GLU  63           HA       GLU  63  -6.337  -3.738   6.430
  540    HB2  GLU  63           HB2      GLU  63  -5.482  -4.368   8.636
  541    HB3  GLU  63           HB3      GLU  63  -4.978  -2.742   8.198
  542    HG2  GLU  63           HG2      GLU  63  -6.832  -1.855   9.594
  543    HG3  GLU  63           HG3      GLU  63  -7.167  -3.506  10.114
  544    H    ALA  64           H        ALA  64  -6.960  -5.873   7.114
  545    HA   ALA  64           HA       ALA  64  -9.771  -6.209   7.231
  546    HB1  ALA  64           HB1      ALA  64  -8.270  -7.810   6.142
  547    HB2  ALA  64           HB2      ALA  64  -7.607  -8.252   7.715
  548    HB3  ALA  64           HB3      ALA  64  -9.299  -8.588   7.345
  549    H    GLY  65           H        GLY  65  -7.473  -5.641   9.653
  550    HA2  GLY  65           HA2      GLY  65  -8.830  -7.077  11.755
  551    HA3  GLY  65           HA3      GLY  65  -7.439  -6.022  11.936
  552    H    LYS  66           H        LYS  66  -9.916  -4.477  10.197
  553    HA   LYS  66           HA       LYS  66 -11.303  -3.587  12.588
  554    HB2  LYS  66           HB2      LYS  66 -10.557  -1.472  12.694
  555    HB3  LYS  66           HB3      LYS  66  -9.186  -2.061  11.765
  556    HG2  LYS  66           HG2      LYS  66 -11.652  -0.904  10.498
  557    HG3  LYS  66           HG3      LYS  66 -10.267   0.072  10.974
  558    HD2  LYS  66           HD2      LYS  66  -9.032  -0.614   9.228
  559    HD3  LYS  66           HD3      LYS  66  -9.616  -2.276   9.339
  560    HE2  LYS  66           HE2      LYS  66 -10.275  -1.068   7.247
  561    HE3  LYS  66           HE3      LYS  66 -11.618  -1.736   8.173
  562    HZ1  LYS  66           HZ1      LYS  66 -12.008   0.539   7.350
  563    HZ2  LYS  66           HZ2      LYS  66 -10.741   1.090   8.328
  564    HZ3  LYS  66           HZ3      LYS  66 -12.123   0.407   9.034
  565    H    ALA  67           H        ALA  67 -13.195  -2.234  12.092
  566    HA   ALA  67           HA       ALA  67 -14.476  -3.241   9.666
  567    HB1  ALA  67           HB1      ALA  67 -15.666  -1.747  12.000
  568    HB2  ALA  67           HB2      ALA  67 -16.549  -2.569  10.713
  569    HB3  ALA  67           HB3      ALA  67 -15.578  -3.504  11.853
  570    H    LEU  68           H        LEU  68 -16.125  -1.596   8.690
  571    HA   LEU  68           HA       LEU  68 -14.501   0.495   7.590
  572    HB2  LEU  68           HB2      LEU  68 -17.402  -0.210   7.185
  573    HB3  LEU  68           HB3      LEU  68 -16.545   1.009   6.263
  574    HG   LEU  68           HG       LEU  68 -15.900  -1.941   6.310
  575   HD11  LEU  68          HD11      LEU  68 -17.954  -1.466   5.115
  576   HD12  LEU  68          HD12      LEU  68 -17.140  -0.212   4.178
  577   HD13  LEU  68          HD13      LEU  68 -16.669  -1.901   3.988
  578   HD21  LEU  68          HD21      LEU  68 -14.322  -1.410   4.515
  579   HD22  LEU  68          HD22      LEU  68 -14.677   0.306   4.710
  580   HD23  LEU  68          HD23      LEU  68 -13.895  -0.585   6.015
  581    H    ASP  69           H        ASP  69 -17.576   0.496   9.374
  582    HA   ASP  69           HA       ASP  69 -17.781   3.301   9.614
  583    HB2  ASP  69           HB2      ASP  69 -19.769   2.004   9.811
  584    HB3  ASP  69           HB3      ASP  69 -19.083   1.004  11.082
  585    H    TYR  70           H        TYR  70 -15.934   0.999  11.357
  586    HA   TYR  70           HA       TYR  70 -15.626   2.199  13.833
  587    HB2  TYR  70           HB2      TYR  70 -14.597   0.147  13.718
  588    HB3  TYR  70           HB3      TYR  70 -13.928   0.438  12.118
  589    HD1  TYR  70           HD1      TYR  70 -13.533   1.369  15.700
  590    HD2  TYR  70           HD2      TYR  70 -11.729   1.095  11.866
  591    HE1  TYR  70           HE1      TYR  70 -11.347   1.896  16.698
  592    HE2  TYR  70           HE2      TYR  70  -9.541   1.614  12.843
  593    HH   TYR  70           HH       TYR  70  -8.999   1.638  16.242
  594    H    TYR  71           H        TYR  71 -14.136   3.002  10.744
  595    HA   TYR  71           HA       TYR  71 -12.579   5.167  11.850
  596    HB2  TYR  71           HB2      TYR  71 -13.075   4.089   9.104
  597    HB3  TYR  71           HB3      TYR  71 -12.468   5.731   9.267
  598    HD1  TYR  71           HD1      TYR  71 -11.726   2.180   9.877
  599    HD2  TYR  71           HD2      TYR  71 -10.208   6.152   9.952
  600    HE1  TYR  71           HE1      TYR  71  -9.445   1.295  10.134
  601    HE2  TYR  71           HE2      TYR  71  -7.924   5.277  10.211
  602    HH   TYR  71           HH       TYR  71  -7.131   2.006   9.722
  603    H    MET  72           H        MET  72 -13.480   6.709   9.296
  604    HA   MET  72           HA       MET  72 -15.717   8.077  10.625
  605    HB2  MET  72           HB2      MET  72 -13.637   9.078   8.679
  606    HB3  MET  72           HB3      MET  72 -15.040  10.019   9.159
  607    HG2  MET  72           HG2      MET  72 -14.287   9.995  11.468
  608    HG3  MET  72           HG3      MET  72 -12.899   9.006  11.014
  609    HE1  MET  72           HE1      MET  72 -14.353  11.859   8.766
  610    HE2  MET  72           HE2      MET  72 -14.694  12.469  10.386
  611    HE3  MET  72           HE3      MET  72 -13.501  13.279   9.371
  612    H    LEU  73           H        LEU  73 -15.742   5.719   8.649
  613    HA   LEU  73           HA       LEU  73 -16.700   6.939   6.207
  614    HB2  LEU  73           HB2      LEU  73 -17.072   4.038   6.572
  615    HB3  LEU  73           HB3      LEU  73 -16.538   4.934   5.175
  616    HG   LEU  73           HG       LEU  73 -14.878   4.057   7.525
  617   HD11  LEU  73          HD11      LEU  73 -15.269   2.374   5.845
  618   HD12  LEU  73          HD12      LEU  73 -14.783   3.493   4.571
  619   HD13  LEU  73          HD13      LEU  73 -13.597   2.930   5.750
  620   HD21  LEU  73          HD21      LEU  73 -14.238   6.330   6.946
  621   HD22  LEU  73          HD22      LEU  73 -12.993   5.178   6.465
  622   HD23  LEU  73          HD23      LEU  73 -14.075   5.864   5.252
  623    H    ARG  74           H        ARG  74 -18.599   7.011   5.437
  624    HA   ARG  74           HA       ARG  74 -20.829   5.625   6.578
  625    HB2  ARG  74           HB2      ARG  74 -22.065   7.891   6.923
  626    HB3  ARG  74           HB3      ARG  74 -21.019   7.275   8.189
  627    HG2  ARG  74           HG2      ARG  74 -20.572   9.576   8.024
  628    HG3  ARG  74           HG3      ARG  74 -19.211   8.766   7.258
  629    HD2  ARG  74           HD2      ARG  74 -21.038   9.187   5.202
  630    HD3  ARG  74           HD3      ARG  74 -21.076  10.664   6.164
  631    HE   ARG  74           HE       ARG  74 -18.504   9.541   5.286
  632   HH11  ARG  74          HH11      ARG  74 -20.864  12.155   5.215
  633   HH12  ARG  74          HH12      ARG  74 -19.764  13.274   4.454
  634   HH21  ARG  74          HH21      ARG  74 -17.085  11.006   4.298
  635   HH22  ARG  74          HH22      ARG  74 -17.632  12.623   3.937
  636    H    ASN  75           H        ASN  75 -22.873   7.045   5.545
  637    HA   ASN  75           HA       ASN  75 -22.833   6.441   2.797
  638    HB2  ASN  75           HB2      ASN  75 -24.645   8.212   4.444
  639    HB3  ASN  75           HB3      ASN  75 -24.890   7.966   2.722
  640   HD21  ASN  75          HD21      ASN  75 -23.777   5.476   4.947
  641   HD22  ASN  75          HD22      ASN  75 -25.200   4.497   4.847
  642    H    GLY  76           H        GLY  76 -21.179   7.409   1.631
  643    HA2  GLY  76           HA2      GLY  76 -21.320   9.481   0.144
  644    HA3  GLY  76           HA3      GLY  76 -21.171  10.360   1.652
  645    H    ASP  77           H        ASP  77 -19.205   7.823   2.229
  646    HA   ASP  77           HA       ASP  77 -16.901   9.425   1.540
  647    HB2  ASP  77           HB2      ASP  77 -17.183   6.820   3.020
  648    HB3  ASP  77           HB3      ASP  77 -15.616   7.523   2.629
  649    H    THR  78           H        THR  78 -15.354   9.027   0.082
  650    HA   THR  78           HA       THR  78 -15.853   6.967  -1.908
  651    HB   THR  78           HB       THR  78 -13.699   9.097  -1.830
  652    HG1  THR  78           HG1      THR  78 -15.543  10.238  -2.056
  653   HG21  THR  78          HG21      THR  78 -13.517   8.676  -4.240
  654   HG22  THR  78          HG22      THR  78 -14.721   7.392  -4.108
  655   HG23  THR  78          HG23      THR  78 -13.157   7.221  -3.309
  656    H    MET  79           H        MET  79 -14.801   5.071  -1.908
  657    HA   MET  79           HA       MET  79 -12.426   4.823  -0.190
  658    HB2  MET  79           HB2      MET  79 -14.528   3.736   0.746
  659    HB3  MET  79           HB3      MET  79 -14.452   2.625  -0.615
  660    HG2  MET  79           HG2      MET  79 -12.235   1.892   0.109
  661    HG3  MET  79           HG3      MET  79 -12.321   2.999   1.477
  662    HE1  MET  79           HE1      MET  79 -14.807  -0.831   0.936
  663    HE2  MET  79           HE2      MET  79 -14.997   0.551  -0.144
  664    HE3  MET  79           HE3      MET  79 -13.463  -0.325  -0.096
  665    H    GLU  80           H        GLU  80 -10.740   4.420  -1.398
  666    HA   GLU  80           HA       GLU  80 -11.027   3.664  -4.151
  667    HB2  GLU  80           HB2      GLU  80  -9.319   5.283  -3.084
  668    HB3  GLU  80           HB3      GLU  80  -8.447   3.835  -2.605
  669    HG2  GLU  80           HG2      GLU  80  -8.129   3.191  -4.885
  670    HG3  GLU  80           HG3      GLU  80  -9.168   4.503  -5.444
  671    H    TYR  81           H        TYR  81 -11.080   1.563  -4.888
  672    HA   TYR  81           HA       TYR  81  -9.841  -0.482  -3.211
  673    HB2  TYR  81           HB2      TYR  81 -12.173  -0.862  -4.117
  674    HB3  TYR  81           HB3      TYR  81 -11.473  -0.871  -5.733
  675    HD1  TYR  81           HD1      TYR  81 -11.630  -2.663  -2.522
  676    HD2  TYR  81           HD2      TYR  81 -10.275  -2.804  -6.553
  677    HE1  TYR  81           HE1      TYR  81 -11.184  -5.068  -2.282
  678    HE2  TYR  81           HE2      TYR  81  -9.834  -5.212  -6.324
  679    HH   TYR  81           HH       TYR  81  -9.379  -6.839  -4.538
  680    H    ARG  82           H        ARG  82  -7.793  -0.699  -3.602
  681    HA   ARG  82           HA       ARG  82  -6.846  -0.463  -6.367
  682    HB2  ARG  82           HB2      ARG  82  -4.915   0.897  -5.583
  683    HB3  ARG  82           HB3      ARG  82  -6.461   1.724  -5.449
  684    HG2  ARG  82           HG2      ARG  82  -6.524   1.416  -3.103
  685    HG3  ARG  82           HG3      ARG  82  -5.163   0.290  -3.150
  686    HD2  ARG  82           HD2      ARG  82  -5.049   3.210  -3.885
  687    HD3  ARG  82           HD3      ARG  82  -4.509   2.521  -2.355
  688    HE   ARG  82           HE       ARG  82  -2.970   1.143  -3.918
  689   HH11  ARG  82          HH11      ARG  82  -3.984   4.443  -4.441
  690   HH12  ARG  82          HH12      ARG  82  -2.504   4.919  -5.227
  691   HH21  ARG  82          HH21      ARG  82  -1.015   1.749  -4.971
  692   HH22  ARG  82          HH22      ARG  82  -0.816   3.380  -5.530
  693    H    LYS  83           H        LYS  83  -4.523  -1.134  -6.536
  694    HA   LYS  83           HA       LYS  83  -4.082  -3.628  -5.278
  695    HB2  LYS  83           HB2      LYS  83  -3.129  -2.835  -7.499
  696    HB3  LYS  83           HB3      LYS  83  -1.994  -1.864  -6.575
  697    HG2  LYS  83           HG2      LYS  83  -0.995  -3.815  -5.623
  698    HG3  LYS  83           HG3      LYS  83  -2.244  -4.852  -6.328
  699    HD2  LYS  83           HD2      LYS  83  -1.474  -4.247  -8.568
  700    HD3  LYS  83           HD3      LYS  83  -0.247  -3.192  -7.868
  701    HE2  LYS  83           HE2      LYS  83   0.756  -5.287  -8.535
  702    HE3  LYS  83           HE3      LYS  83   0.778  -5.145  -6.778
  703    HZ1  LYS  83           HZ1      LYS  83   0.115  -7.364  -7.646
  704    HZ2  LYS  83           HZ2      LYS  83  -1.296  -6.651  -8.273
  705    HZ3  LYS  83           HZ3      LYS  83  -1.016  -6.658  -6.603
  706    H    LYS  84           H        LYS  84  -3.241  -4.066  -3.358
  707    HA   LYS  84           HA       LYS  84  -2.796  -2.200  -1.348
  708    HB2  LYS  84           HB2      LYS  84  -1.971  -5.059  -1.748
  709    HB3  LYS  84           HB3      LYS  84  -1.401  -4.175  -0.340
  710    HG2  LYS  84           HG2      LYS  84  -4.316  -4.302  -1.003
  711    HG3  LYS  84           HG3      LYS  84  -3.516  -5.609  -0.126
  712    HD2  LYS  84           HD2      LYS  84  -2.824  -3.021   0.967
  713    HD3  LYS  84           HD3      LYS  84  -4.568  -3.265   0.956
  714    HE2  LYS  84           HE2      LYS  84  -3.580  -4.049   3.045
  715    HE3  LYS  84           HE3      LYS  84  -4.289  -5.383   2.138
  716    HZ1  LYS  84           HZ1      LYS  84  -2.099  -5.908   3.097
  717    HZ2  LYS  84           HZ2      LYS  84  -1.396  -4.699   2.137
  718    HZ3  LYS  84           HZ3      LYS  84  -2.122  -6.050   1.407
  719    H    GLN  85           H        GLN  85  -0.694  -3.474  -3.762
  720    HA   GLN  85           HA       GLN  85   1.678  -2.304  -2.551
  721    HB2  GLN  85           HB2      GLN  85   1.967  -3.754  -5.078
  722    HB3  GLN  85           HB3      GLN  85   2.835  -3.954  -3.562
  723    HG2  GLN  85           HG2      GLN  85   0.859  -5.197  -2.684
  724    HG3  GLN  85           HG3      GLN  85   0.172  -5.131  -4.310
  725   HE21  GLN  85          HE21      GLN  85   2.539  -6.561  -2.258
  726   HE22  GLN  85          HE22      GLN  85   3.096  -7.752  -3.381
  727    H    ARG  86           H        ARG  86   3.094  -1.019  -3.856
  728    HA   ARG  86           HA       ARG  86   1.952   0.007  -6.347
  729    HB2  ARG  86           HB2      ARG  86   3.098   2.265  -5.497
  730    HB3  ARG  86           HB3      ARG  86   1.416   1.876  -5.189
  731    HG2  ARG  86           HG2      ARG  86   2.213   2.639  -3.162
  732    HG3  ARG  86           HG3      ARG  86   2.239   0.885  -2.995
  733    HD2  ARG  86           HD2      ARG  86   4.558   0.781  -3.149
  734    HD3  ARG  86           HD3      ARG  86   4.674   2.374  -3.907
  735    HE   ARG  86           HE       ARG  86   3.976   1.910  -1.088
  736   HH11  ARG  86          HH11      ARG  86   5.504   3.817  -3.579
  737   HH12  ARG  86          HH12      ARG  86   5.832   5.167  -2.542
  738   HH21  ARG  86          HH21      ARG  86   4.357   3.675   0.297
  739   HH22  ARG  86          HH22      ARG  86   5.199   5.071  -0.318
  740    HA   PRO  87           HA       PRO  87   5.739  -0.821  -8.200
  741    HB2  PRO  87           HB2      PRO  87   6.146   1.306  -9.868
  742    HB3  PRO  87           HB3      PRO  87   4.962   0.030 -10.171
  743    HG2  PRO  87           HG2      PRO  87   4.552   2.755  -9.002
  744    HG3  PRO  87           HG3      PRO  87   3.564   1.887 -10.193
  745    HD2  PRO  87           HD2      PRO  87   2.864   2.026  -7.600
  746    HD3  PRO  87           HD3      PRO  87   2.542   0.581  -8.581
  747    H    LEU  88           H        LEU  88   7.441  -0.844  -6.902
  748    HA   LEU  88           HA       LEU  88   8.589   1.716  -6.049
  749    HB2  LEU  88           HB2      LEU  88   8.572  -0.991  -4.799
  750    HB3  LEU  88           HB3      LEU  88   9.899   0.106  -4.450
  751    HG   LEU  88           HG       LEU  88   6.979   0.744  -4.010
  752   HD11  LEU  88          HD11      LEU  88   7.725  -0.972  -2.468
  753   HD12  LEU  88          HD12      LEU  88   9.132   0.003  -2.038
  754   HD13  LEU  88          HD13      LEU  88   7.510   0.563  -1.629
  755   HD21  LEU  88          HD21      LEU  88   8.292   2.714  -4.487
  756   HD22  LEU  88          HD22      LEU  88   7.883   2.675  -2.771
  757   HD23  LEU  88          HD23      LEU  88   9.505   2.227  -3.305
  758    H    LYS  89           H        LYS  89  10.405   2.372  -6.899
  759    HA   LYS  89           HA       LYS  89  11.877   0.585  -8.662
  760    HB2  LYS  89           HB2      LYS  89  11.756   3.552  -8.279
  761    HB3  LYS  89           HB3      LYS  89  13.200   2.853  -8.995
  762    HG2  LYS  89           HG2      LYS  89  11.706   3.581 -10.731
  763    HG3  LYS  89           HG3      LYS  89  11.817   1.824 -10.745
  764    HD2  LYS  89           HD2      LYS  89   9.535   2.322 -11.057
  765    HD3  LYS  89           HD3      LYS  89   9.683   1.817  -9.374
  766    HE2  LYS  89           HE2      LYS  89   9.671   4.142  -8.655
  767    HE3  LYS  89           HE3      LYS  89   9.600   4.677 -10.335
  768    HZ1  LYS  89           HZ1      LYS  89   7.514   3.181  -8.840
  769    HZ2  LYS  89           HZ2      LYS  89   7.461   3.440 -10.513
  770    HZ3  LYS  89           HZ3      LYS  89   7.404   4.757  -9.452
  771    H    ILE  90           H        ILE  90  13.533  -0.515  -7.891
  772    HA   ILE  90           HA       ILE  90  14.920   0.497  -5.491
  773    HB   ILE  90           HB       ILE  90  14.138  -2.379  -6.021
  774   HG12  ILE  90          HG12      ILE  90  12.220  -0.978  -5.355
  775   HG13  ILE  90          HG13      ILE  90  12.631  -2.160  -4.117
  776   HG21  ILE  90          HG21      ILE  90  15.611  -1.119  -3.715
  777   HG22  ILE  90          HG22      ILE  90  14.978  -2.766  -3.717
  778   HG23  ILE  90          HG23      ILE  90  16.232  -2.303  -4.868
  779   HD11  ILE  90          HD11      ILE  90  13.757  -0.421  -2.830
  780   HD12  ILE  90          HD12      ILE  90  13.355   0.762  -4.076
  781   HD13  ILE  90          HD13      ILE  90  12.072  -0.008  -3.144
  782    H    ARG  91           H        ARG  91  17.141   0.445  -5.619
  783    HA   ARG  91           HA       ARG  91  18.318  -1.038  -7.868
  784    HB2  ARG  91           HB2      ARG  91  18.698   1.434  -7.807
  785    HB3  ARG  91           HB3      ARG  91  19.520   1.223  -6.269
  786    HG2  ARG  91           HG2      ARG  91  21.214  -0.153  -7.335
  787    HG3  ARG  91           HG3      ARG  91  20.387   0.024  -8.885
  788    HD2  ARG  91           HD2      ARG  91  21.551   2.271  -7.247
  789    HD3  ARG  91           HD3      ARG  91  22.289   1.558  -8.680
  790    HE   ARG  91           HE       ARG  91  20.122   2.317  -9.813
  791   HH11  ARG  91          HH11      ARG  91  21.747   4.025  -7.213
  792   HH12  ARG  91          HH12      ARG  91  21.101   5.580  -7.660
  793   HH21  ARG  91          HH21      ARG  91  19.245   4.358 -10.375
  794   HH22  ARG  91          HH22      ARG  91  19.656   5.763  -9.438
  795    H    MET  92           H        MET  92  19.454  -2.787  -7.397
  796    HA   MET  92           HA       MET  92  19.865  -3.566  -4.659
  797    HB2  MET  92           HB2      MET  92  19.849  -4.828  -7.305
  798    HB3  MET  92           HB3      MET  92  21.011  -5.518  -6.183
  799    HG2  MET  92           HG2      MET  92  18.692  -6.531  -6.311
  800    HG3  MET  92           HG3      MET  92  19.363  -6.219  -4.717
  801    HE1  MET  92           HE1      MET  92  16.066  -3.734  -6.751
  802    HE2  MET  92           HE2      MET  92  17.711  -3.855  -7.376
  803    HE3  MET  92           HE3      MET  92  16.666  -5.275  -7.366
  804    H    LEU  93           H        LEU  93  22.034  -5.038  -4.540
  805    HA   LEU  93           HA       LEU  93  23.905  -3.140  -3.734
  806    HB2  LEU  93           HB2      LEU  93  24.292  -6.100  -4.170
  807    HB3  LEU  93           HB3      LEU  93  25.414  -5.062  -3.318
  808    HG   LEU  93           HG       LEU  93  24.267  -6.134  -1.613
  809   HD11  LEU  93          HD11      LEU  93  24.316  -3.752  -1.218
  810   HD12  LEU  93          HD12      LEU  93  22.776  -3.559  -2.057
  811   HD13  LEU  93          HD13      LEU  93  22.846  -4.458  -0.542
  812   HD21  LEU  93          HD21      LEU  93  21.897  -6.546  -1.525
  813   HD22  LEU  93          HD22      LEU  93  21.647  -5.642  -3.018
  814   HD23  LEU  93          HD23      LEU  93  22.543  -7.161  -3.047
  815    H    ASP  94           H        ASP  94  23.941  -5.260  -6.590
  816    HA   ASP  94           HA       ASP  94  26.516  -4.338  -7.455
  817    HB2  ASP  94           HB2      ASP  94  25.690  -6.557  -8.107
  818    HB3  ASP  94           HB3      ASP  94  24.359  -5.815  -8.988
  819    H    GLY  95           H        GLY  95  23.531  -2.901  -7.379
  820    HA2  GLY  95           HA2      GLY  95  23.162  -0.692  -8.157
  821    HA3  GLY  95           HA3      GLY  95  24.347  -0.964  -9.428
  822    H    THR  96           H        THR  96  22.204  -3.541  -8.971
  823    HA   THR  96           HA       THR  96  21.045  -3.039 -11.573
  824    HB   THR  96           HB       THR  96  20.580  -5.373  -9.702
  825    HG1  THR  96           HG1      THR  96  22.710  -4.705 -11.346
  826   HG21  THR  96          HG21      THR  96  18.891  -5.153 -11.458
  827   HG22  THR  96          HG22      THR  96  19.916  -6.560 -11.743
  828   HG23  THR  96          HG23      THR  96  20.161  -5.086 -12.681
  829    H    VAL  97           H        VAL  97  19.004  -2.313 -11.917
  830    HA   VAL  97           HA       VAL  97  17.464  -1.766  -9.474
  831    HB   VAL  97           HB       VAL  97  18.181   0.283 -10.551
  832   HG11  VAL  97          HG11      VAL  97  16.734  -0.701 -12.997
  833   HG12  VAL  97          HG12      VAL  97  17.437   0.903 -12.788
  834   HG13  VAL  97          HG13      VAL  97  18.478  -0.520 -12.814
  835   HG21  VAL  97          HG21      VAL  97  16.012   0.319  -9.461
  836   HG22  VAL  97          HG22      VAL  97  16.008   1.376 -10.872
  837   HG23  VAL  97          HG23      VAL  97  15.232  -0.207 -10.953
  838    H    LYS  98           H        LYS  98  15.432  -2.338  -9.318
  839    HA   LYS  98           HA       LYS  98  14.026  -3.407 -11.652
  840    HB2  LYS  98           HB2      LYS  98  13.286  -5.419 -10.598
  841    HB3  LYS  98           HB3      LYS  98  15.035  -5.371 -10.441
  842    HG2  LYS  98           HG2      LYS  98  14.918  -4.858  -8.146
  843    HG3  LYS  98           HG3      LYS  98  13.202  -4.463  -8.243
  844    HD2  LYS  98           HD2      LYS  98  14.291  -7.219  -8.802
  845    HD3  LYS  98           HD3      LYS  98  13.766  -6.712  -7.195
  846    HE2  LYS  98           HE2      LYS  98  11.874  -7.730  -7.997
  847    HE3  LYS  98           HE3      LYS  98  11.565  -6.047  -8.429
  848    HZ1  LYS  98           HZ1      LYS  98  11.028  -7.535 -10.244
  849    HZ2  LYS  98           HZ2      LYS  98  12.607  -8.155 -10.256
  850    HZ3  LYS  98           HZ3      LYS  98  12.329  -6.537 -10.682
  851    H    THR  99           H        THR  99  11.696  -3.440 -11.379
  852    HA   THR  99           HA       THR  99  10.822  -1.709  -9.172
  853    HB   THR  99           HB       THR  99   9.452  -2.197 -11.829
  854    HG1  THR  99           HG1      THR  99  11.479  -0.879 -11.764
  855   HG21  THR  99          HG21      THR  99   7.916  -1.700  -9.986
  856   HG22  THR  99          HG22      THR  99   7.983  -0.367 -11.142
  857   HG23  THR  99          HG23      THR  99   8.841  -0.248  -9.605
  858    H    ILE 100           H        ILE 100   9.787  -2.786  -7.604
  859    HA   ILE 100           HA       ILE 100   8.329  -5.225  -8.346
  860    HB   ILE 100           HB       ILE 100  10.482  -5.656  -7.130
  861   HG12  ILE 100          HG12      ILE 100   8.229  -7.032  -6.978
  862   HG13  ILE 100          HG13      ILE 100   9.631  -7.469  -6.012
  863   HG21  ILE 100          HG21      ILE 100  10.582  -5.193  -4.719
  864   HG22  ILE 100          HG22      ILE 100  10.546  -3.722  -5.693
  865   HG23  ILE 100          HG23      ILE 100   9.091  -4.260  -4.853
  866   HD11  ILE 100          HD11      ILE 100   7.579  -7.568  -4.717
  867   HD12  ILE 100          HD12      ILE 100   8.663  -6.326  -4.088
  868   HD13  ILE 100          HD13      ILE 100   7.267  -5.866  -5.062
  869    H    MET 101           H        MET 101   6.348  -5.532  -7.312
  870    HA   MET 101           HA       MET 101   5.194  -3.102  -6.231
  871    HB2  MET 101           HB2      MET 101   3.916  -5.788  -6.783
  872    HB3  MET 101           HB3      MET 101   3.063  -4.297  -6.414
  873    HG2  MET 101           HG2      MET 101   4.799  -4.714  -8.833
  874    HG3  MET 101           HG3      MET 101   3.049  -4.909  -8.808
  875    HE1  MET 101           HE1      MET 101   2.204  -2.548  -6.824
  876    HE2  MET 101           HE2      MET 101   1.859  -1.266  -7.986
  877    HE3  MET 101           HE3      MET 101   1.351  -2.923  -8.323
  878    H    VAL 102           H        VAL 102   5.432  -2.721  -4.169
  879    HA   VAL 102           HA       VAL 102   5.120  -4.954  -2.264
  880    HB   VAL 102           HB       VAL 102   6.332  -2.477  -1.238
  881   HG11  VAL 102          HG11      VAL 102   7.797  -4.114  -0.122
  882   HG12  VAL 102          HG12      VAL 102   6.084  -4.434   0.146
  883   HG13  VAL 102          HG13      VAL 102   6.993  -5.407  -1.011
  884   HG21  VAL 102          HG21      VAL 102   7.430  -2.481  -3.369
  885   HG22  VAL 102          HG22      VAL 102   8.569  -3.041  -2.143
  886   HG23  VAL 102          HG23      VAL 102   7.800  -4.203  -3.227
  887    H    ASP 103           H        ASP 103   3.589  -4.868  -0.798
  888    HA   ASP 103           HA       ASP 103   1.413  -3.146  -0.987
  889    HB2  ASP 103           HB2      ASP 103   1.142  -5.298   0.007
  890    HB3  ASP 103           HB3      ASP 103   2.358  -4.956   1.234
  891    H    ASP 104           H        ASP 104   0.898  -1.222  -0.127
  892    HA   ASP 104           HA       ASP 104   2.994   0.151   1.374
  893    HB2  ASP 104           HB2      ASP 104   1.982   1.241  -0.610
  894    HB3  ASP 104           HB3      ASP 104   0.421   1.235   0.206
  895    H    SER 105           H        SER 105   0.339  -1.681   2.054
  896    HA   SER 105           HA       SER 105  -0.609  -0.143   4.330
  897    HB2  SER 105           HB2      SER 105  -2.173  -1.467   2.960
  898    HB3  SER 105           HB3      SER 105  -1.321  -2.937   3.410
  899    HG   SER 105           HG       SER 105  -1.845  -2.162   5.673
  900    H    LYS 106           H        LYS 106   2.214  -1.373   4.113
  901    HA   LYS 106           HA       LYS 106   2.255  -2.442   6.817
  902    HB2  LYS 106           HB2      LYS 106   3.611  -4.396   6.146
  903    HB3  LYS 106           HB3      LYS 106   1.995  -4.434   5.455
  904    HG2  LYS 106           HG2      LYS 106   3.177  -5.000   3.609
  905    HG3  LYS 106           HG3      LYS 106   3.244  -3.245   3.439
  906    HD2  LYS 106           HD2      LYS 106   5.403  -3.455   4.860
  907    HD3  LYS 106           HD3      LYS 106   5.366  -5.146   4.345
  908    HE2  LYS 106           HE2      LYS 106   6.707  -4.078   2.766
  909    HE3  LYS 106           HE3      LYS 106   5.133  -4.204   1.977
  910    HZ1  LYS 106           HZ1      LYS 106   6.263  -1.986   1.813
  911    HZ2  LYS 106           HZ2      LYS 106   5.976  -1.791   3.472
  912    HZ3  LYS 106           HZ3      LYS 106   4.677  -1.957   2.396
  913    H    THR 107           H        THR 107   4.501  -2.670   7.649
  914    HA   THR 107           HA       THR 107   5.844  -0.204   7.279
  915    HB   THR 107           HB       THR 107   7.540  -1.595   8.840
  916    HG1  THR 107           HG1      THR 107   6.617  -3.543   8.972
  917   HG21  THR 107          HG21      THR 107   6.247  -0.764  10.748
  918   HG22  THR 107          HG22      THR 107   4.855  -0.504   9.697
  919   HG23  THR 107          HG23      THR 107   6.325   0.444   9.466
  920    H    VAL 108           H        VAL 108   8.498  -0.581   7.508
  921    HA   VAL 108           HA       VAL 108   9.133  -1.008   4.756
  922    HB   VAL 108           HB       VAL 108  10.894  -0.182   7.037
  923   HG11  VAL 108          HG11      VAL 108  12.424   0.653   5.314
  924   HG12  VAL 108          HG12      VAL 108  12.213  -1.095   5.215
  925   HG13  VAL 108          HG13      VAL 108  11.384  -0.038   4.070
  926   HG21  VAL 108          HG21      VAL 108   9.491   1.469   4.952
  927   HG22  VAL 108          HG22      VAL 108   9.079   1.382   6.666
  928   HG23  VAL 108          HG23      VAL 108  10.617   2.084   6.163
  929    H    THR 109           H        THR 109  10.334  -2.512   7.769
  930    HA   THR 109           HA       THR 109  12.118  -4.312   6.816
  931    HB   THR 109           HB       THR 109  10.001  -4.974   8.866
  932    HG1  THR 109           HG1      THR 109  11.843  -4.240  10.277
  933   HG21  THR 109          HG21      THR 109  11.705  -6.480   9.783
  934   HG22  THR 109          HG22      THR 109  12.790  -6.064   8.457
  935   HG23  THR 109          HG23      THR 109  11.287  -6.925   8.129
  936    H    ASP 110           H        ASP 110   8.588  -4.958   6.966
  937    HA   ASP 110           HA       ASP 110   8.696  -7.452   5.675
  938    HB2  ASP 110           HB2      ASP 110   6.761  -6.484   6.991
  939    HB3  ASP 110           HB3      ASP 110   6.379  -5.506   5.577
  940    H    MET 111           H        MET 111   8.649  -4.191   4.457
  941    HA   MET 111           HA       MET 111   8.082  -4.733   1.738
  942    HB2  MET 111           HB2      MET 111   8.051  -2.459   2.759
  943    HB3  MET 111           HB3      MET 111   9.803  -2.523   2.886
  944    HG2  MET 111           HG2      MET 111   9.837  -2.833   0.378
  945    HG3  MET 111           HG3      MET 111   8.127  -2.412   0.402
  946    HE1  MET 111           HE1      MET 111   7.646  -0.387   2.381
  947    HE2  MET 111           HE2      MET 111   9.186  -0.244   3.227
  948    HE3  MET 111           HE3      MET 111   8.558   1.126   2.311
  949    H    LEU 112           H        LEU 112  11.113  -4.370   3.529
  950    HA   LEU 112           HA       LEU 112  12.814  -4.762   1.316
  951    HB2  LEU 112           HB2      LEU 112  13.231  -3.903   3.800
  952    HB3  LEU 112           HB3      LEU 112  13.699  -5.576   4.033
  953    HG   LEU 112           HG       LEU 112  15.276  -5.276   2.064
  954   HD11  LEU 112          HD11      LEU 112  14.286  -3.293   1.110
  955   HD12  LEU 112          HD12      LEU 112  14.596  -2.391   2.597
  956   HD13  LEU 112          HD13      LEU 112  15.946  -2.952   1.606
  957   HD21  LEU 112          HD21      LEU 112  15.690  -3.686   4.585
  958   HD22  LEU 112          HD22      LEU 112  16.107  -5.378   4.317
  959   HD23  LEU 112          HD23      LEU 112  16.961  -4.108   3.439
  960    H    MET 113           H        MET 113  11.506  -6.957   3.758
  961    HA   MET 113           HA       MET 113  12.723  -9.343   3.049
  962    HB2  MET 113           HB2      MET 113  11.136  -9.124   4.922
  963    HB3  MET 113           HB3      MET 113   9.820  -8.902   3.784
  964    HG2  MET 113           HG2      MET 113  10.316 -11.170   2.875
  965    HG3  MET 113           HG3      MET 113  11.469 -11.381   4.192
  966    HE1  MET 113           HE1      MET 113  10.001  -9.888   6.589
  967    HE2  MET 113           HE2      MET 113   9.144 -11.236   7.335
  968    HE3  MET 113           HE3      MET 113  10.794 -11.456   6.752
  969    H    THR 114           H        THR 114   9.886  -7.793   1.707
  970    HA   THR 114           HA       THR 114   9.258  -9.743  -0.217
  971    HB   THR 114           HB       THR 114   8.608  -6.796  -0.125
  972    HG1  THR 114           HG1      THR 114   7.807  -8.018   1.646
  973   HG21  THR 114          HG21      THR 114   8.300  -7.636  -2.390
  974   HG22  THR 114          HG22      THR 114   6.730  -7.366  -1.632
  975   HG23  THR 114          HG23      THR 114   7.368  -9.005  -1.779
  976    H    ILE 115           H        ILE 115  11.335  -6.857  -0.335
  977    HA   ILE 115           HA       ILE 115  11.634  -6.932  -3.180
  978    HB   ILE 115           HB       ILE 115  13.263  -5.456  -1.104
  979   HG12  ILE 115          HG12      ILE 115  11.002  -4.470  -2.859
  980   HG13  ILE 115          HG13      ILE 115  10.834  -4.885  -1.156
  981   HG21  ILE 115          HG21      ILE 115  13.094  -5.089  -4.094
  982   HG22  ILE 115          HG22      ILE 115  13.963  -4.033  -2.981
  983   HG23  ILE 115          HG23      ILE 115  14.479  -5.706  -3.195
  984   HD11  ILE 115          HD11      ILE 115  12.417  -3.116  -0.577
  985   HD12  ILE 115          HD12      ILE 115  12.563  -2.697  -2.284
  986   HD13  ILE 115          HD13      ILE 115  11.021  -2.491  -1.453
  987    H    CYS 116           H        CYS 116  13.735  -7.792  -0.422
  988    HA   CYS 116           HA       CYS 116  15.926  -8.583  -2.036
  989    HB2  CYS 116           HB2      CYS 116  15.319  -9.531   0.776
  990    HB3  CYS 116           HB3      CYS 116  16.884  -9.505  -0.024
  991    HG   CYS 116           HG       CYS 116  16.157  -6.480  -0.245
  992    H    ALA 117           H        ALA 117  13.035 -10.194  -0.972
  993    HA   ALA 117           HA       ALA 117  13.853 -12.856  -1.487
  994    HB1  ALA 117           HB1      ALA 117  11.067 -11.704  -1.515
  995    HB2  ALA 117           HB2      ALA 117  11.489 -13.413  -1.402
  996    HB3  ALA 117           HB3      ALA 117  11.913 -12.312  -0.092
  997    H    ARG 118           H        ARG 118  12.783 -10.263  -3.545
  998    HA   ARG 118           HA       ARG 118  11.976 -11.900  -5.745
  999    HB2  ARG 118           HB2      ARG 118  12.994  -9.062  -5.998
 1000    HB3  ARG 118           HB3      ARG 118  11.857  -9.911  -7.039
 1001    HG2  ARG 118           HG2      ARG 118  11.353  -8.986  -4.223
 1002    HG3  ARG 118           HG3      ARG 118  10.703  -8.279  -5.697
 1003    HD2  ARG 118           HD2      ARG 118  10.171 -11.115  -4.852
 1004    HD3  ARG 118           HD3      ARG 118   9.148  -9.756  -4.400
 1005    HE   ARG 118           HE       ARG 118   9.622 -10.149  -7.250
 1006   HH11  ARG 118          HH11      ARG 118   7.516 -10.638  -4.483
 1007   HH12  ARG 118          HH12      ARG 118   6.080 -10.819  -5.445
 1008   HH21  ARG 118          HH21      ARG 118   7.716 -10.404  -8.521
 1009   HH22  ARG 118          HH22      ARG 118   6.191 -10.685  -7.723
 1010    H    ILE 119           H        ILE 119  14.987 -10.421  -4.702
 1011    HA   ILE 119           HA       ILE 119  16.417 -11.117  -7.099
 1012    HB   ILE 119           HB       ILE 119  17.824 -10.488  -4.538
 1013   HG12  ILE 119          HG12      ILE 119  15.880  -8.954  -4.606
 1014   HG13  ILE 119          HG13      ILE 119  17.414  -8.106  -4.779
 1015   HG21  ILE 119          HG21      ILE 119  19.280  -9.221  -6.053
 1016   HG22  ILE 119          HG22      ILE 119  19.108 -10.901  -6.558
 1017   HG23  ILE 119          HG23      ILE 119  18.219  -9.633  -7.401
 1018   HD11  ILE 119          HD11      ILE 119  15.515  -8.800  -7.009
 1019   HD12  ILE 119          HD12      ILE 119  15.736  -7.208  -6.282
 1020   HD13  ILE 119          HD13      ILE 119  17.052  -7.954  -7.188
 1021    H    GLY 120           H        GLY 120  15.795 -12.499  -3.975
 1022    HA2  GLY 120           HA2      GLY 120  15.962 -14.899  -3.726
 1023    HA3  GLY 120           HA3      GLY 120  17.382 -14.846  -4.759
 1024    H    ILE 121           H        ILE 121  16.943 -12.452  -2.297
 1025    HA   ILE 121           HA       ILE 121  19.314 -13.458  -0.919
 1026    HB   ILE 121           HB       ILE 121  17.804 -10.914  -0.343
 1027   HG12  ILE 121          HG12      ILE 121  20.179 -11.241  -2.188
 1028   HG13  ILE 121          HG13      ILE 121  18.522 -11.004  -2.733
 1029   HG21  ILE 121          HG21      ILE 121  19.989 -10.190   0.562
 1030   HG22  ILE 121          HG22      ILE 121  19.312 -11.581   1.410
 1031   HG23  ILE 121          HG23      ILE 121  20.617 -11.807   0.246
 1032   HD11  ILE 121          HD11      ILE 121  20.149  -9.058  -1.108
 1033   HD12  ILE 121          HD12      ILE 121  19.771  -8.930  -2.826
 1034   HD13  ILE 121          HD13      ILE 121  18.481  -8.819  -1.628
 1035    H    THR 122           H        THR 122  19.228 -14.408   1.058
 1036    HA   THR 122           HA       THR 122  16.573 -14.798   2.201
 1037    HB   THR 122           HB       THR 122  18.040 -16.766   1.859
 1038    HG1  THR 122           HG1      THR 122  16.429 -16.832   3.478
 1039   HG21  THR 122          HG21      THR 122  19.723 -15.545   4.051
 1040   HG22  THR 122          HG22      THR 122  20.206 -15.757   2.367
 1041   HG23  THR 122          HG23      THR 122  19.917 -17.167   3.385
 1042    H    ASN 123           H        ASN 123  19.686 -13.365   3.073
 1043    HA   ASN 123           HA       ASN 123  18.667 -12.636   5.697
 1044    HB2  ASN 123           HB2      ASN 123  20.972 -11.682   6.045
 1045    HB3  ASN 123           HB3      ASN 123  20.926 -13.413   5.740
 1046   HD21  ASN 123          HD21      ASN 123  23.091 -11.460   5.405
 1047   HD22  ASN 123          HD22      ASN 123  23.577 -11.592   3.742
 1048    H    HIS 124           H        HIS 124  17.008 -11.279   4.878
 1049    HA   HIS 124           HA       HIS 124  17.742  -8.879   3.426
 1050    HB2  HIS 124           HB2      HIS 124  15.384  -8.384   3.363
 1051    HB3  HIS 124           HB3      HIS 124  15.591 -10.093   3.001
 1052    HD1  HIS 124           HD1      HIS 124  14.139  -7.756   5.518
 1053    HD2  HIS 124           HD2      HIS 124  14.613 -11.854   4.986
 1054    HE1  HIS 124           HE1      HIS 124  12.618  -8.839   7.197
 1055    HE2  HIS 124           HE2      HIS 124  13.136 -11.302   7.040
 1056    H    ASP 125           H        ASP 125  17.631  -9.851   6.639
 1057    HA   ASP 125           HA       ASP 125  16.669  -7.445   7.836
 1058    HB2  ASP 125           HB2      ASP 125  17.330  -8.436   9.940
 1059    HB3  ASP 125           HB3      ASP 125  16.564  -9.671   8.948
 1060    H    GLU 126           H        GLU 126  19.615  -8.353   6.424
 1061    HA   GLU 126           HA       GLU 126  21.196  -6.584   8.125
 1062    HB2  GLU 126           HB2      GLU 126  22.162  -8.310   5.846
 1063    HB3  GLU 126           HB3      GLU 126  23.131  -7.565   7.101
 1064    HG2  GLU 126           HG2      GLU 126  21.740  -8.943   8.750
 1065    HG3  GLU 126           HG3      GLU 126  21.227  -9.864   7.340
 1066    H    TYR 127           H        TYR 127  19.164  -5.800   6.026
 1067    HA   TYR 127           HA       TYR 127  20.926  -3.926   4.602
 1068    HB2  TYR 127           HB2      TYR 127  18.346  -5.141   3.609
 1069    HB3  TYR 127           HB3      TYR 127  19.268  -3.898   2.774
 1070    HD1  TYR 127           HD1      TYR 127  21.818  -4.557   2.400
 1071    HD2  TYR 127           HD2      TYR 127  18.627  -7.302   2.950
 1072    HE1  TYR 127           HE1      TYR 127  23.121  -6.281   1.252
 1073    HE2  TYR 127           HE2      TYR 127  19.909  -9.045   1.813
 1074    HH   TYR 127           HH       TYR 127  23.271  -8.651   1.072
 1075    H    SER 128           H        SER 128  20.283  -1.808   4.499
 1076    HA   SER 128           HA       SER 128  17.791  -1.135   5.904
 1077    HB2  SER 128           HB2      SER 128  18.889   1.189   5.985
 1078    HB3  SER 128           HB3      SER 128  19.572  -0.055   7.035
 1079    HG   SER 128           HG       SER 128  21.125   1.205   5.777
 1080    H    LEU 129           H        LEU 129  16.719   0.883   4.945
 1081    HA   LEU 129           HA       LEU 129  16.903   0.655   2.014
 1082    HB2  LEU 129           HB2      LEU 129  14.719   0.114   3.504
 1083    HB3  LEU 129           HB3      LEU 129  14.478   1.833   3.258
 1084    HG   LEU 129           HG       LEU 129  14.911  -0.088   0.971
 1085   HD11  LEU 129          HD11      LEU 129  12.941  -0.793   2.212
 1086   HD12  LEU 129          HD12      LEU 129  12.305   0.851   2.153
 1087   HD13  LEU 129          HD13      LEU 129  12.488  -0.077   0.665
 1088   HD21  LEU 129          HD21      LEU 129  15.308   2.232   0.415
 1089   HD22  LEU 129          HD22      LEU 129  13.801   1.690  -0.323
 1090   HD23  LEU 129          HD23      LEU 129  13.762   2.695   1.127
 1091    H    VAL 130           H        VAL 130  17.001   2.579   0.816
 1092    HA   VAL 130           HA       VAL 130  17.013   5.062   2.353
 1093    HB   VAL 130           HB       VAL 130  19.342   4.367   2.268
 1094   HG11  VAL 130          HG11      VAL 130  20.551   4.196   0.163
 1095   HG12  VAL 130          HG12      VAL 130  19.302   2.961   0.321
 1096   HG13  VAL 130          HG13      VAL 130  19.029   4.363  -0.714
 1097   HG21  VAL 130          HG21      VAL 130  20.340   6.325   1.230
 1098   HG22  VAL 130          HG22      VAL 130  18.822   6.657   0.396
 1099   HG23  VAL 130          HG23      VAL 130  18.897   6.742   2.155
 1100    H    ARG 131           H        ARG 131  15.650   6.417   1.444
 1101    HA   ARG 131           HA       ARG 131  14.840   5.941  -1.337
 1102    HB2  ARG 131           HB2      ARG 131  13.536   7.760   0.678
 1103    HB3  ARG 131           HB3      ARG 131  12.863   7.188  -0.839
 1104    HG2  ARG 131           HG2      ARG 131  13.032   4.849   0.192
 1105    HG3  ARG 131           HG3      ARG 131  13.239   5.704   1.729
 1106    HD2  ARG 131           HD2      ARG 131  10.913   5.306   1.511
 1107    HD3  ARG 131           HD3      ARG 131  11.174   7.018   1.133
 1108    HE   ARG 131           HE       ARG 131  10.794   4.920  -0.910
 1109   HH11  ARG 131          HH11      ARG 131  10.344   8.200   0.206
 1110   HH12  ARG 131          HH12      ARG 131   9.555   8.714  -1.257
 1111   HH21  ARG 131          HH21      ARG 131   9.717   5.610  -2.819
 1112   HH22  ARG 131          HH22      ARG 131   9.193   7.264  -2.948
 1113    H    GLU 132           H        GLU 132  16.280   7.039  -2.583
 1114    HA   GLU 132           HA       GLU 132  16.863   9.801  -2.035
 1115    HB2  GLU 132           HB2      GLU 132  17.395   8.131  -4.507
 1116    HB3  GLU 132           HB3      GLU 132  17.942   9.789  -4.292
 1117    HG2  GLU 132           HG2      GLU 132  19.189   9.008  -2.264
 1118    HG3  GLU 132           HG3      GLU 132  18.779   7.359  -2.741
 1119    H    LEU 133           H        LEU 133  15.451  11.375  -2.363
 1120    HA   LEU 133           HA       LEU 133  13.378  10.922  -4.402
 1121    HB2  LEU 133           HB2      LEU 133  12.990  12.634  -1.967
 1122    HB3  LEU 133           HB3      LEU 133  11.774  11.966  -3.037
 1123    HG   LEU 133           HG       LEU 133  13.460  10.401  -1.086
 1124   HD11  LEU 133          HD11      LEU 133  10.517  11.072  -1.087
 1125   HD12  LEU 133          HD12      LEU 133  11.334  10.018   0.067
 1126   HD13  LEU 133          HD13      LEU 133  11.735  11.735   0.002
 1127   HD21  LEU 133          HD21      LEU 133  12.050   8.501  -1.721
 1128   HD22  LEU 133          HD22      LEU 133  11.285   9.491  -2.964
 1129   HD23  LEU 133          HD23      LEU 133  13.000   9.098  -3.081
 1130    H    MET 134           H        MET 134  12.155  13.148  -4.625
 1131    HA   MET 134           HA       MET 134  14.121  15.136  -5.516
 1132    HB2  MET 134           HB2      MET 134  11.957  16.038  -6.682
 1133    HB3  MET 134           HB3      MET 134  12.777  14.633  -7.351
 1134    HG2  MET 134           HG2      MET 134  11.034  13.307  -6.990
 1135    HG3  MET 134           HG3      MET 134  10.801  13.915  -5.353
 1136    HE1  MET 134           HE1      MET 134  10.188  16.935  -5.616
 1137    HE2  MET 134           HE2      MET 134   8.435  16.920  -5.816
 1138    HE3  MET 134           HE3      MET 134   9.205  15.804  -4.686
 1139    H    GLU 135           H        GLU 135  13.096  14.642  -2.778
 1140    HA   GLU 135           HA       GLU 135  11.080  16.276  -1.903
 1141    HB2  GLU 135           HB2      GLU 135  13.566  15.204  -0.646
 1142    HB3  GLU 135           HB3      GLU 135  12.551  16.326   0.253
 1143    HG2  GLU 135           HG2      GLU 135  11.415  13.866  -1.005
 1144    HG3  GLU 135           HG3      GLU 135  12.172  13.833   0.589
 1145    H    GLU 136           H        GLU 136  10.797  18.352  -2.165
 1146    HA   GLU 136           HA       GLU 136  12.947  20.224  -2.465
 1147    HB2  GLU 136           HB2      GLU 136  11.149  21.882  -2.629
 1148    HB3  GLU 136           HB3      GLU 136  10.806  20.485  -3.642
 1149    HG2  GLU 136           HG2      GLU 136   9.292  19.613  -1.931
 1150    HG3  GLU 136           HG3      GLU 136   9.617  21.028  -0.933
 1151    H    LYS 137           H        LYS 137  10.958  18.998   0.078
 1152    HA   LYS 137           HA       LYS 137  11.587  21.152   1.918
 1153    HB2  LYS 137           HB2      LYS 137  10.149  18.540   2.417
 1154    HB3  LYS 137           HB3      LYS 137  10.214  19.914   3.511
 1155    HG2  LYS 137           HG2      LYS 137   8.959  21.260   1.931
 1156    HG3  LYS 137           HG3      LYS 137   8.940  19.917   0.785
 1157    HD2  LYS 137           HD2      LYS 137   7.704  18.563   2.419
 1158    HD3  LYS 137           HD3      LYS 137   7.701  19.932   3.534
 1159    HE2  LYS 137           HE2      LYS 137   6.475  21.254   1.854
 1160    HE3  LYS 137           HE3      LYS 137   6.424  19.837   0.806
 1161    HZ1  LYS 137           HZ1      LYS 137   4.373  20.112   2.052
 1162    HZ2  LYS 137           HZ2      LYS 137   5.222  20.025   3.517
 1163    HZ3  LYS 137           HZ3      LYS 137   5.155  18.673   2.495
 1164    H    LYS 138           H        LYS 138  11.886  17.616   2.146
 1165    HA   LYS 138           HA       LYS 138  13.785  17.738   4.248
 1166    HB2  LYS 138           HB2      LYS 138  13.156  15.437   2.390
 1167    HB3  LYS 138           HB3      LYS 138  14.020  15.321   3.914
 1168    HG2  LYS 138           HG2      LYS 138  11.941  16.203   5.028
 1169    HG3  LYS 138           HG3      LYS 138  11.136  15.984   3.471
 1170    HD2  LYS 138           HD2      LYS 138  12.684  13.699   4.538
 1171    HD3  LYS 138           HD3      LYS 138  11.164  14.082   5.345
 1172    HE2  LYS 138           HE2      LYS 138  11.465  13.621   2.380
 1173    HE3  LYS 138           HE3      LYS 138  10.977  12.378   3.531
 1174    HZ1  LYS 138           HZ1      LYS 138   9.471  14.912   3.398
 1175    HZ2  LYS 138           HZ2      LYS 138   8.942  13.372   3.874
 1176    HZ3  LYS 138           HZ3      LYS 138   9.197  13.714   2.233
 1177    H    ASP 169           H        ASP 169  14.082  16.801   0.855
 1178    HA   ASP 169           HA       ASP 169  15.816  16.349  -0.474
 1179    HB2  ASP 169           HB2      ASP 169  16.109  18.814  -0.344
 1180    HB3  ASP 169           HB3      ASP 169  17.155  18.605   1.055
 1181    H    GLU 170           H        GLU 170  16.058  14.349   0.343
 1182    HA   GLU 170           HA       GLU 170  18.327  13.914   2.114
 1183    HB2  GLU 170           HB2      GLU 170  15.566  13.843   2.938
 1184    HB3  GLU 170           HB3      GLU 170  16.293  12.254   3.121
 1185    HG2  GLU 170           HG2      GLU 170  17.261  14.834   4.318
 1186    HG3  GLU 170           HG3      GLU 170  16.511  13.481   5.165
 1187    H    LEU 171           H        LEU 171  19.006  11.747   2.255
 1188    HA   LEU 171           HA       LEU 171  18.442  10.087  -0.033
 1189    HB2  LEU 171           HB2      LEU 171  19.972   9.375   2.474
 1190    HB3  LEU 171           HB3      LEU 171  20.033   8.544   0.931
 1191    HG   LEU 171           HG       LEU 171  21.106  11.269   1.572
 1192   HD11  LEU 171          HD11      LEU 171  22.453   8.714   0.703
 1193   HD12  LEU 171          HD12      LEU 171  23.256  10.262   0.968
 1194   HD13  LEU 171          HD13      LEU 171  22.500   9.418   2.319
 1195   HD21  LEU 171          HD21      LEU 171  20.100  11.290  -0.646
 1196   HD22  LEU 171          HD22      LEU 171  21.861  11.332  -0.765
 1197   HD23  LEU 171          HD23      LEU 171  20.995   9.824  -1.074
 1198    H    ASN 172           H        ASN 172  17.313  10.586   3.127
 1199    HA   ASN 172           HA       ASN 172  15.711   9.632   4.404
 1200    HB2  ASN 172           HB2      ASN 172  14.702   8.734   1.701
 1201    HB3  ASN 172           HB3      ASN 172  13.776   8.639   3.184
 1202   HD21  ASN 172          HD21      ASN 172  14.572  10.485   0.541
 1203   HD22  ASN 172          HD22      ASN 172  13.907  11.999   1.056
 1204    H    TRP 173           H        TRP 173  17.265   8.179   5.377
 1205    HA   TRP 173           HA       TRP 173  17.494   5.508   4.271
 1206    HB2  TRP 173           HB2      TRP 173  18.596   6.774   6.794
 1207    HB3  TRP 173           HB3      TRP 173  18.895   5.109   6.316
 1208    HD1  TRP 173           HD1      TRP 173  19.724   8.711   5.256
 1209    HE1  TRP 173           HE1      TRP 173  21.876   8.674   3.862
 1210    HE3  TRP 173           HE3      TRP 173  20.342   3.651   4.892
 1211    HZ2  TRP 173           HZ2      TRP 173  23.611   6.741   2.743
 1212    HZ3  TRP 173           HZ3      TRP 173  22.277   2.790   3.643
 1213    HH2  TRP 173           HH2      TRP 173  23.879   4.304   2.590
 1214    H    LEU 174           H        LEU 174  15.731   4.272   4.559
 1215    HA   LEU 174           HA       LEU 174  13.778   4.821   6.532
 1216    HB2  LEU 174           HB2      LEU 174  14.144   2.421   4.754
 1217    HB3  LEU 174           HB3      LEU 174  12.779   2.643   5.829
 1218    HG   LEU 174           HG       LEU 174  13.446   4.139   3.320
 1219   HD11  LEU 174          HD11      LEU 174  12.074   2.188   3.079
 1220   HD12  LEU 174          HD12      LEU 174  11.025   2.709   4.401
 1221   HD13  LEU 174          HD13      LEU 174  11.054   3.615   2.884
 1222   HD21  LEU 174          HD21      LEU 174  11.583   5.027   5.519
 1223   HD22  LEU 174          HD22      LEU 174  13.015   5.878   4.943
 1224   HD23  LEU 174          HD23      LEU 174  11.608   5.706   3.889
 1225    H    ASP 175           H        ASP 175  13.635   4.274   8.465
 1226    HA   ASP 175           HA       ASP 175  15.658   2.883   9.886
 1227    HB2  ASP 175           HB2      ASP 175  13.976   3.307  11.805
 1228    HB3  ASP 175           HB3      ASP 175  14.692   4.702  11.000
 1229    H    HIS 176           H        HIS 176  12.871   1.811   8.321
 1230    HA   HIS 176           HA       HIS 176  11.904  -0.233   8.140
 1231    HB2  HIS 176           HB2      HIS 176  14.032  -1.032  10.098
 1232    HB3  HIS 176           HB3      HIS 176  12.779  -2.155   9.578
 1233    HD1  HIS 176           HD1      HIS 176  12.713  -2.596   6.919
 1234    HD2  HIS 176           HD2      HIS 176  16.158  -0.876   8.439
 1235    HE1  HIS 176           HE1      HIS 176  14.433  -2.841   5.112
 1236    HE2  HIS 176           HE2      HIS 176  16.586  -2.135   6.221
 1237    H    GLY 177           H        GLY 177  11.180   1.882  10.130
 1238    HA2  GLY 177           HA2      GLY 177   9.482   0.148  11.824
 1239    HA3  GLY 177           HA3      GLY 177  10.336   1.519  12.512
 1240    H    ARG 178           H        ARG 178   9.874   3.233  10.198
 1241    HA   ARG 178           HA       ARG 178   7.175   4.044  10.933
 1242    HB2  ARG 178           HB2      ARG 178   8.731   5.806  11.057
 1243    HB3  ARG 178           HB3      ARG 178   9.455   5.392   9.511
 1244    HG2  ARG 178           HG2      ARG 178   7.646   6.284   8.301
 1245    HG3  ARG 178           HG3      ARG 178   6.627   6.368   9.744
 1246    HD2  ARG 178           HD2      ARG 178   7.588   8.559   8.959
 1247    HD3  ARG 178           HD3      ARG 178   7.884   8.152  10.648
 1248    HE   ARG 178           HE       ARG 178  10.040   7.254   9.082
 1249   HH11  ARG 178          HH11      ARG 178   8.589  10.234  10.202
 1250   HH12  ARG 178          HH12      ARG 178  10.097  11.091  10.271
 1251   HH21  ARG 178          HH21      ARG 178  12.037   8.377   9.174
 1252   HH22  ARG 178          HH22      ARG 178  12.049  10.039   9.690
 1253    H    THR 179           H        THR 179   5.483   4.340   9.526
 1254    HA   THR 179           HA       THR 179   5.480   2.686   7.184
 1255    HB   THR 179           HB       THR 179   3.485   2.999   8.700
 1256    HG1  THR 179           HG1      THR 179   2.365   2.358   7.028
 1257   HG21  THR 179          HG21      THR 179   2.044   4.938   8.312
 1258   HG22  THR 179          HG22      THR 179   3.269   5.639   7.256
 1259   HG23  THR 179          HG23      THR 179   3.605   5.424   8.974
 1260    H    LEU 180           H        LEU 180   4.711   3.553   5.052
 1261    HA   LEU 180           HA       LEU 180   6.687   5.393   4.240
 1262    HB2  LEU 180           HB2      LEU 180   4.424   4.140   2.706
 1263    HB3  LEU 180           HB3      LEU 180   5.823   4.931   2.006
 1264    HG   LEU 180           HG       LEU 180   6.366   2.716   1.824
 1265   HD11  LEU 180          HD11      LEU 180   8.075   2.202   3.559
 1266   HD12  LEU 180          HD12      LEU 180   8.220   3.799   2.822
 1267   HD13  LEU 180          HD13      LEU 180   7.516   3.631   4.432
 1268   HD21  LEU 180          HD21      LEU 180   5.626   1.940   4.596
 1269   HD22  LEU 180          HD22      LEU 180   4.399   2.006   3.323
 1270   HD23  LEU 180          HD23      LEU 180   5.793   0.941   3.157
 1271    H    ARG 181           H        ARG 181   3.126   5.555   4.220
 1272    HA   ARG 181           HA       ARG 181   2.894   8.036   2.972
 1273    HB2  ARG 181           HB2      ARG 181   1.147   6.403   4.730
 1274    HB3  ARG 181           HB3      ARG 181   0.706   8.087   4.491
 1275    HG2  ARG 181           HG2      ARG 181   0.340   7.802   2.220
 1276    HG3  ARG 181           HG3      ARG 181   1.298   6.322   2.152
 1277    HD2  ARG 181           HD2      ARG 181  -1.271   6.542   3.704
 1278    HD3  ARG 181           HD3      ARG 181  -1.208   6.027   2.016
 1279    HE   ARG 181           HE       ARG 181   0.044   4.103   2.682
 1280   HH11  ARG 181          HH11      ARG 181  -1.356   5.948   5.327
 1281   HH12  ARG 181          HH12      ARG 181  -1.145   4.678   6.492
 1282   HH21  ARG 181          HH21      ARG 181   0.317   2.437   4.217
 1283   HH22  ARG 181          HH22      ARG 181  -0.228   2.670   5.858
 1284    H    GLU 182           H        GLU 182   3.616   7.269   6.306
 1285    HA   GLU 182           HA       GLU 182   3.024   9.879   7.316
 1286    HB2  GLU 182           HB2      GLU 182   2.954   7.821   8.706
 1287    HB3  GLU 182           HB3      GLU 182   4.701   7.697   8.562
 1288    HG2  GLU 182           HG2      GLU 182   3.991   8.664  10.695
 1289    HG3  GLU 182           HG3      GLU 182   4.995   9.765   9.753
 1290    H    GLN 183           H        GLN 183   5.607   8.570   5.565
 1291    HA   GLN 183           HA       GLN 183   7.571  10.482   6.521
 1292    HB2  GLN 183           HB2      GLN 183   7.704   8.722   4.091
 1293    HB3  GLN 183           HB3      GLN 183   9.042   9.534   4.881
 1294    HG2  GLN 183           HG2      GLN 183   8.859   8.104   6.786
 1295    HG3  GLN 183           HG3      GLN 183   7.381   7.375   6.149
 1296   HE21  GLN 183          HE21      GLN 183   8.227   5.308   6.074
 1297   HE22  GLN 183          HE22      GLN 183   9.444   4.862   4.932
 1298    H    GLY 184           H        GLY 184   5.045  10.304   4.255
 1299    HA2  GLY 184           HA2      GLY 184   4.270  11.923   2.780
 1300    HA3  GLY 184           HA3      GLY 184   5.736  12.852   3.068
 1301    H    VAL 185           H        VAL 185   6.097   9.507   2.297
 1302    HA   VAL 185           HA       VAL 185   7.672   9.999   0.032
 1303    HB   VAL 185           HB       VAL 185   7.752   7.664  -0.330
 1304   HG11  VAL 185          HG11      VAL 185   7.379   8.055   2.626
 1305   HG12  VAL 185          HG12      VAL 185   8.310   6.783   1.843
 1306   HG13  VAL 185          HG13      VAL 185   8.840   8.462   1.726
 1307   HG21  VAL 185          HG21      VAL 185   5.343   7.234  -0.350
 1308   HG22  VAL 185          HG22      VAL 185   6.212   6.068   0.648
 1309   HG23  VAL 185          HG23      VAL 185   5.307   7.377   1.408
 1310    H    GLU 186           H        GLU 186   7.348   9.330  -2.118
 1311    HA   GLU 186           HA       GLU 186   4.572   9.446  -3.073
 1312    HB2  GLU 186           HB2      GLU 186   5.891   9.978  -5.307
 1313    HB3  GLU 186           HB3      GLU 186   5.592  11.240  -4.128
 1314    HG2  GLU 186           HG2      GLU 186   7.913  11.130  -5.107
 1315    HG3  GLU 186           HG3      GLU 186   7.806  11.186  -3.348
 1316    H    GLU 187           H        GLU 187   5.047   8.332  -5.646
 1317    HA   GLU 187           HA       GLU 187   5.947   5.614  -4.950
 1318    HB2  GLU 187           HB2      GLU 187   3.607   6.471  -6.660
 1319    HB3  GLU 187           HB3      GLU 187   4.170   4.812  -6.517
 1320    HG2  GLU 187           HG2      GLU 187   3.550   4.695  -4.242
 1321    HG3  GLU 187           HG3      GLU 187   3.303   6.439  -4.147
 1322    H    HIS 188           H        HIS 188   7.437   7.865  -6.387
 1323    HA   HIS 188           HA       HIS 188   7.772   6.459  -8.948
 1324    HB2  HIS 188           HB2      HIS 188   7.866   8.610 -10.170
 1325    HB3  HIS 188           HB3      HIS 188   6.290   8.259  -9.477
 1326    HD1  HIS 188           HD1      HIS 188   5.332   9.941  -7.846
 1327    HD2  HIS 188           HD2      HIS 188   9.278  10.744  -8.875
 1328    HE1  HIS 188           HE1      HIS 188   5.780  12.279  -7.042
 1329    HE2  HIS 188           HE2      HIS 188   8.070  12.827  -7.926
 1330    H    GLU 189           H        GLU 189   9.341   7.977  -6.322
 1331    HA   GLU 189           HA       GLU 189  11.756   8.557  -7.820
 1332    HB2  GLU 189           HB2      GLU 189  11.095   8.707  -4.890
 1333    HB3  GLU 189           HB3      GLU 189  12.700   9.042  -5.524
 1334    HG2  GLU 189           HG2      GLU 189  10.166  10.507  -6.209
 1335    HG3  GLU 189           HG3      GLU 189  11.477  11.095  -5.184
 1336    H    THR 190           H        THR 190  13.859   7.629  -7.253
 1337    HA   THR 190           HA       THR 190  13.582   4.753  -7.133
 1338    HB   THR 190           HB       THR 190  16.061   6.407  -7.639
 1339    HG1  THR 190           HG1      THR 190  14.758   6.811  -9.347
 1340   HG21  THR 190          HG21      THR 190  16.948   4.340  -8.627
 1341   HG22  THR 190          HG22      THR 190  15.477   3.486  -8.159
 1342   HG23  THR 190          HG23      THR 190  16.562   4.118  -6.920
 1343    H    LEU 191           H        LEU 191  14.236   3.449  -5.592
 1344    HA   LEU 191           HA       LEU 191  15.398   4.655  -3.161
 1345    HB2  LEU 191           HB2      LEU 191  13.666   2.185  -3.216
 1346    HB3  LEU 191           HB3      LEU 191  14.166   3.107  -1.817
 1347    HG   LEU 191           HG       LEU 191  11.970   3.731  -1.993
 1348   HD11  LEU 191          HD11      LEU 191  13.349   5.722  -3.776
 1349   HD12  LEU 191          HD12      LEU 191  11.821   5.976  -2.930
 1350   HD13  LEU 191          HD13      LEU 191  13.310   5.745  -2.013
 1351   HD21  LEU 191          HD21      LEU 191  10.768   4.120  -4.090
 1352   HD22  LEU 191          HD22      LEU 191  12.230   3.723  -4.993
 1353   HD23  LEU 191          HD23      LEU 191  11.444   2.492  -4.003
 1354    H    LEU 192           H        LEU 192  17.087   3.467  -2.148
 1355    HA   LEU 192           HA       LEU 192  18.224   1.440  -3.956
 1356    HB2  LEU 192           HB2      LEU 192  19.882   2.988  -2.017
 1357    HB3  LEU 192           HB3      LEU 192  20.331   2.308  -3.569
 1358    HG   LEU 192           HG       LEU 192  18.556   4.728  -3.244
 1359   HD11  LEU 192          HD11      LEU 192  20.789   5.178  -2.380
 1360   HD12  LEU 192          HD12      LEU 192  21.494   4.593  -3.889
 1361   HD13  LEU 192          HD13      LEU 192  20.493   6.046  -3.887
 1362   HD21  LEU 192          HD21      LEU 192  18.252   3.491  -5.343
 1363   HD22  LEU 192          HD22      LEU 192  18.986   5.075  -5.611
 1364   HD23  LEU 192          HD23      LEU 192  19.982   3.619  -5.661
 1365    H    LEU 193           H        LEU 193  18.664  -0.530  -3.126
 1366    HA   LEU 193           HA       LEU 193  18.207  -1.045  -0.327
 1367    HB2  LEU 193           HB2      LEU 193  17.547  -2.603  -2.166
 1368    HB3  LEU 193           HB3      LEU 193  19.246  -2.877  -2.496
 1369    HG   LEU 193           HG       LEU 193  18.215  -3.442   0.253
 1370   HD11  LEU 193          HD11      LEU 193  17.891  -5.260  -2.130
 1371   HD12  LEU 193          HD12      LEU 193  17.599  -5.699  -0.447
 1372   HD13  LEU 193          HD13      LEU 193  16.585  -4.487  -1.231
 1373   HD21  LEU 193          HD21      LEU 193  20.610  -3.616  -0.219
 1374   HD22  LEU 193          HD22      LEU 193  19.911  -5.194   0.151
 1375   HD23  LEU 193          HD23      LEU 193  20.271  -4.759  -1.519
 1376    H    ARG 194           H        ARG 194  19.728  -0.963   1.215
 1377    HA   ARG 194           HA       ARG 194  22.540  -0.816   0.352
 1378    HB2  ARG 194           HB2      ARG 194  21.163   0.619   2.624
 1379    HB3  ARG 194           HB3      ARG 194  22.898   0.632   2.351
 1380    HG2  ARG 194           HG2      ARG 194  20.808   1.722   0.482
 1381    HG3  ARG 194           HG3      ARG 194  21.846   2.666   1.548
 1382    HD2  ARG 194           HD2      ARG 194  22.638   1.031  -0.848
 1383    HD3  ARG 194           HD3      ARG 194  22.814   2.775  -0.605
 1384    HE   ARG 194           HE       ARG 194  24.328   1.817   1.382
 1385   HH11  ARG 194          HH11      ARG 194  24.162   0.862  -1.995
 1386   HH12  ARG 194          HH12      ARG 194  25.846   0.417  -2.070
 1387   HH21  ARG 194          HH21      ARG 194  26.526   1.221   1.267
 1388   HH22  ARG 194          HH22      ARG 194  27.179   0.623  -0.228
 1389    H    ARG 195           H        ARG 195  23.967  -2.127   1.328
 1390    HA   ARG 195           HA       ARG 195  23.122  -4.097   3.203
 1391    HB2  ARG 195           HB2      ARG 195  24.996  -4.319   1.542
 1392    HB3  ARG 195           HB3      ARG 195  25.950  -3.243   2.545
 1393    HG2  ARG 195           HG2      ARG 195  24.905  -5.397   4.124
 1394    HG3  ARG 195           HG3      ARG 195  25.747  -6.031   2.709
 1395    HD2  ARG 195           HD2      ARG 195  27.367  -5.839   4.429
 1396    HD3  ARG 195           HD3      ARG 195  27.665  -4.506   3.313
 1397    HE   ARG 195           HE       ARG 195  26.129  -4.141   5.798
 1398   HH11  ARG 195          HH11      ARG 195  28.796  -3.289   3.684
 1399   HH12  ARG 195          HH12      ARG 195  29.180  -1.824   4.543
 1400   HH21  ARG 195          HH21      ARG 195  26.646  -2.203   6.937
 1401   HH22  ARG 195          HH22      ARG 195  27.949  -1.202   6.373
 1402    H    LYS 196           H        LYS 196  22.808  -3.791   5.311
 1403    HA   LYS 196           HA       LYS 196  23.895  -1.360   6.524
 1404    HB2  LYS 196           HB2      LYS 196  21.464  -1.727   6.706
 1405    HB3  LYS 196           HB3      LYS 196  21.760  -3.239   7.555
 1406    HG2  LYS 196           HG2      LYS 196  22.858  -2.010   9.360
 1407    HG3  LYS 196           HG3      LYS 196  22.550  -0.496   8.512
 1408    HD2  LYS 196           HD2      LYS 196  20.123  -0.961   8.651
 1409    HD3  LYS 196           HD3      LYS 196  20.486  -2.407   9.598
 1410    HE2  LYS 196           HE2      LYS 196  19.895  -0.601  11.087
 1411    HE3  LYS 196           HE3      LYS 196  21.606  -0.984  11.279
 1412    HZ1  LYS 196           HZ1      LYS 196  20.481   1.284   9.720
 1413    HZ2  LYS 196           HZ2      LYS 196  22.132   0.909   9.835
 1414    HZ3  LYS 196           HZ3      LYS 196  21.274   1.395  11.215
 1415    H    PHE 197           H        PHE 197  23.467  -4.813   7.358
 1416    HA   PHE 197           HA       PHE 197  25.433  -4.510   9.487
 1417    HB2  PHE 197           HB2      PHE 197  23.776  -6.892   8.650
 1418    HB3  PHE 197           HB3      PHE 197  24.901  -6.891   9.998
 1419    HD1  PHE 197           HD1      PHE 197  24.360  -4.263  11.198
 1420    HD2  PHE 197           HD2      PHE 197  21.679  -7.159   9.611
 1421    HE1  PHE 197           HE1      PHE 197  22.591  -3.425  12.680
 1422    HE2  PHE 197           HE2      PHE 197  19.896  -6.320  11.085
 1423    HZ   PHE 197           HZ       PHE 197  20.324  -4.465  12.599
 1424    H    PHE 198           H        PHE 198  27.339  -5.743   9.615
 1425    HA   PHE 198           HA       PHE 198  28.534  -6.048   6.987
 1426    HB2  PHE 198           HB2      PHE 198  29.696  -5.894   9.765
 1427    HB3  PHE 198           HB3      PHE 198  30.672  -6.257   8.347
 1428    HD1  PHE 198           HD1      PHE 198  30.860  -4.548   6.526
 1429    HD2  PHE 198           HD2      PHE 198  29.067  -3.705  10.291
 1430    HE1  PHE 198           HE1      PHE 198  31.114  -2.139   6.103
 1431    HE2  PHE 198           HE2      PHE 198  29.316  -1.297   9.877
 1432    HZ   PHE 198           HZ       PHE 198  30.388  -0.516   7.762
 1433    H    TYR 199           H        TYR 199  26.893  -8.102   7.142
 1434    HA   TYR 199           HA       TYR 199  27.886 -10.462   8.231
 1435    HB2  TYR 199           HB2      TYR 199  26.736 -11.648   6.358
 1436    HB3  TYR 199           HB3      TYR 199  25.720 -10.502   7.215
 1437    HD1  TYR 199           HD1      TYR 199  27.533 -11.136   4.062
 1438    HD2  TYR 199           HD2      TYR 199  24.762  -8.632   6.096
 1439    HE1  TYR 199           HE1      TYR 199  26.885 -10.121   1.919
 1440    HE2  TYR 199           HE2      TYR 199  24.112  -7.606   3.963
 1441    HH   TYR 199           HH       TYR 199  25.192  -8.897   0.906
 1442    H    SER 200           H        SER 200  28.837  -8.747   5.323
 1443    HA   SER 200           HA       SER 200  30.753  -8.751   4.129
 1444    HB2  SER 200           HB2      SER 200  31.924 -10.122   6.549
 1445    HB3  SER 200           HB3      SER 200  32.797  -9.173   5.346
 1446    HG   SER 200           HG       SER 200  31.045  -8.323   7.374
 1447    H    ASP 201           H        ASP 201  29.011 -11.031   3.803
 1448    HA   ASP 201           HA       ASP 201  28.915 -12.950   2.596
 1449    HB2  ASP 201           HB2      ASP 201  30.447 -11.634   1.128
 1450    HB3  ASP 201           HB3      ASP 201  31.810 -12.358   1.962
 1451    H    GLN 202           H        GLN 202  30.106 -12.795   5.430
 1452    HA   GLN 202           HA       GLN 202  31.921 -14.991   5.647
 1453    HB2  GLN 202           HB2      GLN 202  31.948 -13.147   7.252
 1454    HB3  GLN 202           HB3      GLN 202  30.311 -13.538   7.752
 1455    HG2  GLN 202           HG2      GLN 202  31.072 -15.669   8.636
 1456    HG3  GLN 202           HG3      GLN 202  32.713 -15.318   8.093
 1457   HE21  GLN 202          HE21      GLN 202  31.651 -15.821  10.786
 1458   HE22  GLN 202          HE22      GLN 202  32.091 -14.435  11.732
  Start of MODEL    2
    1    H1   GLY  -5           H1       GLY  -5 -25.412 -13.957  -2.602
    2    H2   GLY  -5           H2       GLY  -5 -26.790 -13.628  -1.670
    3    H3   GLY  -5           H3       GLY  -5 -25.645 -12.409  -1.945
    4    HA2  GLY  -5           HA2      GLY  -5 -26.147 -12.479  -4.331
    5    HA3  GLY  -5           HA3      GLY  -5 -27.387 -13.680  -3.988
    6    H    ILE  -4           H        ILE  -4 -29.120 -13.031  -2.492
    7    HA   ILE  -4           HA       ILE  -4 -29.860 -10.248  -2.939
    8    HB   ILE  -4           HB       ILE  -4 -32.041 -10.898  -1.888
    9   HG12  ILE  -4          HG12      ILE  -4 -30.891 -13.696  -2.022
   10   HG13  ILE  -4          HG13      ILE  -4 -31.175 -12.790  -0.540
   11   HG21  ILE  -4          HG21      ILE  -4 -31.763 -10.874  -4.298
   12   HG22  ILE  -4          HG22      ILE  -4 -31.158 -12.530  -4.263
   13   HG23  ILE  -4          HG23      ILE  -4 -32.828 -12.194  -3.812
   14   HD11  ILE  -4          HD11      ILE  -4 -32.934 -14.413  -0.933
   15   HD12  ILE  -4          HD12      ILE  -4 -33.569 -12.769  -1.014
   16   HD13  ILE  -4          HD13      ILE  -4 -33.282 -13.677  -2.498
   17    H    ASP  -3           H        ASP  -3 -27.740 -10.325  -1.411
   18    HA   ASP  -3           HA       ASP  -3 -28.070 -10.602   1.355
   19    HB2  ASP  -3           HB2      ASP  -3 -26.161  -8.878  -0.238
   20    HB3  ASP  -3           HB3      ASP  -3 -26.061  -9.086   1.507
   21    HA   PRO  -2           HA       PRO  -2 -30.827  -7.249   2.022
   22    HB2  PRO  -2           HB2      PRO  -2 -30.901  -7.347   4.724
   23    HB3  PRO  -2           HB3      PRO  -2 -31.696  -8.551   3.703
   24    HG2  PRO  -2           HG2      PRO  -2 -29.078  -8.712   5.138
   25    HG3  PRO  -2           HG3      PRO  -2 -30.338  -9.947   4.966
   26    HD2  PRO  -2           HD2      PRO  -2 -28.066  -9.904   3.460
   27    HD3  PRO  -2           HD3      PRO  -2 -29.602 -10.584   2.887
   28    H    PHE  -1           H        PHE  -1 -30.368  -5.167   1.876
   29    HA   PHE  -1           HA       PHE  -1 -28.484  -4.015   3.793
   30    HB2  PHE  -1           HB2      PHE  -1 -28.715  -3.472   0.838
   31    HB3  PHE  -1           HB3      PHE  -1 -27.999  -2.309   1.944
   32    HD1  PHE  -1           HD1      PHE  -1 -25.910  -2.798   3.081
   33    HD2  PHE  -1           HD2      PHE  -1 -27.582  -5.500   0.260
   34    HE1  PHE  -1           HE1      PHE  -1 -23.748  -3.974   2.934
   35    HE2  PHE  -1           HE2      PHE  -1 -25.431  -6.685   0.106
   36    HZ   PHE  -1           HZ       PHE  -1 -23.510  -5.921   1.446
   37    H    THR   0           H        THR   0 -30.278  -3.587   5.075
   38    HA   THR   0           HA       THR   0 -32.351  -1.829   4.138
   39    HB   THR   0           HB       THR   0 -32.929  -1.837   6.650
   40    HG1  THR   0           HG1      THR   0 -31.863  -3.377   7.882
   41   HG21  THR   0          HG21      THR   0 -33.893  -4.097   6.511
   42   HG22  THR   0          HG22      THR   0 -32.865  -4.444   5.120
   43   HG23  THR   0          HG23      THR   0 -34.115  -3.206   5.004
   44    H    MET   1           H        MET   1 -32.131  -0.520   6.986
   45    HA   MET   1           HA       MET   1 -30.531   1.692   6.025
   46    HB2  MET   1           HB2      MET   1 -32.808   1.948   7.157
   47    HB3  MET   1           HB3      MET   1 -31.978   1.576   8.661
   48    HG2  MET   1           HG2      MET   1 -32.201   3.942   8.474
   49    HG3  MET   1           HG3      MET   1 -30.502   3.524   8.279
   50    HE1  MET   1           HE1      MET   1 -29.644   2.984   5.518
   51    HE2  MET   1           HE2      MET   1 -29.609   4.566   4.745
   52    HE3  MET   1           HE3      MET   1 -29.064   4.387   6.412
   53    H    VAL   2           H        VAL   2 -29.270  -0.673   6.595
   54    HA   VAL   2           HA       VAL   2 -27.297   0.255   8.541
   55    HB   VAL   2           HB       VAL   2 -26.759  -2.110   9.105
   56   HG11  VAL   2          HG11      VAL   2 -28.156  -0.811  10.606
   57   HG12  VAL   2          HG12      VAL   2 -29.596  -1.293   9.709
   58   HG13  VAL   2          HG13      VAL   2 -28.665  -2.500  10.595
   59   HG21  VAL   2          HG21      VAL   2 -27.673  -3.195   7.126
   60   HG22  VAL   2          HG22      VAL   2 -28.360  -3.884   8.597
   61   HG23  VAL   2          HG23      VAL   2 -29.307  -2.755   7.626
   62    H    ALA   3           H        ALA   3 -27.058   1.103   6.181
   63    HA   ALA   3           HA       ALA   3 -25.006  -0.492   4.894
   64    HB1  ALA   3           HB1      ALA   3 -25.994  -0.069   2.661
   65    HB2  ALA   3           HB2      ALA   3 -27.011  -1.106   3.665
   66    HB3  ALA   3           HB3      ALA   3 -27.427   0.594   3.446
   67    H    LEU   4           H        LEU   4 -23.496   0.722   3.932
   68    HA   LEU   4           HA       LEU   4 -23.760   3.630   4.308
   69    HB2  LEU   4           HB2      LEU   4 -21.261   1.947   4.347
   70    HB3  LEU   4           HB3      LEU   4 -21.328   3.680   4.605
   71    HG   LEU   4           HG       LEU   4 -22.394   1.514   6.416
   72   HD11  LEU   4          HD11      LEU   4 -19.976   1.912   6.500
   73   HD12  LEU   4          HD12      LEU   4 -20.276   3.615   6.851
   74   HD13  LEU   4          HD13      LEU   4 -20.782   2.369   8.000
   75   HD21  LEU   4          HD21      LEU   4 -23.958   3.388   6.386
   76   HD22  LEU   4          HD22      LEU   4 -23.098   3.294   7.924
   77   HD23  LEU   4          HD23      LEU   4 -22.636   4.505   6.726
   78    H    SER   5           H        SER   5 -23.355   4.899   2.588
   79    HA   SER   5           HA       SER   5 -23.145   3.512   0.028
   80    HB2  SER   5           HB2      SER   5 -23.883   6.383   0.655
   81    HB3  SER   5           HB3      SER   5 -23.837   5.685  -0.958
   82    HG   SER   5           HG       SER   5 -25.593   5.126   1.175
   83    H    LEU   6           H        LEU   6 -21.111   3.159  -0.563
   84    HA   LEU   6           HA       LEU   6 -19.132   5.265  -0.002
   85    HB2  LEU   6           HB2      LEU   6 -18.610   2.313  -0.371
   86    HB3  LEU   6           HB3      LEU   6 -17.445   3.537   0.108
   87    HG   LEU   6           HG       LEU   6 -19.778   2.536   1.743
   88   HD11  LEU   6          HD11      LEU   6 -17.887   0.999   1.633
   89   HD12  LEU   6          HD12      LEU   6 -16.802   2.291   2.148
   90   HD13  LEU   6          HD13      LEU   6 -18.051   1.700   3.242
   91   HD21  LEU   6          HD21      LEU   6 -17.744   4.666   2.388
   92   HD22  LEU   6          HD22      LEU   6 -19.473   4.909   2.122
   93   HD23  LEU   6          HD23      LEU   6 -18.916   3.987   3.519
   94    H    LYS   7           H        LYS   7 -18.028   6.099  -1.677
   95    HA   LYS   7           HA       LYS   7 -18.604   5.084  -4.335
   96    HB2  LYS   7           HB2      LYS   7 -16.975   7.439  -3.400
   97    HB3  LYS   7           HB3      LYS   7 -17.117   6.966  -5.089
   98    HG2  LYS   7           HG2      LYS   7 -19.710   7.096  -4.444
   99    HG3  LYS   7           HG3      LYS   7 -19.056   8.292  -3.318
  100    HD2  LYS   7           HD2      LYS   7 -19.532   9.512  -5.239
  101    HD3  LYS   7           HD3      LYS   7 -17.798   9.227  -5.338
  102    HE2  LYS   7           HE2      LYS   7 -18.742   8.845  -7.497
  103    HE3  LYS   7           HE3      LYS   7 -18.285   7.284  -6.814
  104    HZ1  LYS   7           HZ1      LYS   7 -20.516   6.762  -6.371
  105    HZ2  LYS   7           HZ2      LYS   7 -20.531   7.425  -7.930
  106    HZ3  LYS   7           HZ3      LYS   7 -21.037   8.355  -6.603
  107    H    ILE   8           H        ILE   8 -17.426   3.665  -5.309
  108    HA   ILE   8           HA       ILE   8 -14.836   2.971  -4.102
  109    HB   ILE   8           HB       ILE   8 -16.515   1.280  -5.965
  110   HG12  ILE   8          HG12      ILE   8 -17.705   1.622  -3.853
  111   HG13  ILE   8          HG13      ILE   8 -17.102  -0.027  -3.953
  112   HG21  ILE   8          HG21      ILE   8 -14.116   0.626  -4.259
  113   HG22  ILE   8          HG22      ILE   8 -15.044  -0.531  -5.211
  114   HG23  ILE   8          HG23      ILE   8 -14.146   0.754  -6.017
  115   HD11  ILE   8          HD11      ILE   8 -16.811   0.889  -1.726
  116   HD12  ILE   8          HD12      ILE   8 -15.251   0.561  -2.480
  117   HD13  ILE   8          HD13      ILE   8 -15.852   2.216  -2.384
  118    H    SER   9           H        SER   9 -13.363   4.206  -5.127
  119    HA   SER   9           HA       SER   9 -13.484   4.378  -8.039
  120    HB2  SER   9           HB2      SER   9 -11.710   5.831  -6.072
  121    HB3  SER   9           HB3      SER   9 -11.688   6.076  -7.812
  122    HG   SER   9           HG       SER   9 -13.014   7.559  -6.451
  123    H    ILE  10           H        ILE  10 -12.796   2.502  -8.807
  124    HA   ILE  10           HA       ILE  10 -10.496   1.142  -7.685
  125    HB   ILE  10           HB       ILE  10 -12.073   0.370 -10.145
  126   HG12  ILE  10          HG12      ILE  10 -12.577  -0.606  -7.331
  127   HG13  ILE  10          HG13      ILE  10 -13.470   0.736  -8.040
  128   HG21  ILE  10          HG21      ILE  10  -9.941  -0.783  -9.864
  129   HG22  ILE  10          HG22      ILE  10 -10.395  -1.245  -8.224
  130   HG23  ILE  10          HG23      ILE  10 -11.289  -1.891  -9.602
  131   HD11  ILE  10          HD11      ILE  10 -14.321  -0.722  -9.777
  132   HD12  ILE  10          HD12      ILE  10 -13.384  -2.066  -9.127
  133   HD13  ILE  10          HD13      ILE  10 -14.696  -1.367  -8.179
  134    H    GLY  11           H        GLY  11  -9.058   2.957  -8.190
  135    HA2  GLY  11           HA2      GLY  11  -7.231   3.661  -9.421
  136    HA3  GLY  11           HA3      GLY  11  -7.693   2.534 -10.689
  137    H    ASN  12           H        ASN  12  -9.039   3.208 -12.345
  138    HA   ASN  12           HA       ASN  12  -9.274   6.129 -12.590
  139    HB2  ASN  12           HB2      ASN  12  -9.483   4.050 -14.779
  140    HB3  ASN  12           HB3      ASN  12  -9.356   5.793 -14.985
  141   HD21  ASN  12          HD21      ASN  12  -7.672   2.860 -14.280
  142   HD22  ASN  12          HD22      ASN  12  -6.073   3.509 -14.401
  143    H    VAL  13           H        VAL  13 -11.066   3.154 -12.624
  144    HA   VAL  13           HA       VAL  13 -13.550   4.416 -13.436
  145    HB   VAL  13           HB       VAL  13 -12.998   2.124 -14.196
  146   HG11  VAL  13          HG11      VAL  13 -11.764   1.348 -12.263
  147   HG12  VAL  13          HG12      VAL  13 -13.235   1.372 -11.291
  148   HG13  VAL  13          HG13      VAL  13 -13.087   0.244 -12.638
  149   HG21  VAL  13          HG21      VAL  13 -15.412   2.241 -12.396
  150   HG22  VAL  13          HG22      VAL  13 -15.339   2.726 -14.090
  151   HG23  VAL  13          HG23      VAL  13 -15.128   1.030 -13.646
  152    H    VAL  14           H        VAL  14 -15.461   4.381 -12.033
  153    HA   VAL  14           HA       VAL  14 -14.956   3.866  -9.217
  154    HB   VAL  14           HB       VAL  14 -14.452   6.181  -9.188
  155   HG11  VAL  14          HG11      VAL  14 -16.992   6.680 -10.719
  156   HG12  VAL  14          HG12      VAL  14 -15.892   7.910 -10.094
  157   HG13  VAL  14          HG13      VAL  14 -15.350   6.804 -11.355
  158   HG21  VAL  14          HG21      VAL  14 -17.313   5.805  -8.306
  159   HG22  VAL  14          HG22      VAL  14 -15.867   5.496  -7.347
  160   HG23  VAL  14          HG23      VAL  14 -16.277   7.147  -7.820
  161    H    LYS  15           H        LYS  15 -16.542   2.888  -8.282
  162    HA   LYS  15           HA       LYS  15 -19.175   2.843  -9.588
  163    HB2  LYS  15           HB2      LYS  15 -17.614   0.529  -8.433
  164    HB3  LYS  15           HB3      LYS  15 -19.334   0.447  -8.783
  165    HG2  LYS  15           HG2      LYS  15 -17.108   0.894 -10.759
  166    HG3  LYS  15           HG3      LYS  15 -18.103  -0.554 -10.583
  167    HD2  LYS  15           HD2      LYS  15 -20.101   0.856 -11.128
  168    HD3  LYS  15           HD3      LYS  15 -18.996   2.181 -11.495
  169    HE2  LYS  15           HE2      LYS  15 -19.496   1.165 -13.563
  170    HE3  LYS  15           HE3      LYS  15 -17.875   0.616 -13.135
  171    HZ1  LYS  15           HZ1      LYS  15 -19.420  -1.292 -12.040
  172    HZ2  LYS  15           HZ2      LYS  15 -18.704  -1.398 -13.573
  173    HZ3  LYS  15           HZ3      LYS  15 -20.320  -0.897 -13.425
  174    H    THR  16           H        THR  16 -20.945   2.592  -8.189
  175    HA   THR  16           HA       THR  16 -20.329   3.512  -5.465
  176    HB   THR  16           HB       THR  16 -22.980   3.614  -6.917
  177    HG1  THR  16           HG1      THR  16 -22.395   5.534  -7.623
  178   HG21  THR  16          HG21      THR  16 -23.622   5.155  -5.109
  179   HG22  THR  16          HG22      THR  16 -22.064   4.878  -4.330
  180   HG23  THR  16          HG23      THR  16 -23.218   3.555  -4.488
  181    H    MET  17           H        MET  17 -20.522   2.108  -3.838
  182    HA   MET  17           HA       MET  17 -22.343  -0.155  -4.136
  183    HB2  MET  17           HB2      MET  17 -19.434  -0.293  -4.060
  184    HB3  MET  17           HB3      MET  17 -20.162  -1.195  -2.739
  185    HG2  MET  17           HG2      MET  17 -21.131  -1.556  -5.540
  186    HG3  MET  17           HG3      MET  17 -19.680  -2.379  -4.979
  187    HE1  MET  17           HE1      MET  17 -20.335  -3.060  -1.944
  188    HE2  MET  17           HE2      MET  17 -21.041  -4.668  -2.117
  189    HE3  MET  17           HE3      MET  17 -19.640  -4.208  -3.086
  190    H    GLN  18           H        GLN  18 -23.179  -0.901  -2.195
  191    HA   GLN  18           HA       GLN  18 -22.550   0.797   0.117
  192    HB2  GLN  18           HB2      GLN  18 -25.114  -0.520  -0.740
  193    HB3  GLN  18           HB3      GLN  18 -24.868   0.069   0.902
  194    HG2  GLN  18           HG2      GLN  18 -24.850   2.258   0.271
  195    HG3  GLN  18           HG3      GLN  18 -24.282   1.897  -1.359
  196   HE21  GLN  18          HE21      GLN  18 -25.825   3.108  -2.357
  197   HE22  GLN  18          HE22      GLN  18 -27.484   2.651  -2.414
  198    H    PHE  19           H        PHE  19 -22.181  -0.128   2.093
  199    HA   PHE  19           HA       PHE  19 -21.973  -3.051   2.174
  200    HB2  PHE  19           HB2      PHE  19 -19.909  -1.081   3.213
  201    HB3  PHE  19           HB3      PHE  19 -19.846  -2.828   3.403
  202    HD1  PHE  19           HD1      PHE  19 -19.443  -0.034   1.083
  203    HD2  PHE  19           HD2      PHE  19 -19.181  -4.249   1.577
  204    HE1  PHE  19           HE1      PHE  19 -18.203  -0.202  -1.037
  205    HE2  PHE  19           HE2      PHE  19 -17.938  -4.428  -0.538
  206    HZ   PHE  19           HZ       PHE  19 -17.372  -2.398  -1.804
  207    H    GLU  20           H        GLU  20 -22.023  -3.830   4.434
  208    HA   GLU  20           HA       GLU  20 -23.838  -2.303   6.045
  209    HB2  GLU  20           HB2      GLU  20 -22.247  -4.725   6.905
  210    HB3  GLU  20           HB3      GLU  20 -23.750  -4.123   7.591
  211    HG2  GLU  20           HG2      GLU  20 -24.924  -4.695   5.524
  212    HG3  GLU  20           HG3      GLU  20 -23.418  -5.311   4.846
  213    HA   PRO  21           HA       PRO  21 -20.910   0.020   8.373
  214    HB2  PRO  21           HB2      PRO  21 -22.450  -0.360  10.817
  215    HB3  PRO  21           HB3      PRO  21 -22.224   1.104   9.871
  216    HG2  PRO  21           HG2      PRO  21 -24.584  -0.260  10.032
  217    HG3  PRO  21           HG3      PRO  21 -24.131   0.754   8.653
  218    HD2  PRO  21           HD2      PRO  21 -24.118  -2.205   8.913
  219    HD3  PRO  21           HD3      PRO  21 -24.422  -1.190   7.494
  220    H    SER  22           H        SER  22 -21.943  -3.116   9.365
  221    HA   SER  22           HA       SER  22 -19.633  -3.475  11.113
  222    HB2  SER  22           HB2      SER  22 -20.887  -5.781  11.384
  223    HB3  SER  22           HB3      SER  22 -21.484  -4.328  12.191
  224    HG   SER  22           HG       SER  22 -22.781  -5.850  10.470
  225    H    THR  23           H        THR  23 -19.943  -3.503   7.966
  226    HA   THR  23           HA       THR  23 -18.906  -6.040   7.227
  227    HB   THR  23           HB       THR  23 -19.054  -3.426   5.732
  228    HG1  THR  23           HG1      THR  23 -20.556  -5.842   5.657
  229   HG21  THR  23          HG21      THR  23 -18.229  -6.124   4.689
  230   HG22  THR  23          HG22      THR  23 -17.171  -4.729   4.902
  231   HG23  THR  23          HG23      THR  23 -18.480  -4.670   3.722
  232    H    MET  24           H        MET  24 -17.049  -6.595   7.945
  233    HA   MET  24           HA       MET  24 -14.826  -4.957   8.488
  234    HB2  MET  24           HB2      MET  24 -15.412  -7.704   8.617
  235    HB3  MET  24           HB3      MET  24 -14.028  -7.563   7.550
  236    HG2  MET  24           HG2      MET  24 -13.154  -7.878   9.686
  237    HG3  MET  24           HG3      MET  24 -12.945  -6.163   9.334
  238    HE1  MET  24           HE1      MET  24 -12.831  -7.494  12.324
  239    HE2  MET  24           HE2      MET  24 -12.483  -5.809  11.929
  240    HE3  MET  24           HE3      MET  24 -13.645  -6.195  13.200
  241    H    VAL  25           H        VAL  25 -13.002  -4.505   7.249
  242    HA   VAL  25           HA       VAL  25 -13.019  -4.106   4.572
  243    HB   VAL  25           HB       VAL  25 -10.784  -4.804   6.426
  244   HG11  VAL  25          HG11      VAL  25 -10.118  -5.782   4.265
  245   HG12  VAL  25          HG12      VAL  25 -10.420  -4.228   3.485
  246   HG13  VAL  25          HG13      VAL  25  -9.138  -4.377   4.691
  247   HG21  VAL  25          HG21      VAL  25 -11.800  -2.610   6.533
  248   HG22  VAL  25          HG22      VAL  25 -10.147  -2.497   5.927
  249   HG23  VAL  25          HG23      VAL  25 -11.507  -2.374   4.811
  250    H    TYR  26           H        TYR  26 -12.347  -7.203   6.170
  251    HA   TYR  26           HA       TYR  26 -11.710  -8.507   3.740
  252    HB2  TYR  26           HB2      TYR  26 -11.654 -10.579   4.887
  253    HB3  TYR  26           HB3      TYR  26 -10.979  -9.368   5.959
  254    HD1  TYR  26           HD1      TYR  26 -14.090 -11.288   5.280
  255    HD2  TYR  26           HD2      TYR  26 -11.781  -9.171   8.156
  256    HE1  TYR  26           HE1      TYR  26 -15.655 -11.984   7.043
  257    HE2  TYR  26           HE2      TYR  26 -13.332  -9.871   9.928
  258    HH   TYR  26           HH       TYR  26 -15.788 -12.252   9.390
  259    H    ASP  27           H        ASP  27 -14.742  -7.823   5.313
  260    HA   ASP  27           HA       ASP  27 -16.254  -9.658   3.701
  261    HB2  ASP  27           HB2      ASP  27 -17.068  -7.315   5.419
  262    HB3  ASP  27           HB3      ASP  27 -18.225  -8.231   4.463
  263    H    ALA  28           H        ALA  28 -15.631  -6.182   3.693
  264    HA   ALA  28           HA       ALA  28 -17.145  -5.438   1.512
  265    HB1  ALA  28           HB1      ALA  28 -14.445  -4.349   2.302
  266    HB2  ALA  28           HB2      ALA  28 -15.638  -3.537   1.288
  267    HB3  ALA  28           HB3      ALA  28 -15.996  -3.856   2.984
  268    H    CYS  29           H        CYS  29 -13.775  -6.539   1.554
  269    HA   CYS  29           HA       CYS  29 -13.240  -6.299  -1.154
  270    HB2  CYS  29           HB2      CYS  29 -11.505  -6.722   0.524
  271    HB3  CYS  29           HB3      CYS  29 -12.123  -8.353   0.761
  272    HG   CYS  29           HG       CYS  29  -9.683  -7.716  -1.022
  273    H    ARG  30           H        ARG  30 -14.900  -8.964   0.516
  274    HA   ARG  30           HA       ARG  30 -14.681 -10.634  -1.820
  275    HB2  ARG  30           HB2      ARG  30 -16.154 -12.224  -0.607
  276    HB3  ARG  30           HB3      ARG  30 -14.665 -11.819   0.226
  277    HG2  ARG  30           HG2      ARG  30 -15.778 -10.545   1.835
  278    HG3  ARG  30           HG3      ARG  30 -17.262 -10.445   0.875
  279    HD2  ARG  30           HD2      ARG  30 -17.647 -12.813   1.175
  280    HD3  ARG  30           HD3      ARG  30 -16.101 -12.997   2.001
  281    HE   ARG  30           HE       ARG  30 -17.190 -11.348   3.661
  282   HH11  ARG  30          HH11      ARG  30 -18.878 -13.859   1.902
  283   HH12  ARG  30          HH12      ARG  30 -20.040 -14.135   3.166
  284   HH21  ARG  30          HH21      ARG  30 -18.675 -11.707   5.325
  285   HH22  ARG  30          HH22      ARG  30 -19.901 -12.937   5.140
  286    H    MET  31           H        MET  31 -17.169  -8.594  -0.402
  287    HA   MET  31           HA       MET  31 -19.182  -9.519  -2.225
  288    HB2  MET  31           HB2      MET  31 -19.198  -7.044  -0.497
  289    HB3  MET  31           HB3      MET  31 -20.583  -7.807  -1.261
  290    HG2  MET  31           HG2      MET  31 -20.355  -9.754   0.111
  291    HG3  MET  31           HG3      MET  31 -18.854  -9.146   0.797
  292    HE1  MET  31           HE1      MET  31 -19.565  -6.055   1.112
  293    HE2  MET  31           HE2      MET  31 -19.978  -6.084   2.830
  294    HE3  MET  31           HE3      MET  31 -18.641  -7.070   2.225
  295    H    ILE  32           H        ILE  32 -16.948  -6.782  -2.110
  296    HA   ILE  32           HA       ILE  32 -18.158  -5.325  -4.205
  297    HB   ILE  32           HB       ILE  32 -16.501  -4.291  -2.719
  298   HG12  ILE  32          HG12      ILE  32 -15.757  -4.316  -5.650
  299   HG13  ILE  32          HG13      ILE  32 -16.923  -3.252  -4.869
  300   HG21  ILE  32          HG21      ILE  32 -14.454  -5.974  -4.160
  301   HG22  ILE  32          HG22      ILE  32 -14.115  -4.704  -2.982
  302   HG23  ILE  32          HG23      ILE  32 -14.958  -6.172  -2.481
  303   HD11  ILE  32          HD11      ILE  32 -15.156  -2.188  -3.620
  304   HD12  ILE  32          HD12      ILE  32 -13.972  -3.301  -4.308
  305   HD13  ILE  32          HD13      ILE  32 -14.801  -2.143  -5.347
  306    H    ARG  33           H        ARG  33 -15.538  -7.703  -4.207
  307    HA   ARG  33           HA       ARG  33 -15.111  -7.802  -6.973
  308    HB2  ARG  33           HB2      ARG  33 -14.711  -9.871  -4.815
  309    HB3  ARG  33           HB3      ARG  33 -14.224 -10.129  -6.486
  310    HG2  ARG  33           HG2      ARG  33 -12.756  -8.162  -6.341
  311    HG3  ARG  33           HG3      ARG  33 -13.219  -7.964  -4.650
  312    HD2  ARG  33           HD2      ARG  33 -11.975 -10.477  -5.745
  313    HD3  ARG  33           HD3      ARG  33 -11.035  -9.155  -5.059
  314    HE   ARG  33           HE       ARG  33 -12.267  -9.559  -2.956
  315   HH11  ARG  33          HH11      ARG  33 -12.178 -12.105  -5.360
  316   HH12  ARG  33          HH12      ARG  33 -12.332 -13.384  -4.185
  317   HH21  ARG  33          HH21      ARG  33 -12.453 -11.256  -1.405
  318   HH22  ARG  33          HH22      ARG  33 -12.490 -12.903  -1.965
  319    H    GLU  34           H        GLU  34 -17.626  -9.105  -5.017
  320    HA   GLU  34           HA       GLU  34 -18.399 -11.312  -6.591
  321    HB2  GLU  34           HB2      GLU  34 -19.086 -10.934  -4.238
  322    HB3  GLU  34           HB3      GLU  34 -20.097  -9.598  -4.765
  323    HG2  GLU  34           HG2      GLU  34 -21.534 -11.421  -4.449
  324    HG3  GLU  34           HG3      GLU  34 -21.340 -11.259  -6.193
  325    H    ARG  35           H        ARG  35 -20.039  -8.132  -6.309
  326    HA   ARG  35           HA       ARG  35 -21.412  -8.670  -8.794
  327    HB2  ARG  35           HB2      ARG  35 -22.535  -6.466  -8.413
  328    HB3  ARG  35           HB3      ARG  35 -22.799  -7.672  -7.168
  329    HG2  ARG  35           HG2      ARG  35 -20.576  -5.778  -6.737
  330    HG3  ARG  35           HG3      ARG  35 -22.217  -5.131  -6.639
  331    HD2  ARG  35           HD2      ARG  35 -21.005  -7.365  -5.026
  332    HD3  ARG  35           HD3      ARG  35 -21.571  -5.802  -4.446
  333    HE   ARG  35           HE       ARG  35 -23.334  -7.956  -5.449
  334   HH11  ARG  35          HH11      ARG  35 -22.783  -5.119  -3.484
  335   HH12  ARG  35          HH12      ARG  35 -24.269  -5.269  -2.601
  336   HH21  ARG  35          HH21      ARG  35 -25.288  -8.172  -4.325
  337   HH22  ARG  35          HH22      ARG  35 -25.718  -7.024  -3.084
  338    H    ILE  36           H        ILE  36 -18.693  -6.740  -7.772
  339    HA   ILE  36           HA       ILE  36 -18.675  -5.375 -10.376
  340    HB   ILE  36           HB       ILE  36 -16.917  -4.768  -7.990
  341   HG12  ILE  36          HG12      ILE  36 -19.488  -3.421  -8.856
  342   HG13  ILE  36          HG13      ILE  36 -19.279  -4.402  -7.408
  343   HG21  ILE  36          HG21      ILE  36 -16.568  -2.623  -9.142
  344   HG22  ILE  36          HG22      ILE  36 -16.015  -3.994 -10.104
  345   HG23  ILE  36          HG23      ILE  36 -17.543  -3.203 -10.491
  346   HD11  ILE  36          HD11      ILE  36 -17.695  -2.766  -6.529
  347   HD12  ILE  36          HD12      ILE  36 -17.903  -1.785  -7.981
  348   HD13  ILE  36          HD13      ILE  36 -19.260  -2.032  -6.882
  349    HA   PRO  37           HA       PRO  37 -15.471  -8.521 -11.133
  350    HB2  PRO  37           HB2      PRO  37 -16.107  -8.264 -13.934
  351    HB3  PRO  37           HB3      PRO  37 -16.414  -9.627 -12.857
  352    HG2  PRO  37           HG2      PRO  37 -18.386  -8.066 -13.937
  353    HG3  PRO  37           HG3      PRO  37 -18.554  -8.955 -12.412
  354    HD2  PRO  37           HD2      PRO  37 -17.929  -6.057 -12.860
  355    HD3  PRO  37           HD3      PRO  37 -19.003  -6.807 -11.655
  356    H    GLU  38           H        GLU  38 -15.723  -5.290 -11.912
  357    HA   GLU  38           HA       GLU  38 -13.159  -5.253 -13.337
  358    HB2  GLU  38           HB2      GLU  38 -13.682  -2.886 -13.808
  359    HB3  GLU  38           HB3      GLU  38 -14.899  -3.991 -14.430
  360    HG2  GLU  38           HG2      GLU  38 -16.179  -3.497 -12.277
  361    HG3  GLU  38           HG3      GLU  38 -15.073  -2.137 -12.091
  362    H    ALA  39           H        ALA  39 -14.047  -5.473 -10.323
  363    HA   ALA  39           HA       ALA  39 -12.518  -3.359  -9.110
  364    HB1  ALA  39           HB1      ALA  39 -14.435  -4.363  -7.950
  365    HB2  ALA  39           HB2      ALA  39 -13.588  -5.909  -7.899
  366    HB3  ALA  39           HB3      ALA  39 -12.950  -4.523  -7.011
  367    H    LEU  40           H        LEU  40 -12.068  -6.802  -9.773
  368    HA   LEU  40           HA       LEU  40  -9.426  -6.718  -8.613
  369    HB2  LEU  40           HB2      LEU  40  -9.407  -9.191  -9.450
  370    HB3  LEU  40           HB3      LEU  40 -10.292  -8.735  -8.016
  371    HG   LEU  40           HG       LEU  40 -11.439 -10.377  -9.534
  372   HD11  LEU  40          HD11      LEU  40 -12.702  -9.125  -7.887
  373   HD12  LEU  40          HD12      LEU  40 -12.890  -7.789  -9.023
  374   HD13  LEU  40          HD13      LEU  40 -13.644  -9.347  -9.361
  375   HD21  LEU  40          HD21      LEU  40 -10.858  -9.510 -11.681
  376   HD22  LEU  40          HD22      LEU  40 -12.612  -9.434 -11.503
  377   HD23  LEU  40          HD23      LEU  40 -11.639  -7.971 -11.320
  378    H    ALA  41           H        ALA  41  -8.765  -5.084 -10.202
  379    HA   ALA  41           HA       ALA  41  -8.271  -5.903 -12.900
  380    HB1  ALA  41           HB1      ALA  41  -7.064  -3.781 -13.092
  381    HB2  ALA  41           HB2      ALA  41  -8.644  -3.561 -12.338
  382    HB3  ALA  41           HB3      ALA  41  -7.185  -3.556 -11.347
  383    H    GLY  42           H        GLY  42  -7.272  -7.751 -11.095
  384    HA2  GLY  42           HA2      GLY  42  -4.797  -8.481 -11.955
  385    HA3  GLY  42           HA3      GLY  42  -4.475  -7.418 -10.584
  386    HA   PRO  43           HA       PRO  43  -5.324 -11.476  -8.599
  387    HB2  PRO  43           HB2      PRO  43  -3.296 -10.739  -6.681
  388    HB3  PRO  43           HB3      PRO  43  -3.296 -12.086  -7.818
  389    HG2  PRO  43           HG2      PRO  43  -1.610  -9.929  -7.997
  390    HG3  PRO  43           HG3      PRO  43  -2.078 -10.945  -9.370
  391    HD2  PRO  43           HD2      PRO  43  -3.089  -8.255  -8.565
  392    HD3  PRO  43           HD3      PRO  43  -2.814  -8.921 -10.189
  393    HA   PRO  44           HA       PRO  44  -8.105  -9.103  -5.998
  394    HB2  PRO  44           HB2      PRO  44  -9.129 -11.350  -4.721
  395    HB3  PRO  44           HB3      PRO  44  -9.737 -10.661  -6.229
  396    HG2  PRO  44           HG2      PRO  44  -7.884 -12.963  -5.805
  397    HG3  PRO  44           HG3      PRO  44  -9.187 -12.771  -6.994
  398    HD2  PRO  44           HD2      PRO  44  -6.619 -12.487  -7.690
  399    HD3  PRO  44           HD3      PRO  44  -7.881 -11.450  -8.392
  400    H    ASN  45           H        ASN  45  -5.810 -11.488  -4.839
  401    HA   ASN  45           HA       ASN  45  -6.162 -10.768  -2.067
  402    HB2  ASN  45           HB2      ASN  45  -4.087 -12.493  -3.433
  403    HB3  ASN  45           HB3      ASN  45  -4.206 -12.274  -1.690
  404   HD21  ASN  45          HD21      ASN  45  -5.671 -13.654  -4.514
  405   HD22  ASN  45          HD22      ASN  45  -6.776 -14.698  -3.683
  406    H    ASP  46           H        ASP  46  -4.553  -9.431  -4.671
  407    HA   ASP  46           HA       ASP  46  -2.508  -8.150  -3.004
  408    HB2  ASP  46           HB2      ASP  46  -2.862  -8.340  -6.001
  409    HB3  ASP  46           HB3      ASP  46  -1.670  -7.287  -5.246
  410    H    PHE  47           H        PHE  47  -5.600  -7.661  -3.634
  411    HA   PHE  47           HA       PHE  47  -5.358  -4.748  -3.998
  412    HB2  PHE  47           HB2      PHE  47  -7.474  -6.708  -4.829
  413    HB3  PHE  47           HB3      PHE  47  -7.904  -5.027  -4.546
  414    HD1  PHE  47           HD1      PHE  47  -5.163  -6.872  -6.301
  415    HD2  PHE  47           HD2      PHE  47  -8.049  -3.751  -6.429
  416    HE1  PHE  47           HE1      PHE  47  -4.428  -6.290  -8.573
  417    HE2  PHE  47           HE2      PHE  47  -7.317  -3.160  -8.700
  418    HZ   PHE  47           HZ       PHE  47  -5.504  -4.430  -9.775
  419    H    GLY  48           H        GLY  48  -6.173  -3.413  -2.470
  420    HA2  GLY  48           HA2      GLY  48  -7.841  -4.592  -0.352
  421    HA3  GLY  48           HA3      GLY  48  -6.378  -3.733   0.088
  422    H    LEU  49           H        LEU  49  -8.082  -2.551   1.349
  423    HA   LEU  49           HA       LEU  49  -9.636  -0.691  -0.311
  424    HB2  LEU  49           HB2      LEU  49  -9.983  -1.373   2.605
  425    HB3  LEU  49           HB3      LEU  49 -11.042  -0.359   1.645
  426    HG   LEU  49           HG       LEU  49 -10.605  -3.325   1.284
  427   HD11  LEU  49          HD11      LEU  49 -12.991  -1.749   2.234
  428   HD12  LEU  49          HD12      LEU  49 -12.949  -3.491   1.959
  429   HD13  LEU  49          HD13      LEU  49 -11.955  -2.774   3.228
  430   HD21  LEU  49          HD21      LEU  49 -10.957  -2.231  -0.865
  431   HD22  LEU  49          HD22      LEU  49 -12.366  -3.189  -0.406
  432   HD23  LEU  49          HD23      LEU  49 -12.399  -1.434  -0.233
  433    H    PHE  50           H        PHE  50  -8.558   1.082  -0.657
  434    HA   PHE  50           HA       PHE  50  -7.167   2.426   1.548
  435    HB2  PHE  50           HB2      PHE  50  -5.973   2.182  -0.619
  436    HB3  PHE  50           HB3      PHE  50  -7.228   3.139  -1.396
  437    HD1  PHE  50           HD1      PHE  50  -4.450   3.226   1.021
  438    HD2  PHE  50           HD2      PHE  50  -7.249   5.511  -1.232
  439    HE1  PHE  50           HE1      PHE  50  -3.206   5.274   1.556
  440    HE2  PHE  50           HE2      PHE  50  -6.006   7.566  -0.697
  441    HZ   PHE  50           HZ       PHE  50  -3.980   7.449   0.700
  442    H    LEU  51           H        LEU  51  -7.981   4.206   2.506
  443    HA   LEU  51           HA       LEU  51 -10.581   5.145   1.559
  444    HB2  LEU  51           HB2      LEU  51  -9.987   4.503   4.011
  445    HB3  LEU  51           HB3      LEU  51  -9.216   6.075   4.068
  446    HG   LEU  51           HG       LEU  51 -11.532   6.012   5.009
  447   HD11  LEU  51          HD11      LEU  51 -10.573   8.118   4.268
  448   HD12  LEU  51          HD12      LEU  51 -11.141   7.814   2.625
  449   HD13  LEU  51          HD13      LEU  51 -12.304   8.061   3.929
  450   HD21  LEU  51          HD21      LEU  51 -12.515   4.427   3.458
  451   HD22  LEU  51          HD22      LEU  51 -13.414   5.944   3.445
  452   HD23  LEU  51          HD23      LEU  51 -12.302   5.568   2.129
  453    H    SER  52           H        SER  52 -10.595   6.776   0.203
  454    HA   SER  52           HA       SER  52  -8.243   8.421  -0.130
  455    HB2  SER  52           HB2      SER  52 -10.868   8.442  -1.638
  456    HB3  SER  52           HB3      SER  52  -9.397   9.290  -2.111
  457    HG   SER  52           HG       SER  52  -8.492   7.446  -2.712
  458    H    ASP  53           H        ASP  53  -8.015   9.985   1.327
  459    HA   ASP  53           HA       ASP  53 -10.273  11.593   2.185
  460    HB2  ASP  53           HB2      ASP  53  -8.574  11.126   3.849
  461    HB3  ASP  53           HB3      ASP  53  -7.311  11.760   2.799
  462    H    ASP  54           H        ASP  54  -7.087  12.458   0.927
  463    HA   ASP  54           HA       ASP  54  -7.768  13.784  -1.388
  464    HB2  ASP  54           HB2      ASP  54  -9.099  15.355  -0.100
  465    HB3  ASP  54           HB3      ASP  54  -7.770  15.623   1.021
  466    H    ASP  55           H        ASP  55  -5.893  14.322   1.556
  467    HA   ASP  55           HA       ASP  55  -3.465  14.709  -0.015
  468    HB2  ASP  55           HB2      ASP  55  -3.863  16.278   1.804
  469    HB3  ASP  55           HB3      ASP  55  -4.017  14.954   2.953
  470    HA   PRO  56           HA       PRO  56  -2.193  10.484   0.212
  471    HB2  PRO  56           HB2      PRO  56   0.538  10.945   0.493
  472    HB3  PRO  56           HB3      PRO  56  -0.341  10.866  -1.036
  473    HG2  PRO  56           HG2      PRO  56   0.471  13.259   0.562
  474    HG3  PRO  56           HG3      PRO  56   0.479  13.027  -1.197
  475    HD2  PRO  56           HD2      PRO  56  -1.430  14.458  -0.018
  476    HD3  PRO  56           HD3      PRO  56  -1.815  13.373  -1.371
  477    H    LYS  57           H        LYS  57  -1.068  12.754   2.671
  478    HA   LYS  57           HA       LYS  57  -0.099  10.671   4.424
  479    HB2  LYS  57           HB2      LYS  57  -0.682  13.558   5.101
  480    HB3  LYS  57           HB3      LYS  57   0.351  12.446   5.987
  481    HG2  LYS  57           HG2      LYS  57   0.960  13.181   3.153
  482    HG3  LYS  57           HG3      LYS  57   1.438  14.226   4.491
  483    HD2  LYS  57           HD2      LYS  57   2.188  11.318   4.201
  484    HD3  LYS  57           HD3      LYS  57   3.232  12.683   3.797
  485    HE2  LYS  57           HE2      LYS  57   2.141  11.964   6.514
  486    HE3  LYS  57           HE3      LYS  57   3.818  11.861   5.980
  487    HZ1  LYS  57           HZ1      LYS  57   3.492  13.827   7.311
  488    HZ2  LYS  57           HZ2      LYS  57   2.225  14.351   6.317
  489    HZ3  LYS  57           HZ3      LYS  57   3.806  14.292   5.711
  490    H    LYS  58           H        LYS  58  -2.967  12.649   4.077
  491    HA   LYS  58           HA       LYS  58  -4.166  11.837   6.554
  492    HB2  LYS  58           HB2      LYS  58  -5.354  13.185   4.127
  493    HB3  LYS  58           HB3      LYS  58  -6.167  12.990   5.674
  494    HG2  LYS  58           HG2      LYS  58  -4.619  14.424   6.760
  495    HG3  LYS  58           HG3      LYS  58  -3.572  14.464   5.338
  496    HD2  LYS  58           HD2      LYS  58  -5.317  15.602   4.075
  497    HD3  LYS  58           HD3      LYS  58  -6.384  15.541   5.482
  498    HE2  LYS  58           HE2      LYS  58  -3.707  16.910   5.419
  499    HE3  LYS  58           HE3      LYS  58  -5.253  17.726   5.179
  500    HZ1  LYS  58           HZ1      LYS  58  -4.548  17.960   7.455
  501    HZ2  LYS  58           HZ2      LYS  58  -4.380  16.280   7.625
  502    HZ3  LYS  58           HZ3      LYS  58  -5.920  16.960   7.399
  503    H    GLY  59           H        GLY  59  -4.177  10.745   3.269
  504    HA2  GLY  59           HA2      GLY  59  -6.386   9.009   3.324
  505    HA3  GLY  59           HA3      GLY  59  -4.951   8.793   2.328
  506    H    ILE  60           H        ILE  60  -6.503   6.733   3.706
  507    HA   ILE  60           HA       ILE  60  -4.368   5.672   5.410
  508    HB   ILE  60           HB       ILE  60  -6.077   4.797   7.020
  509   HG12  ILE  60          HG12      ILE  60  -7.881   6.826   5.682
  510   HG13  ILE  60          HG13      ILE  60  -8.042   5.080   5.535
  511   HG21  ILE  60          HG21      ILE  60  -4.680   6.694   7.589
  512   HG22  ILE  60          HG22      ILE  60  -5.828   7.793   6.825
  513   HG23  ILE  60          HG23      ILE  60  -6.297   6.892   8.267
  514   HD11  ILE  60          HD11      ILE  60  -9.629   5.987   7.129
  515   HD12  ILE  60          HD12      ILE  60  -8.477   4.917   7.926
  516   HD13  ILE  60          HD13      ILE  60  -8.306   6.666   8.078
  517    H    TRP  61           H        TRP  61  -4.246   3.444   5.523
  518    HA   TRP  61           HA       TRP  61  -5.735   1.986   3.485
  519    HB2  TRP  61           HB2      TRP  61  -3.309   1.363   5.140
  520    HB3  TRP  61           HB3      TRP  61  -4.229   0.053   4.410
  521    HD1  TRP  61           HD1      TRP  61  -1.602   2.572   3.637
  522    HE1  TRP  61           HE1      TRP  61  -0.951   2.443   1.148
  523    HE3  TRP  61           HE3      TRP  61  -5.385  -0.413   1.988
  524    HZ2  TRP  61           HZ2      TRP  61  -1.935   1.231  -1.204
  525    HZ3  TRP  61           HZ3      TRP  61  -5.471  -1.011  -0.396
  526    HH2  TRP  61           HH2      TRP  61  -3.779  -0.206  -1.957
  527    H    LEU  62           H        LEU  62  -7.310   0.589   3.921
  528    HA   LEU  62           HA       LEU  62  -8.209   0.445   6.689
  529    HB2  LEU  62           HB2      LEU  62  -9.566  -0.521   4.174
  530    HB3  LEU  62           HB3      LEU  62 -10.297  -0.363   5.760
  531    HG   LEU  62           HG       LEU  62  -9.274   1.944   4.104
  532   HD11  LEU  62          HD11      LEU  62 -11.223   0.913   3.080
  533   HD12  LEU  62          HD12      LEU  62 -12.091   1.014   4.612
  534   HD13  LEU  62          HD13      LEU  62 -11.623   2.489   3.764
  535   HD21  LEU  62          HD21      LEU  62  -9.174   2.369   6.492
  536   HD22  LEU  62          HD22      LEU  62 -10.456   3.318   5.739
  537   HD23  LEU  62          HD23      LEU  62 -10.857   1.870   6.663
  538    H    GLU  63           H        GLU  63  -7.306  -1.167   7.822
  539    HA   GLU  63           HA       GLU  63  -6.332  -3.551   6.572
  540    HB2  GLU  63           HB2      GLU  63  -5.810  -4.236   8.891
  541    HB3  GLU  63           HB3      GLU  63  -5.183  -2.637   8.501
  542    HG2  GLU  63           HG2      GLU  63  -7.872  -2.711   9.683
  543    HG3  GLU  63           HG3      GLU  63  -6.559  -3.217  10.729
  544    H    ALA  64           H        ALA  64  -6.976  -5.721   7.268
  545    HA   ALA  64           HA       ALA  64  -9.837  -5.949   7.143
  546    HB1  ALA  64           HB1      ALA  64  -8.403  -7.439   5.835
  547    HB2  ALA  64           HB2      ALA  64  -7.758  -8.117   7.331
  548    HB3  ALA  64           HB3      ALA  64  -9.459  -8.340   6.924
  549    H    GLY  65           H        GLY  65  -7.775  -5.484   9.650
  550    HA2  GLY  65           HA2      GLY  65  -9.022  -7.281  11.540
  551    HA3  GLY  65           HA3      GLY  65  -7.791  -6.079  11.897
  552    H    LYS  66           H        LYS  66 -10.077  -4.462  10.169
  553    HA   LYS  66           HA       LYS  66 -11.847  -4.045  12.451
  554    HB2  LYS  66           HB2      LYS  66 -11.346  -1.874  12.811
  555    HB3  LYS  66           HB3      LYS  66  -9.805  -2.309  12.088
  556    HG2  LYS  66           HG2      LYS  66 -12.112  -1.180  10.525
  557    HG3  LYS  66           HG3      LYS  66 -10.845  -0.194  11.247
  558    HD2  LYS  66           HD2      LYS  66  -9.184  -1.157   9.856
  559    HD3  LYS  66           HD3      LYS  66 -10.281  -2.431   9.318
  560    HE2  LYS  66           HE2      LYS  66 -10.645   0.512   8.758
  561    HE3  LYS  66           HE3      LYS  66  -9.958  -0.650   7.624
  562    HZ1  LYS  66           HZ1      LYS  66 -12.055  -1.871   7.722
  563    HZ2  LYS  66           HZ2      LYS  66 -12.267  -0.293   7.152
  564    HZ3  LYS  66           HZ3      LYS  66 -12.705  -0.685   8.742
  565    H    ALA  67           H        ALA  67 -13.809  -2.883  11.916
  566    HA   ALA  67           HA       ALA  67 -14.771  -3.617   9.274
  567    HB1  ALA  67           HB1      ALA  67 -16.100  -4.054  11.315
  568    HB2  ALA  67           HB2      ALA  67 -16.246  -2.312  11.559
  569    HB3  ALA  67           HB3      ALA  67 -16.959  -3.064  10.129
  570    H    LEU  68           H        LEU  68 -16.283  -1.905   8.214
  571    HA   LEU  68           HA       LEU  68 -14.546   0.215   7.452
  572    HB2  LEU  68           HB2      LEU  68 -17.449  -0.231   6.801
  573    HB3  LEU  68           HB3      LEU  68 -16.391   0.920   6.017
  574    HG   LEU  68           HG       LEU  68 -16.034  -2.074   5.974
  575   HD11  LEU  68          HD11      LEU  68 -17.005  -0.185   3.838
  576   HD12  LEU  68          HD12      LEU  68 -16.663  -1.901   3.617
  577   HD13  LEU  68          HD13      LEU  68 -17.971  -1.393   4.685
  578   HD21  LEU  68          HD21      LEU  68 -13.921  -0.882   5.850
  579   HD22  LEU  68          HD22      LEU  68 -14.316  -1.611   4.293
  580   HD23  LEU  68          HD23      LEU  68 -14.547   0.121   4.543
  581    H    ASP  69           H        ASP  69 -17.681   0.206   9.100
  582    HA   ASP  69           HA       ASP  69 -17.839   3.025   9.407
  583    HB2  ASP  69           HB2      ASP  69 -19.876   1.768   9.361
  584    HB3  ASP  69           HB3      ASP  69 -19.340   0.719  10.663
  585    H    TYR  70           H        TYR  70 -16.113   0.649  11.060
  586    HA   TYR  70           HA       TYR  70 -15.820   1.602  13.620
  587    HB2  TYR  70           HB2      TYR  70 -14.785  -0.460  12.783
  588    HB3  TYR  70           HB3      TYR  70 -13.730   0.484  11.738
  589    HD1  TYR  70           HD1      TYR  70 -14.595  -0.002  15.311
  590    HD2  TYR  70           HD2      TYR  70 -11.643   1.089  12.467
  591    HE1  TYR  70           HE1      TYR  70 -12.918   0.092  17.104
  592    HE2  TYR  70           HE2      TYR  70  -9.948   1.189  14.243
  593    HH   TYR  70           HH       TYR  70  -9.810   1.466  16.655
  594    H    TYR  71           H        TYR  71 -14.134   2.609  10.664
  595    HA   TYR  71           HA       TYR  71 -12.934   4.900  11.947
  596    HB2  TYR  71           HB2      TYR  71 -12.989   3.882   9.113
  597    HB3  TYR  71           HB3      TYR  71 -12.339   5.472   9.503
  598    HD1  TYR  71           HD1      TYR  71 -11.880   1.842   9.981
  599    HD2  TYR  71           HD2      TYR  71 -10.204   5.706  10.562
  600    HE1  TYR  71           HE1      TYR  71  -9.716   0.812  10.540
  601    HE2  TYR  71           HE2      TYR  71  -8.041   4.682  11.122
  602    HH   TYR  71           HH       TYR  71  -7.102   2.647  11.888
  603    H    MET  72           H        MET  72 -13.327   6.794   9.808
  604    HA   MET  72           HA       MET  72 -15.927   7.776  10.667
  605    HB2  MET  72           HB2      MET  72 -13.760   9.053   8.995
  606    HB3  MET  72           HB3      MET  72 -15.243   9.859   9.488
  607    HG2  MET  72           HG2      MET  72 -14.601   9.570  11.837
  608    HG3  MET  72           HG3      MET  72 -13.097   8.811  11.318
  609    HE1  MET  72           HE1      MET  72 -11.203  10.103   9.921
  610    HE2  MET  72           HE2      MET  72 -12.412  10.584   8.729
  611    HE3  MET  72           HE3      MET  72 -11.340  11.794   9.436
  612    H    LEU  73           H        LEU  73 -15.658   5.525   8.645
  613    HA   LEU  73           HA       LEU  73 -16.553   6.785   6.181
  614    HB2  LEU  73           HB2      LEU  73 -16.829   3.884   6.292
  615    HB3  LEU  73           HB3      LEU  73 -16.060   4.892   5.092
  616    HG   LEU  73           HG       LEU  73 -14.814   3.876   7.641
  617   HD11  LEU  73          HD11      LEU  73 -14.282   3.309   4.732
  618   HD12  LEU  73          HD12      LEU  73 -13.328   2.697   6.084
  619   HD13  LEU  73          HD13      LEU  73 -15.013   2.208   5.899
  620   HD21  LEU  73          HD21      LEU  73 -14.011   6.110   7.198
  621   HD22  LEU  73          HD22      LEU  73 -12.756   4.928   6.830
  622   HD23  LEU  73          HD23      LEU  73 -13.668   5.683   5.521
  623    H    ARG  74           H        ARG  74 -18.466   6.499   5.227
  624    HA   ARG  74           HA       ARG  74 -20.681   5.151   6.235
  625    HB2  ARG  74           HB2      ARG  74 -21.899   7.352   7.001
  626    HB3  ARG  74           HB3      ARG  74 -20.912   6.447   8.137
  627    HG2  ARG  74           HG2      ARG  74 -20.459   8.783   8.392
  628    HG3  ARG  74           HG3      ARG  74 -19.042   8.000   7.693
  629    HD2  ARG  74           HD2      ARG  74 -20.047   8.714   5.430
  630    HD3  ARG  74           HD3      ARG  74 -21.034   9.816   6.390
  631    HE   ARG  74           HE       ARG  74 -18.083   9.833   6.370
  632   HH11  ARG  74          HH11      ARG  74 -21.168  11.464   6.626
  633   HH12  ARG  74          HH12      ARG  74 -20.473  13.055   6.646
  634   HH21  ARG  74          HH21      ARG  74 -17.154  11.910   6.394
  635   HH22  ARG  74          HH22      ARG  74 -18.173  13.314   6.536
  636    H    ASN  75           H        ASN  75 -22.703   6.882   5.540
  637    HA   ASN  75           HA       ASN  75 -22.725   6.591   2.753
  638    HB2  ASN  75           HB2      ASN  75 -24.478   8.060   4.689
  639    HB3  ASN  75           HB3      ASN  75 -24.724   8.263   2.957
  640   HD21  ASN  75          HD21      ASN  75 -24.796   5.998   5.620
  641   HD22  ASN  75          HD22      ASN  75 -25.726   4.785   4.796
  642    H    GLY  76           H        GLY  76 -21.181   7.562   1.589
  643    HA2  GLY  76           HA2      GLY  76 -21.182   9.676   0.230
  644    HA3  GLY  76           HA3      GLY  76 -21.052  10.509   1.771
  645    H    ASP  77           H        ASP  77 -19.199   8.020   2.480
  646    HA   ASP  77           HA       ASP  77 -16.803   9.524   1.919
  647    HB2  ASP  77           HB2      ASP  77 -17.448   8.025   4.015
  648    HB3  ASP  77           HB3      ASP  77 -16.693   6.761   3.050
  649    H    THR  78           H        THR  78 -15.153   8.995   0.529
  650    HA   THR  78           HA       THR  78 -15.806   7.043  -1.536
  651    HB   THR  78           HB       THR  78 -13.562   9.076  -1.431
  652    HG1  THR  78           HG1      THR  78 -15.698   9.999  -1.542
  653   HG21  THR  78          HG21      THR  78 -13.049   7.203  -2.914
  654   HG22  THR  78          HG22      THR  78 -13.378   8.662  -3.849
  655   HG23  THR  78          HG23      THR  78 -14.603   7.401  -3.724
  656    H    MET  79           H        MET  79 -14.720   5.155  -1.803
  657    HA   MET  79           HA       MET  79 -12.350   4.717  -0.134
  658    HB2  MET  79           HB2      MET  79 -14.492   3.633   0.767
  659    HB3  MET  79           HB3      MET  79 -14.422   2.585  -0.643
  660    HG2  MET  79           HG2      MET  79 -12.225   1.787   0.048
  661    HG3  MET  79           HG3      MET  79 -12.285   2.843   1.459
  662    HE1  MET  79           HE1      MET  79 -15.093   0.580  -0.201
  663    HE2  MET  79           HE2      MET  79 -13.601  -0.364  -0.265
  664    HE3  MET  79           HE3      MET  79 -14.924  -0.869   0.790
  665    H    GLU  80           H        GLU  80 -10.747   4.423  -1.446
  666    HA   GLU  80           HA       GLU  80 -11.117   3.710  -4.213
  667    HB2  GLU  80           HB2      GLU  80  -9.426   5.375  -3.224
  668    HB3  GLU  80           HB3      GLU  80  -8.508   3.970  -2.717
  669    HG2  GLU  80           HG2      GLU  80  -8.186   3.286  -4.990
  670    HG3  GLU  80           HG3      GLU  80  -9.254   4.570  -5.567
  671    H    TYR  81           H        TYR  81 -11.114   1.613  -4.972
  672    HA   TYR  81           HA       TYR  81  -9.988  -0.442  -3.240
  673    HB2  TYR  81           HB2      TYR  81 -12.294  -0.734  -4.226
  674    HB3  TYR  81           HB3      TYR  81 -11.548  -0.767  -5.819
  675    HD1  TYR  81           HD1      TYR  81 -11.875  -2.584  -2.623
  676    HD2  TYR  81           HD2      TYR  81 -10.442  -2.727  -6.624
  677    HE1  TYR  81           HE1      TYR  81 -11.522  -5.009  -2.404
  678    HE2  TYR  81           HE2      TYR  81 -10.089  -5.148  -6.420
  679    HH   TYR  81           HH       TYR  81  -9.830  -6.844  -4.820
  680    H    ARG  82           H        ARG  82  -7.878  -0.635  -3.533
  681    HA   ARG  82           HA       ARG  82  -6.845  -0.502  -6.270
  682    HB2  ARG  82           HB2      ARG  82  -4.964   0.923  -5.542
  683    HB3  ARG  82           HB3      ARG  82  -6.518   1.735  -5.422
  684    HG2  ARG  82           HG2      ARG  82  -6.517   1.660  -3.097
  685    HG3  ARG  82           HG3      ARG  82  -5.298   0.382  -3.042
  686    HD2  ARG  82           HD2      ARG  82  -4.787   3.176  -4.050
  687    HD3  ARG  82           HD3      ARG  82  -4.442   2.633  -2.407
  688    HE   ARG  82           HE       ARG  82  -3.121   0.820  -3.887
  689   HH11  ARG  82          HH11      ARG  82  -3.154   4.328  -3.940
  690   HH12  ARG  82          HH12      ARG  82  -1.539   4.453  -4.566
  691   HH21  ARG  82          HH21      ARG  82  -0.993   0.987  -4.692
  692   HH22  ARG  82          HH22      ARG  82  -0.309   2.557  -5.002
  693    H    LYS  83           H        LYS  83  -4.566  -1.184  -6.401
  694    HA   LYS  83           HA       LYS  83  -4.125  -3.648  -5.104
  695    HB2  LYS  83           HB2      LYS  83  -3.193  -2.937  -7.329
  696    HB3  LYS  83           HB3      LYS  83  -2.091  -1.872  -6.471
  697    HG2  LYS  83           HG2      LYS  83  -1.004  -3.746  -5.435
  698    HG3  LYS  83           HG3      LYS  83  -2.188  -4.862  -6.126
  699    HD2  LYS  83           HD2      LYS  83  -1.445  -4.133  -8.388
  700    HD3  LYS  83           HD3      LYS  83  -0.178  -3.178  -7.616
  701    HE2  LYS  83           HE2      LYS  83   0.787  -5.244  -8.311
  702    HE3  LYS  83           HE3      LYS  83   0.651  -5.272  -6.552
  703    HZ1  LYS  83           HZ1      LYS  83  -1.270  -6.545  -8.429
  704    HZ2  LYS  83           HZ2      LYS  83  -1.305  -6.639  -6.738
  705    HZ3  LYS  83           HZ3      LYS  83  -0.041  -7.366  -7.595
  706    H    LYS  84           H        LYS  84  -3.190  -4.107  -3.215
  707    HA   LYS  84           HA       LYS  84  -2.759  -2.183  -1.234
  708    HB2  LYS  84           HB2      LYS  84  -1.992  -5.071  -1.525
  709    HB3  LYS  84           HB3      LYS  84  -1.423  -4.146  -0.144
  710    HG2  LYS  84           HG2      LYS  84  -4.321  -4.449  -0.892
  711    HG3  LYS  84           HG3      LYS  84  -3.479  -5.460   0.286
  712    HD2  LYS  84           HD2      LYS  84  -2.986  -2.695   0.847
  713    HD3  LYS  84           HD3      LYS  84  -4.719  -2.972   0.722
  714    HE2  LYS  84           HE2      LYS  84  -3.970  -3.267   3.011
  715    HE3  LYS  84           HE3      LYS  84  -4.537  -4.797   2.347
  716    HZ1  LYS  84           HZ1      LYS  84  -1.672  -4.021   2.408
  717    HZ2  LYS  84           HZ2      LYS  84  -2.327  -5.555   2.087
  718    HZ3  LYS  84           HZ3      LYS  84  -2.425  -4.902   3.648
  719    H    GLN  85           H        GLN  85  -0.629  -3.570  -3.590
  720    HA   GLN  85           HA       GLN  85   1.738  -2.528  -2.306
  721    HB2  GLN  85           HB2      GLN  85   2.127  -3.694  -4.936
  722    HB3  GLN  85           HB3      GLN  85   2.831  -4.154  -3.392
  723    HG2  GLN  85           HG2      GLN  85   0.630  -5.304  -2.908
  724    HG3  GLN  85           HG3      GLN  85   0.257  -5.074  -4.615
  725   HE21  GLN  85          HE21      GLN  85   2.130  -6.796  -2.300
  726   HE22  GLN  85          HE22      GLN  85   2.826  -7.937  -3.394
  727    H    ARG  86           H        ARG  86   3.156  -1.114  -3.296
  728    HA   ARG  86           HA       ARG  86   2.176   0.309  -5.685
  729    HB2  ARG  86           HB2      ARG  86   3.477   2.253  -4.871
  730    HB3  ARG  86           HB3      ARG  86   2.226   1.777  -3.727
  731    HG2  ARG  86           HG2      ARG  86   3.734   0.956  -2.205
  732    HG3  ARG  86           HG3      ARG  86   4.979   0.688  -3.423
  733    HD2  ARG  86           HD2      ARG  86   5.808   2.499  -2.352
  734    HD3  ARG  86           HD3      ARG  86   4.905   3.288  -3.637
  735    HE   ARG  86           HE       ARG  86   3.534   2.904  -1.098
  736   HH11  ARG  86          HH11      ARG  86   5.227   5.117  -3.221
  737   HH12  ARG  86          HH12      ARG  86   4.674   6.529  -2.379
  738   HH21  ARG  86          HH21      ARG  86   2.842   4.741   0.011
  739   HH22  ARG  86          HH22      ARG  86   3.321   6.321  -0.553
  740    HA   PRO  87           HA       PRO  87   5.868  -1.109  -7.675
  741    HB2  PRO  87           HB2      PRO  87   6.382   0.908  -9.422
  742    HB3  PRO  87           HB3      PRO  87   5.070  -0.254  -9.638
  743    HG2  PRO  87           HG2      PRO  87   4.975   2.548  -8.616
  744    HG3  PRO  87           HG3      PRO  87   3.832   1.698  -9.670
  745    HD2  PRO  87           HD2      PRO  87   3.424   2.099  -6.998
  746    HD3  PRO  87           HD3      PRO  87   2.732   0.740  -7.904
  747    H    LEU  88           H        LEU  88   7.727  -1.231  -6.633
  748    HA   LEU  88           HA       LEU  88   9.057   1.230  -5.727
  749    HB2  LEU  88           HB2      LEU  88   8.984  -1.552  -4.713
  750    HB3  LEU  88           HB3      LEU  88  10.522  -0.724  -4.587
  751    HG   LEU  88           HG       LEU  88   9.135  -0.588  -2.530
  752   HD11  LEU  88          HD11      LEU  88  10.841   1.085  -2.984
  753   HD12  LEU  88          HD12      LEU  88   9.671   2.045  -3.892
  754   HD13  LEU  88          HD13      LEU  88   9.455   1.802  -2.159
  755   HD21  LEU  88          HD21      LEU  88   6.935  -0.477  -3.549
  756   HD22  LEU  88          HD22      LEU  88   7.206   0.917  -2.503
  757   HD23  LEU  88          HD23      LEU  88   7.322   1.093  -4.254
  758    H    LYS  89           H        LYS  89  10.723   1.938  -6.926
  759    HA   LYS  89           HA       LYS  89  12.198  -0.004  -8.549
  760    HB2  LYS  89           HB2      LYS  89  12.084   3.005  -8.602
  761    HB3  LYS  89           HB3      LYS  89  13.406   2.136  -9.369
  762    HG2  LYS  89           HG2      LYS  89  11.916   2.467 -11.108
  763    HG3  LYS  89           HG3      LYS  89  11.551   0.822 -10.584
  764    HD2  LYS  89           HD2      LYS  89   9.450   1.777 -10.805
  765    HD3  LYS  89           HD3      LYS  89   9.777   1.947  -9.079
  766    HE2  LYS  89           HE2      LYS  89   8.887   4.022  -9.864
  767    HE3  LYS  89           HE3      LYS  89  10.603   4.256  -9.536
  768    HZ1  LYS  89           HZ1      LYS  89  11.046   4.001 -11.910
  769    HZ2  LYS  89           HZ2      LYS  89   9.974   5.282 -11.625
  770    HZ3  LYS  89           HZ3      LYS  89   9.388   3.802 -12.210
  771    H    ILE  90           H        ILE  90  14.026  -0.802  -7.848
  772    HA   ILE  90           HA       ILE  90  15.213   0.429  -5.439
  773    HB   ILE  90           HB       ILE  90  14.721  -2.523  -5.883
  774   HG12  ILE  90          HG12      ILE  90  12.666  -1.281  -5.332
  775   HG13  ILE  90          HG13      ILE  90  13.142  -2.359  -4.025
  776   HG21  ILE  90          HG21      ILE  90  15.524  -2.778  -3.562
  777   HG22  ILE  90          HG22      ILE  90  16.770  -2.193  -4.664
  778   HG23  ILE  90          HG23      ILE  90  15.973  -1.073  -3.557
  779   HD11  ILE  90          HD11      ILE  90  14.071  -0.469  -2.799
  780   HD12  ILE  90          HD12      ILE  90  13.605   0.612  -4.112
  781   HD13  ILE  90          HD13      ILE  90  12.366  -0.222  -3.177
  782    H    ARG  91           H        ARG  91  17.416   0.571  -5.428
  783    HA   ARG  91           HA       ARG  91  18.896  -0.643  -7.637
  784    HB2  ARG  91           HB2      ARG  91  19.074   1.814  -6.243
  785    HB3  ARG  91           HB3      ARG  91  20.489   0.882  -5.770
  786    HG2  ARG  91           HG2      ARG  91  21.096   2.220  -7.629
  787    HG3  ARG  91           HG3      ARG  91  20.961   0.554  -8.211
  788    HD2  ARG  91           HD2      ARG  91  19.088   0.959  -9.393
  789    HD3  ARG  91           HD3      ARG  91  18.549   2.258  -8.317
  790    HE   ARG  91           HE       ARG  91  20.897   3.000  -9.733
  791   HH11  ARG  91          HH11      ARG  91  17.467   2.521 -10.196
  792   HH12  ARG  91          HH12      ARG  91  17.315   3.768 -11.395
  793   HH21  ARG  91          HH21      ARG  91  20.703   4.665 -11.287
  794   HH22  ARG  91          HH22      ARG  91  19.148   5.008 -11.986
  795    H    MET  92           H        MET  92  19.739  -2.632  -7.215
  796    HA   MET  92           HA       MET  92  20.182  -3.513  -4.522
  797    HB2  MET  92           HB2      MET  92  20.196  -4.665  -7.217
  798    HB3  MET  92           HB3      MET  92  21.433  -5.336  -6.162
  799    HG2  MET  92           HG2      MET  92  19.150  -6.467  -6.276
  800    HG3  MET  92           HG3      MET  92  19.883  -6.221  -4.697
  801    HE1  MET  92           HE1      MET  92  16.978  -5.297  -7.126
  802    HE2  MET  92           HE2      MET  92  16.353  -3.810  -6.412
  803    HE3  MET  92           HE3      MET  92  17.956  -3.830  -7.147
  804    H    LEU  93           H        LEU  93  22.431  -4.771  -4.303
  805    HA   LEU  93           HA       LEU  93  24.164  -2.749  -3.554
  806    HB2  LEU  93           HB2      LEU  93  24.783  -5.665  -4.029
  807    HB3  LEU  93           HB3      LEU  93  25.846  -4.546  -3.205
  808    HG   LEU  93           HG       LEU  93  24.821  -5.759  -1.492
  809   HD11  LEU  93          HD11      LEU  93  23.223  -3.228  -1.792
  810   HD12  LEU  93          HD12      LEU  93  23.399  -4.166  -0.309
  811   HD13  LEU  93          HD13      LEU  93  24.807  -3.388  -1.030
  812   HD21  LEU  93          HD21      LEU  93  22.118  -5.308  -2.742
  813   HD22  LEU  93          HD22      LEU  93  23.062  -6.791  -2.894
  814   HD23  LEU  93          HD23      LEU  93  22.485  -6.269  -1.312
  815    H    ASP  94           H        ASP  94  24.226  -4.762  -6.453
  816    HA   ASP  94           HA       ASP  94  26.722  -3.624  -7.366
  817    HB2  ASP  94           HB2      ASP  94  24.735  -5.368  -8.838
  818    HB3  ASP  94           HB3      ASP  94  26.356  -4.967  -9.392
  819    H    GLY  95           H        GLY  95  23.635  -2.462  -7.266
  820    HA2  GLY  95           HA2      GLY  95  23.019  -0.345  -8.179
  821    HA3  GLY  95           HA3      GLY  95  24.144  -0.628  -9.511
  822    H    THR  96           H        THR  96  22.698  -3.473  -8.978
  823    HA   THR  96           HA       THR  96  21.202  -3.461 -11.349
  824    HB   THR  96           HB       THR  96  20.826  -5.407  -9.071
  825    HG1  THR  96           HG1      THR  96  22.721  -6.364  -9.602
  826   HG21  THR  96          HG21      THR  96  20.741  -5.727 -12.076
  827   HG22  THR  96          HG22      THR  96  19.344  -5.682 -11.000
  828   HG23  THR  96          HG23      THR  96  20.493  -7.016 -10.898
  829    H    VAL  97           H        VAL  97  19.252  -2.581 -11.688
  830    HA   VAL  97           HA       VAL  97  17.646  -2.014  -9.296
  831    HB   VAL  97           HB       VAL  97  18.335   0.058 -10.160
  832   HG11  VAL  97          HG11      VAL  97  17.521  -0.929 -12.881
  833   HG12  VAL  97          HG12      VAL  97  18.002   0.727 -12.510
  834   HG13  VAL  97          HG13      VAL  97  19.154  -0.590 -12.302
  835   HG21  VAL  97          HG21      VAL  97  16.267   1.141 -10.874
  836   HG22  VAL  97          HG22      VAL  97  15.553  -0.436 -11.216
  837   HG23  VAL  97          HG23      VAL  97  15.976   0.002  -9.560
  838    H    LYS  98           H        LYS  98  15.581  -2.504  -9.218
  839    HA   LYS  98           HA       LYS  98  14.265  -3.648 -11.564
  840    HB2  LYS  98           HB2      LYS  98  13.596  -5.672 -10.543
  841    HB3  LYS  98           HB3      LYS  98  15.315  -5.533 -10.219
  842    HG2  LYS  98           HG2      LYS  98  14.956  -5.001  -7.961
  843    HG3  LYS  98           HG3      LYS  98  13.247  -4.657  -8.232
  844    HD2  LYS  98           HD2      LYS  98  14.488  -7.381  -8.580
  845    HD3  LYS  98           HD3      LYS  98  13.697  -6.852  -7.094
  846    HE2  LYS  98           HE2      LYS  98  11.992  -7.968  -8.179
  847    HE3  LYS  98           HE3      LYS  98  11.704  -6.294  -8.664
  848    HZ1  LYS  98           HZ1      LYS  98  13.129  -8.336 -10.297
  849    HZ2  LYS  98           HZ2      LYS  98  12.793  -6.743 -10.766
  850    HZ3  LYS  98           HZ3      LYS  98  11.524  -7.837 -10.526
  851    H    THR  99           H        THR  99  11.920  -3.824 -11.300
  852    HA   THR  99           HA       THR  99  10.893  -1.995  -9.235
  853    HB   THR  99           HB       THR  99   9.437  -2.816 -11.747
  854    HG1  THR  99           HG1      THR  99  11.150  -1.826 -12.638
  855   HG21  THR  99          HG21      THR  99   8.211  -0.741 -11.360
  856   HG22  THR  99          HG22      THR  99   9.222  -0.395  -9.957
  857   HG23  THR  99          HG23      THR  99   8.139  -1.786  -9.941
  858    H    ILE 100           H        ILE 100   9.802  -3.023  -7.607
  859    HA   ILE 100           HA       ILE 100   8.207  -5.359  -8.345
  860    HB   ILE 100           HB       ILE 100  10.331  -6.175  -7.377
  861   HG12  ILE 100          HG12      ILE 100   7.933  -7.187  -6.910
  862   HG13  ILE 100          HG13      ILE 100   9.365  -7.860  -6.150
  863   HG21  ILE 100          HG21      ILE 100   9.511  -4.629  -4.928
  864   HG22  ILE 100          HG22      ILE 100  10.836  -5.790  -5.002
  865   HG23  ILE 100          HG23      ILE 100  10.903  -4.312  -5.963
  866   HD11  ILE 100          HD11      ILE 100   7.429  -5.936  -4.883
  867   HD12  ILE 100          HD12      ILE 100   7.535  -7.670  -4.577
  868   HD13  ILE 100          HD13      ILE 100   8.866  -6.610  -4.113
  869    H    MET 101           H        MET 101   6.309  -5.583  -7.161
  870    HA   MET 101           HA       MET 101   5.494  -3.094  -5.884
  871    HB2  MET 101           HB2      MET 101   3.866  -5.435  -6.850
  872    HB3  MET 101           HB3      MET 101   3.203  -3.940  -6.194
  873    HG2  MET 101           HG2      MET 101   4.711  -2.875  -8.079
  874    HG3  MET 101           HG3      MET 101   4.494  -4.461  -8.813
  875    HE1  MET 101           HE1      MET 101   1.105  -1.538  -7.743
  876    HE2  MET 101           HE2      MET 101   1.976  -2.462  -6.518
  877    HE3  MET 101           HE3      MET 101   2.826  -1.244  -7.470
  878    H    VAL 102           H        VAL 102   5.594  -2.882  -3.867
  879    HA   VAL 102           HA       VAL 102   5.051  -5.175  -2.091
  880    HB   VAL 102           HB       VAL 102   6.157  -3.353  -0.412
  881   HG11  VAL 102          HG11      VAL 102   6.664  -5.713  -0.559
  882   HG12  VAL 102          HG12      VAL 102   7.590  -5.440  -2.037
  883   HG13  VAL 102          HG13      VAL 102   8.143  -4.756  -0.509
  884   HG21  VAL 102          HG21      VAL 102   6.721  -1.803  -2.203
  885   HG22  VAL 102          HG22      VAL 102   8.184  -2.485  -1.493
  886   HG23  VAL 102          HG23      VAL 102   7.605  -3.079  -3.048
  887    H    ASP 103           H        ASP 103   3.550  -5.063  -0.573
  888    HA   ASP 103           HA       ASP 103   1.393  -3.336  -0.758
  889    HB2  ASP 103           HB2      ASP 103   1.071  -5.403   0.342
  890    HB3  ASP 103           HB3      ASP 103   2.391  -5.104   1.467
  891    H    ASP 104           H        ASP 104   1.398  -1.229  -0.485
  892    HA   ASP 104           HA       ASP 104   3.316   0.285   0.848
  893    HB2  ASP 104           HB2      ASP 104   1.841   1.263  -0.815
  894    HB3  ASP 104           HB3      ASP 104   0.438   0.962   0.206
  895    H    SER 105           H        SER 105   0.617  -1.452   2.098
  896    HA   SER 105           HA       SER 105   0.246   0.215   4.410
  897    HB2  SER 105           HB2      SER 105  -1.580  -1.102   3.329
  898    HB3  SER 105           HB3      SER 105  -0.805  -2.574   3.909
  899    HG   SER 105           HG       SER 105  -1.308  -0.590   5.798
  900    H    LYS 106           H        LYS 106   2.407  -2.357   3.634
  901    HA   LYS 106           HA       LYS 106   2.741  -3.048   6.456
  902    HB2  LYS 106           HB2      LYS 106   4.169  -4.887   5.625
  903    HB3  LYS 106           HB3      LYS 106   2.545  -4.931   4.961
  904    HG2  LYS 106           HG2      LYS 106   3.817  -5.385   3.110
  905    HG3  LYS 106           HG3      LYS 106   3.624  -3.641   2.973
  906    HD2  LYS 106           HD2      LYS 106   5.832  -3.622   4.375
  907    HD3  LYS 106           HD3      LYS 106   6.017  -5.248   3.710
  908    HE2  LYS 106           HE2      LYS 106   7.125  -3.864   2.192
  909    HE3  LYS 106           HE3      LYS 106   5.554  -4.159   1.443
  910    HZ1  LYS 106           HZ1      LYS 106   6.309  -1.801   1.403
  911    HZ2  LYS 106           HZ2      LYS 106   6.146  -1.765   3.089
  912    HZ3  LYS 106           HZ3      LYS 106   4.790  -2.039   2.112
  913    H    THR 107           H        THR 107   4.999  -3.350   7.245
  914    HA   THR 107           HA       THR 107   6.283  -0.828   7.174
  915    HB   THR 107           HB       THR 107   8.044  -2.155   8.572
  916    HG1  THR 107           HG1      THR 107   7.613  -4.217   8.821
  917   HG21  THR 107          HG21      THR 107   6.419  -0.582   9.512
  918   HG22  THR 107          HG22      THR 107   6.596  -2.000  10.546
  919   HG23  THR 107          HG23      THR 107   5.185  -1.842   9.501
  920    H    VAL 108           H        VAL 108   8.831  -0.869   7.149
  921    HA   VAL 108           HA       VAL 108   9.539  -1.197   4.421
  922    HB   VAL 108           HB       VAL 108  11.233  -0.529   6.813
  923   HG11  VAL 108          HG11      VAL 108  12.836   0.399   5.211
  924   HG12  VAL 108          HG12      VAL 108  12.615  -1.335   4.983
  925   HG13  VAL 108          HG13      VAL 108  11.841  -0.195   3.882
  926   HG21  VAL 108          HG21      VAL 108  10.989   1.787   6.071
  927   HG22  VAL 108          HG22      VAL 108   9.905   1.252   4.786
  928   HG23  VAL 108          HG23      VAL 108   9.436   1.057   6.475
  929    H    THR 109           H        THR 109  10.788  -2.704   7.380
  930    HA   THR 109           HA       THR 109  12.623  -4.453   6.413
  931    HB   THR 109           HB       THR 109  10.620  -5.190   8.543
  932    HG1  THR 109           HG1      THR 109  12.336  -4.209   9.899
  933   HG21  THR 109          HG21      THR 109  12.089  -7.026   7.833
  934   HG22  THR 109          HG22      THR 109  12.479  -6.489   9.468
  935   HG23  THR 109          HG23      THR 109  13.500  -6.004   8.113
  936    H    ASP 110           H        ASP 110   9.122  -5.208   6.644
  937    HA   ASP 110           HA       ASP 110   9.275  -7.783   5.563
  938    HB2  ASP 110           HB2      ASP 110   7.279  -6.943   6.707
  939    HB3  ASP 110           HB3      ASP 110   7.010  -5.780   5.412
  940    H    MET 111           H        MET 111   8.961  -4.644   4.040
  941    HA   MET 111           HA       MET 111   8.613  -5.473   1.384
  942    HB2  MET 111           HB2      MET 111   8.186  -3.226   1.765
  943    HB3  MET 111           HB3      MET 111   9.644  -3.005   2.716
  944    HG2  MET 111           HG2      MET 111  11.002  -2.935   0.781
  945    HG3  MET 111           HG3      MET 111   9.679  -3.481  -0.248
  946    HE1  MET 111           HE1      MET 111  10.507  -0.714   2.414
  947    HE2  MET 111           HE2      MET 111   9.314   0.516   1.990
  948    HE3  MET 111           HE3      MET 111   8.783  -1.049   2.607
  949    H    LEU 112           H        LEU 112  11.549  -4.801   3.259
  950    HA   LEU 112           HA       LEU 112  13.347  -5.199   1.118
  951    HB2  LEU 112           HB2      LEU 112  13.660  -4.233   3.581
  952    HB3  LEU 112           HB3      LEU 112  14.192  -5.877   3.887
  953    HG   LEU 112           HG       LEU 112  15.828  -5.597   1.980
  954   HD11  LEU 112          HD11      LEU 112  14.993  -2.714   2.275
  955   HD12  LEU 112          HD12      LEU 112  16.375  -3.290   1.341
  956   HD13  LEU 112          HD13      LEU 112  14.739  -3.739   0.861
  957   HD21  LEU 112          HD21      LEU 112  17.409  -4.279   3.311
  958   HD22  LEU 112          HD22      LEU 112  16.088  -3.767   4.359
  959   HD23  LEU 112          HD23      LEU 112  16.547  -5.468   4.288
  960    H    MET 113           H        MET 113  11.927  -7.359   3.504
  961    HA   MET 113           HA       MET 113  13.301  -9.720   2.916
  962    HB2  MET 113           HB2      MET 113  11.712  -9.540   4.774
  963    HB3  MET 113           HB3      MET 113  10.386  -9.345   3.639
  964    HG2  MET 113           HG2      MET 113  10.902 -11.614   2.746
  965    HG3  MET 113           HG3      MET 113  12.074 -11.800   4.049
  966    HE1  MET 113           HE1      MET 113  10.718 -10.460   6.534
  967    HE2  MET 113           HE2      MET 113   9.850 -11.827   7.233
  968    HE3  MET 113           HE3      MET 113  11.470 -12.055   6.573
  969    H    THR 114           H        THR 114  10.341  -8.413   1.543
  970    HA   THR 114           HA       THR 114   9.863 -10.401  -0.365
  971    HB   THR 114           HB       THR 114   9.112  -7.477  -0.363
  972    HG1  THR 114           HG1      THR 114   8.263  -9.548   1.085
  973   HG21  THR 114          HG21      THR 114   8.970  -8.355  -2.636
  974   HG22  THR 114          HG22      THR 114   7.355  -8.105  -1.973
  975   HG23  THR 114          HG23      THR 114   8.030  -9.732  -2.060
  976    H    ILE 115           H        ILE 115  11.832  -7.440  -0.541
  977    HA   ILE 115           HA       ILE 115  12.207  -7.632  -3.375
  978    HB   ILE 115           HB       ILE 115  13.689  -5.961  -1.338
  979   HG12  ILE 115          HG12      ILE 115  11.458  -5.209  -3.241
  980   HG13  ILE 115          HG13      ILE 115  11.250  -5.497  -1.516
  981   HG21  ILE 115          HG21      ILE 115  15.014  -6.268  -3.348
  982   HG22  ILE 115          HG22      ILE 115  13.644  -5.792  -4.351
  983   HG23  ILE 115          HG23      ILE 115  14.399  -4.617  -3.273
  984   HD11  ILE 115          HD11      ILE 115  11.339  -3.125  -2.021
  985   HD12  ILE 115          HD12      ILE 115  12.708  -3.612  -1.022
  986   HD13  ILE 115          HD13      ILE 115  12.933  -3.329  -2.749
  987    H    CYS 116           H        CYS 116  14.223  -8.355  -0.518
  988    HA   CYS 116           HA       CYS 116  16.526  -9.064  -1.983
  989    HB2  CYS 116           HB2      CYS 116  17.339 -10.104   0.044
  990    HB3  CYS 116           HB3      CYS 116  16.544  -8.590   0.459
  991    HG   CYS 116           HG       CYS 116  14.128 -10.544   0.813
  992    H    ALA 117           H        ALA 117  13.624 -10.800  -1.184
  993    HA   ALA 117           HA       ALA 117  14.578 -13.399  -1.861
  994    HB1  ALA 117           HB1      ALA 117  12.638 -13.088  -0.413
  995    HB2  ALA 117           HB2      ALA 117  11.753 -12.349  -1.746
  996    HB3  ALA 117           HB3      ALA 117  12.221 -14.047  -1.833
  997    H    ARG 118           H        ARG 118  13.279 -10.704  -3.640
  998    HA   ARG 118           HA       ARG 118  12.600 -12.105  -6.012
  999    HB2  ARG 118           HB2      ARG 118  13.423  -9.194  -5.740
 1000    HB3  ARG 118           HB3      ARG 118  12.601  -9.921  -7.111
 1001    HG2  ARG 118           HG2      ARG 118  11.466  -9.708  -4.334
 1002    HG3  ARG 118           HG3      ARG 118  11.084  -8.641  -5.684
 1003    HD2  ARG 118           HD2      ARG 118  10.601 -11.613  -5.622
 1004    HD3  ARG 118           HD3      ARG 118   9.379 -10.376  -5.333
 1005    HE   ARG 118           HE       ARG 118  10.830 -10.467  -7.896
 1006   HH11  ARG 118          HH11      ARG 118   7.827 -10.668  -6.078
 1007   HH12  ARG 118          HH12      ARG 118   6.820 -10.545  -7.496
 1008   HH21  ARG 118          HH21      ARG 118   9.507 -10.341  -9.751
 1009   HH22  ARG 118          HH22      ARG 118   7.778 -10.382  -9.583
 1010    H    ILE 119           H        ILE 119  15.544 -10.477  -4.894
 1011    HA   ILE 119           HA       ILE 119  16.943 -10.956  -7.366
 1012    HB   ILE 119           HB       ILE 119  18.468 -10.300  -4.901
 1013   HG12  ILE 119          HG12      ILE 119  16.357  -9.005  -4.632
 1014   HG13  ILE 119          HG13      ILE 119  17.772  -7.984  -4.857
 1015   HG21  ILE 119          HG21      ILE 119  19.559 -10.387  -7.066
 1016   HG22  ILE 119          HG22      ILE 119  18.437  -9.183  -7.701
 1017   HG23  ILE 119          HG23      ILE 119  19.583  -8.741  -6.434
 1018   HD11  ILE 119          HD11      ILE 119  17.157  -7.652  -7.192
 1019   HD12  ILE 119          HD12      ILE 119  15.738  -8.674  -6.960
 1020   HD13  ILE 119          HD13      ILE 119  15.872  -7.143  -6.097
 1021    H    GLY 120           H        GLY 120  16.603 -12.504  -4.265
 1022    HA2  GLY 120           HA2      GLY 120  17.201 -14.770  -3.860
 1023    HA3  GLY 120           HA3      GLY 120  18.391 -14.655  -5.150
 1024    H    ILE 121           H        ILE 121  17.995 -12.246  -2.665
 1025    HA   ILE 121           HA       ILE 121  20.769 -12.546  -1.887
 1026    HB   ILE 121           HB       ILE 121  18.646 -10.609  -0.956
 1027   HG12  ILE 121          HG12      ILE 121  20.967 -10.216  -2.852
 1028   HG13  ILE 121          HG13      ILE 121  19.280 -10.372  -3.331
 1029   HG21  ILE 121          HG21      ILE 121  20.333 -10.900   0.758
 1030   HG22  ILE 121          HG22      ILE 121  21.609 -10.604  -0.423
 1031   HG23  ILE 121          HG23      ILE 121  20.488  -9.313   0.005
 1032   HD11  ILE 121          HD11      ILE 121  18.750  -8.319  -2.122
 1033   HD12  ILE 121          HD12      ILE 121  20.441  -8.162  -1.646
 1034   HD13  ILE 121          HD13      ILE 121  19.989  -8.053  -3.347
 1035    H    THR 122           H        THR 122  17.583 -13.172  -0.589
 1036    HA   THR 122           HA       THR 122  16.884 -14.603   1.026
 1037    HB   THR 122           HB       THR 122  19.795 -15.218   1.553
 1038    HG1  THR 122           HG1      THR 122  18.009 -16.801   0.007
 1039   HG21  THR 122          HG21      THR 122  18.934 -17.309   2.491
 1040   HG22  THR 122          HG22      THR 122  17.282 -16.768   2.193
 1041   HG23  THR 122          HG23      THR 122  18.292 -15.915   3.360
 1042    H    ASN 123           H        ASN 123  19.888 -13.088   2.276
 1043    HA   ASN 123           HA       ASN 123  18.533 -12.582   4.813
 1044    HB2  ASN 123           HB2      ASN 123  20.973 -13.439   4.541
 1045    HB3  ASN 123           HB3      ASN 123  21.354 -11.754   4.191
 1046   HD21  ASN 123          HD21      ASN 123  22.566 -11.423   6.023
 1047   HD22  ASN 123          HD22      ASN 123  21.879 -11.410   7.616
 1048    H    HIS 124           H        HIS 124  17.763 -10.641   5.424
 1049    HA   HIS 124           HA       HIS 124  18.423  -8.357   3.687
 1050    HB2  HIS 124           HB2      HIS 124  16.070  -7.607   3.813
 1051    HB3  HIS 124           HB3      HIS 124  16.244  -9.152   2.993
 1052    HD1  HIS 124           HD1      HIS 124  14.608  -7.530   5.879
 1053    HD2  HIS 124           HD2      HIS 124  15.299 -11.394   4.510
 1054    HE1  HIS 124           HE1      HIS 124  13.013  -8.995   7.150
 1055    HE2  HIS 124           HE2      HIS 124  13.663 -11.347   6.513
 1056    H    ASP 125           H        ASP 125  18.408  -9.547   6.779
 1057    HA   ASP 125           HA       ASP 125  17.499  -7.260   8.210
 1058    HB2  ASP 125           HB2      ASP 125  17.548  -9.583   9.135
 1059    HB3  ASP 125           HB3      ASP 125  19.305  -9.478   9.196
 1060    H    GLU 126           H        GLU 126  20.404  -8.067   6.617
 1061    HA   GLU 126           HA       GLU 126  22.003  -6.227   8.202
 1062    HB2  GLU 126           HB2      GLU 126  23.863  -7.000   6.676
 1063    HB3  GLU 126           HB3      GLU 126  23.154  -8.229   7.712
 1064    HG2  GLU 126           HG2      GLU 126  21.920  -9.150   5.887
 1065    HG3  GLU 126           HG3      GLU 126  22.404  -7.834   4.821
 1066    H    TYR 127           H        TYR 127  19.799  -5.572   6.111
 1067    HA   TYR 127           HA       TYR 127  21.396  -3.510   4.739
 1068    HB2  TYR 127           HB2      TYR 127  18.964  -4.937   3.649
 1069    HB3  TYR 127           HB3      TYR 127  19.816  -3.621   2.854
 1070    HD1  TYR 127           HD1      TYR 127  22.310  -4.044   2.307
 1071    HD2  TYR 127           HD2      TYR 127  19.525  -7.113   3.199
 1072    HE1  TYR 127           HE1      TYR 127  23.754  -5.667   1.180
 1073    HE2  TYR 127           HE2      TYR 127  20.949  -8.758   2.079
 1074    HH   TYR 127           HH       TYR 127  24.176  -8.069   1.162
 1075    H    SER 128           H        SER 128  20.480  -1.465   4.599
 1076    HA   SER 128           HA       SER 128  17.884  -1.099   5.939
 1077    HB2  SER 128           HB2      SER 128  20.141   0.897   5.585
 1078    HB3  SER 128           HB3      SER 128  18.609   1.208   6.403
 1079    HG   SER 128           HG       SER 128  19.247   0.073   8.090
 1080    H    LEU 129           H        LEU 129  16.802   1.048   4.978
 1081    HA   LEU 129           HA       LEU 129  17.105   0.805   2.055
 1082    HB2  LEU 129           HB2      LEU 129  14.892   0.089   3.381
 1083    HB3  LEU 129           HB3      LEU 129  14.546   1.797   3.204
 1084    HG   LEU 129           HG       LEU 129  15.250   0.081   0.831
 1085   HD11  LEU 129          HD11      LEU 129  12.507   0.606   1.960
 1086   HD12  LEU 129          HD12      LEU 129  12.860  -0.180   0.421
 1087   HD13  LEU 129          HD13      LEU 129  13.340  -0.948   1.935
 1088   HD21  LEU 129          HD21      LEU 129  15.373   2.494   0.508
 1089   HD22  LEU 129          HD22      LEU 129  14.027   1.801  -0.398
 1090   HD23  LEU 129          HD23      LEU 129  13.724   2.667   1.110
 1091    H    VAL 130           H        VAL 130  17.120   2.699   0.845
 1092    HA   VAL 130           HA       VAL 130  16.910   5.223   2.303
 1093    HB   VAL 130           HB       VAL 130  19.240   4.996   2.408
 1094   HG11  VAL 130          HG11      VAL 130  19.181   3.993  -0.422
 1095   HG12  VAL 130          HG12      VAL 130  20.636   4.266   0.538
 1096   HG13  VAL 130          HG13      VAL 130  19.472   3.037   1.031
 1097   HG21  VAL 130          HG21      VAL 130  18.735   6.489  -0.161
 1098   HG22  VAL 130          HG22      VAL 130  18.631   7.161   1.467
 1099   HG23  VAL 130          HG23      VAL 130  20.184   6.610   0.838
 1100    H    ARG 131           H        ARG 131  15.486   6.417   1.284
 1101    HA   ARG 131           HA       ARG 131  15.032   5.958  -1.581
 1102    HB2  ARG 131           HB2      ARG 131  13.407   7.523   0.425
 1103    HB3  ARG 131           HB3      ARG 131  12.967   7.240  -1.251
 1104    HG2  ARG 131           HG2      ARG 131  12.863   4.818  -0.762
 1105    HG3  ARG 131           HG3      ARG 131  13.167   5.192   0.941
 1106    HD2  ARG 131           HD2      ARG 131  10.759   4.945   0.461
 1107    HD3  ARG 131           HD3      ARG 131  11.186   6.568   1.029
 1108    HE   ARG 131           HE       ARG 131  11.001   7.340  -1.248
 1109   HH11  ARG 131          HH11      ARG 131   9.659   4.166  -0.645
 1110   HH12  ARG 131          HH12      ARG 131   8.579   4.233  -1.997
 1111   HH21  ARG 131          HH21      ARG 131   9.578   7.445  -3.015
 1112   HH22  ARG 131          HH22      ARG 131   8.518   6.107  -3.341
 1113    H    GLU 132           H        GLU 132  16.603   7.191  -2.588
 1114    HA   GLU 132           HA       GLU 132  16.871   9.961  -1.929
 1115    HB2  GLU 132           HB2      GLU 132  17.750   8.429  -4.393
 1116    HB3  GLU 132           HB3      GLU 132  18.145  10.113  -4.075
 1117    HG2  GLU 132           HG2      GLU 132  19.241   9.291  -1.938
 1118    HG3  GLU 132           HG3      GLU 132  19.079   7.668  -2.620
 1119    H    LEU 133           H        LEU 133  15.367  11.416  -2.355
 1120    HA   LEU 133           HA       LEU 133  13.378  10.733  -4.391
 1121    HB2  LEU 133           HB2      LEU 133  13.194  12.916  -2.333
 1122    HB3  LEU 133           HB3      LEU 133  11.905  12.294  -3.338
 1123    HG   LEU 133           HG       LEU 133  13.241  10.939  -1.015
 1124   HD11  LEU 133          HD11      LEU 133  11.517  12.532  -0.444
 1125   HD12  LEU 133          HD12      LEU 133  10.409  11.789  -1.600
 1126   HD13  LEU 133          HD13      LEU 133  10.924  10.894  -0.168
 1127   HD21  LEU 133          HD21      LEU 133  11.219   9.764  -2.919
 1128   HD22  LEU 133          HD22      LEU 133  12.919   9.304  -2.814
 1129   HD23  LEU 133          HD23      LEU 133  11.841   9.008  -1.452
 1130    H    MET 134           H        MET 134  12.247  12.950  -4.999
 1131    HA   MET 134           HA       MET 134  14.249  14.713  -6.251
 1132    HB2  MET 134           HB2      MET 134  12.288  15.146  -7.876
 1133    HB3  MET 134           HB3      MET 134  13.113  13.597  -8.011
 1134    HG2  MET 134           HG2      MET 134  10.792  13.153  -8.144
 1135    HG3  MET 134           HG3      MET 134  11.328  12.617  -6.560
 1136    HE1  MET 134           HE1      MET 134   7.871  13.728  -5.418
 1137    HE2  MET 134           HE2      MET 134   8.372  12.707  -6.768
 1138    HE3  MET 134           HE3      MET 134   9.189  12.575  -5.210
 1139    H    GLU 135           H        GLU 135  12.803  14.601  -3.637
 1140    HA   GLU 135           HA       GLU 135  10.525  16.100  -3.446
 1141    HB2  GLU 135           HB2      GLU 135  12.547  15.069  -1.656
 1142    HB3  GLU 135           HB3      GLU 135  11.887  16.599  -1.096
 1143    HG2  GLU 135           HG2      GLU 135  10.165  14.284  -1.902
 1144    HG3  GLU 135           HG3      GLU 135  10.745  14.535  -0.256
 1145    H    GLU 136           H        GLU 136  10.016  18.122  -3.645
 1146    HA   GLU 136           HA       GLU 136  12.023  20.203  -3.678
 1147    HB2  GLU 136           HB2      GLU 136  10.202  21.647  -4.350
 1148    HB3  GLU 136           HB3      GLU 136  10.130  20.154  -5.277
 1149    HG2  GLU 136           HG2      GLU 136   8.356  19.322  -3.845
 1150    HG3  GLU 136           HG3      GLU 136   8.437  20.792  -2.875
 1151    H    LYS 137           H        LYS 137  10.007  18.664  -1.430
 1152    HA   LYS 137           HA       LYS 137   9.918  20.975   0.358
 1153    HB2  LYS 137           HB2      LYS 137   8.544  18.290   0.509
 1154    HB3  LYS 137           HB3      LYS 137   8.382  19.560   1.716
 1155    HG2  LYS 137           HG2      LYS 137   7.343  21.019   0.122
 1156    HG3  LYS 137           HG3      LYS 137   7.637  19.868  -1.183
 1157    HD2  LYS 137           HD2      LYS 137   6.129  18.280  -0.191
 1158    HD3  LYS 137           HD3      LYS 137   5.934  19.296   1.240
 1159    HE2  LYS 137           HE2      LYS 137   5.181  20.157  -1.545
 1160    HE3  LYS 137           HE3      LYS 137   4.051  19.415  -0.414
 1161    HZ1  LYS 137           HZ1      LYS 137   5.590  21.836   0.317
 1162    HZ2  LYS 137           HZ2      LYS 137   4.157  21.240   1.005
 1163    HZ3  LYS 137           HZ3      LYS 137   4.129  21.945  -0.539
 1164    H    LYS 138           H        LYS 138  10.278  17.493   1.030
 1165    HA   LYS 138           HA       LYS 138  11.878  17.921   3.326
 1166    HB2  LYS 138           HB2      LYS 138  11.580  15.437   1.624
 1167    HB3  LYS 138           HB3      LYS 138  12.320  15.480   3.219
 1168    HG2  LYS 138           HG2      LYS 138  10.198  16.221   4.171
 1169    HG3  LYS 138           HG3      LYS 138   9.478  16.148   2.561
 1170    HD2  LYS 138           HD2      LYS 138  10.815  13.745   3.730
 1171    HD3  LYS 138           HD3      LYS 138   9.162  14.149   4.192
 1172    HE2  LYS 138           HE2      LYS 138  10.177  13.629   1.399
 1173    HE3  LYS 138           HE3      LYS 138   9.172  12.547   2.365
 1174    HZ1  LYS 138           HZ1      LYS 138   7.777  13.692   0.833
 1175    HZ2  LYS 138           HZ2      LYS 138   8.416  15.202   1.259
 1176    HZ3  LYS 138           HZ3      LYS 138   7.461  14.343   2.369
 1177    H    ASP 169           H        ASP 169  12.762  16.405   0.286
 1178    HA   ASP 169           HA       ASP 169  14.671  16.059  -0.789
 1179    HB2  ASP 169           HB2      ASP 169  14.800  18.449  -1.075
 1180    HB3  ASP 169           HB3      ASP 169  15.467  18.652   0.541
 1181    H    GLU 170           H        GLU 170  14.969  14.197   0.309
 1182    HA   GLU 170           HA       GLU 170  17.084  14.217   2.315
 1183    HB2  GLU 170           HB2      GLU 170  14.311  13.856   2.891
 1184    HB3  GLU 170           HB3      GLU 170  15.127  12.320   3.140
 1185    HG2  GLU 170           HG2      GLU 170  16.192  14.854   4.317
 1186    HG3  GLU 170           HG3      GLU 170  14.919  13.931   5.113
 1187    H    LEU 171           H        LEU 171  17.958  12.127   2.736
 1188    HA   LEU 171           HA       LEU 171  18.130  10.445   0.398
 1189    HB2  LEU 171           HB2      LEU 171  19.278   9.985   3.156
 1190    HB3  LEU 171           HB3      LEU 171  19.792   9.228   1.660
 1191    HG   LEU 171           HG       LEU 171  20.097  12.144   2.350
 1192   HD11  LEU 171          HD11      LEU 171  21.602  10.716   3.625
 1193   HD12  LEU 171          HD12      LEU 171  22.141   9.939   2.136
 1194   HD13  LEU 171          HD13      LEU 171  22.486  11.646   2.416
 1195   HD21  LEU 171          HD21      LEU 171  21.433  12.223   0.280
 1196   HD22  LEU 171          HD22      LEU 171  20.940  10.566  -0.071
 1197   HD23  LEU 171          HD23      LEU 171  19.732  11.854  -0.014
 1198    H    ASN 172           H        ASN 172  16.325  10.689   3.225
 1199    HA   ASN 172           HA       ASN 172  14.834   9.373   4.326
 1200    HB2  ASN 172           HB2      ASN 172  14.373   8.532   1.466
 1201    HB3  ASN 172           HB3      ASN 172  13.311   8.087   2.787
 1202   HD21  ASN 172          HD21      ASN 172  14.128  10.409   0.520
 1203   HD22  ASN 172          HD22      ASN 172  13.064  11.667   1.043
 1204    H    TRP 173           H        TRP 173  16.635   8.185   5.365
 1205    HA   TRP 173           HA       TRP 173  17.207   5.563   4.266
 1206    HB2  TRP 173           HB2      TRP 173  18.349   7.285   6.428
 1207    HB3  TRP 173           HB3      TRP 173  18.537   5.538   6.575
 1208    HD1  TRP 173           HD1      TRP 173  19.475   8.442   4.206
 1209    HE1  TRP 173           HE1      TRP 173  21.583   7.767   2.905
 1210    HE3  TRP 173           HE3      TRP 173  19.930   3.629   5.860
 1211    HZ2  TRP 173           HZ2      TRP 173  23.233   5.492   2.624
 1212    HZ3  TRP 173           HZ3      TRP 173  21.804   2.270   5.029
 1213    HH2  TRP 173           HH2      TRP 173  23.421   3.185   3.444
 1214    H    LEU 174           H        LEU 174  15.350   4.419   4.498
 1215    HA   LEU 174           HA       LEU 174  13.446   4.784   6.496
 1216    HB2  LEU 174           HB2      LEU 174  13.972   2.314   4.854
 1217    HB3  LEU 174           HB3      LEU 174  12.521   2.624   5.783
 1218    HG   LEU 174           HG       LEU 174  13.435   3.968   3.257
 1219   HD11  LEU 174          HD11      LEU 174  11.019   2.401   4.129
 1220   HD12  LEU 174          HD12      LEU 174  11.104   3.295   2.602
 1221   HD13  LEU 174          HD13      LEU 174  12.220   1.963   2.915
 1222   HD21  LEU 174          HD21      LEU 174  11.267   4.883   5.150
 1223   HD22  LEU 174          HD22      LEU 174  12.723   5.772   4.708
 1224   HD23  LEU 174          HD23      LEU 174  11.471   5.472   3.498
 1225    H    ASP 175           H        ASP 175  13.230   4.138   8.455
 1226    HA   ASP 175           HA       ASP 175  15.420   2.903   9.838
 1227    HB2  ASP 175           HB2      ASP 175  12.685   3.706  10.858
 1228    HB3  ASP 175           HB3      ASP 175  14.078   3.302  11.855
 1229    H    HIS 176           H        HIS 176  13.123   1.588   8.032
 1230    HA   HIS 176           HA       HIS 176  12.521  -0.555   7.678
 1231    HB2  HIS 176           HB2      HIS 176  14.290  -0.947  10.009
 1232    HB3  HIS 176           HB3      HIS 176  13.144  -2.239   9.645
 1233    HD1  HIS 176           HD1      HIS 176  13.252  -3.142   7.121
 1234    HD2  HIS 176           HD2      HIS 176  16.514  -0.968   8.446
 1235    HE1  HIS 176           HE1      HIS 176  15.054  -3.555   5.430
 1236    HE2  HIS 176           HE2      HIS 176  17.109  -2.512   6.458
 1237    H    GLY 177           H        GLY 177  11.617   1.188  10.434
 1238    HA2  GLY 177           HA2      GLY 177   9.368  -0.661  10.957
 1239    HA3  GLY 177           HA3      GLY 177  10.036   0.453  12.147
 1240    H    ARG 178           H        ARG 178   9.674   1.397   8.888
 1241    HA   ARG 178           HA       ARG 178   7.676   3.393   9.699
 1242    HB2  ARG 178           HB2      ARG 178   9.995   4.129   9.002
 1243    HB3  ARG 178           HB3      ARG 178   9.642   3.499   7.403
 1244    HG2  ARG 178           HG2      ARG 178   9.207   5.730   7.161
 1245    HG3  ARG 178           HG3      ARG 178   7.601   5.086   7.498
 1246    HD2  ARG 178           HD2      ARG 178   8.050   7.131   8.780
 1247    HD3  ARG 178           HD3      ARG 178   7.800   5.735   9.829
 1248    HE   ARG 178           HE       ARG 178  10.540   5.963   9.334
 1249   HH11  ARG 178          HH11      ARG 178   8.016   7.760  10.961
 1250   HH12  ARG 178          HH12      ARG 178   9.081   8.438  12.153
 1251   HH21  ARG 178          HH21      ARG 178  11.963   6.849  10.906
 1252   HH22  ARG 178          HH22      ARG 178  11.327   7.931  12.118
 1253    H    THR 179           H        THR 179   5.917   3.794   8.310
 1254    HA   THR 179           HA       THR 179   5.558   1.900   6.106
 1255    HB   THR 179           HB       THR 179   3.632   2.160   7.562
 1256    HG1  THR 179           HG1      THR 179   2.721   1.791   5.688
 1257   HG21  THR 179          HG21      THR 179   2.426   4.256   7.775
 1258   HG22  THR 179          HG22      THR 179   3.620   5.063   6.757
 1259   HG23  THR 179          HG23      THR 179   4.086   4.446   8.343
 1260    H    LEU 180           H        LEU 180   4.475   3.047   4.099
 1261    HA   LEU 180           HA       LEU 180   6.582   4.922   3.315
 1262    HB2  LEU 180           HB2      LEU 180   4.701   3.395   1.529
 1263    HB3  LEU 180           HB3      LEU 180   6.228   4.146   1.093
 1264    HG   LEU 180           HG       LEU 180   5.973   1.827   3.003
 1265   HD11  LEU 180          HD11      LEU 180   5.314   1.076   0.832
 1266   HD12  LEU 180          HD12      LEU 180   6.712   1.856   0.089
 1267   HD13  LEU 180          HD13      LEU 180   6.941   0.486   1.179
 1268   HD21  LEU 180          HD21      LEU 180   7.926   3.282   3.343
 1269   HD22  LEU 180          HD22      LEU 180   8.368   1.664   2.802
 1270   HD23  LEU 180          HD23      LEU 180   8.396   3.011   1.664
 1271    H    ARG 181           H        ARG 181   3.108   4.594   3.443
 1272    HA   ARG 181           HA       ARG 181   2.403   6.865   1.938
 1273    HB2  ARG 181           HB2      ARG 181   0.918   4.973   2.767
 1274    HB3  ARG 181           HB3      ARG 181   0.905   5.791   4.322
 1275    HG2  ARG 181           HG2      ARG 181   0.072   7.832   2.981
 1276    HG3  ARG 181           HG3      ARG 181  -0.311   6.644   1.731
 1277    HD2  ARG 181           HD2      ARG 181  -1.613   7.160   4.302
 1278    HD3  ARG 181           HD3      ARG 181  -2.257   6.434   2.832
 1279    HE   ARG 181           HE       ARG 181  -0.902   4.394   3.616
 1280   HH11  ARG 181          HH11      ARG 181  -2.609   6.636   5.686
 1281   HH12  ARG 181          HH12      ARG 181  -2.685   5.537   7.035
 1282   HH21  ARG 181          HH21      ARG 181  -1.005   2.938   5.365
 1283   HH22  ARG 181          HH22      ARG 181  -1.789   3.418   6.847
 1284    H    GLU 182           H        GLU 182   3.367   6.407   5.257
 1285    HA   GLU 182           HA       GLU 182   2.604   8.988   6.213
 1286    HB2  GLU 182           HB2      GLU 182   2.817   6.994   7.659
 1287    HB3  GLU 182           HB3      GLU 182   4.544   6.958   7.347
 1288    HG2  GLU 182           HG2      GLU 182   4.062   7.895   9.519
 1289    HG3  GLU 182           HG3      GLU 182   4.806   9.098   8.465
 1290    H    GLN 183           H        GLN 183   5.155   7.880   4.298
 1291    HA   GLN 183           HA       GLN 183   7.040   9.923   5.131
 1292    HB2  GLN 183           HB2      GLN 183   7.126   8.009   2.799
 1293    HB3  GLN 183           HB3      GLN 183   8.449   9.034   3.342
 1294    HG2  GLN 183           HG2      GLN 183   8.587   7.838   5.420
 1295    HG3  GLN 183           HG3      GLN 183   7.166   6.879   4.998
 1296   HE21  GLN 183          HE21      GLN 183   8.243   4.945   5.122
 1297   HE22  GLN 183          HE22      GLN 183   9.433   4.470   3.956
 1298    H    GLY 184           H        GLY 184   4.456   9.522   2.941
 1299    HA2  GLY 184           HA2      GLY 184   3.503  11.014   1.458
 1300    HA3  GLY 184           HA3      GLY 184   4.766  12.167   1.864
 1301    H    VAL 185           H        VAL 185   6.154   9.231   1.112
 1302    HA   VAL 185           HA       VAL 185   7.307  10.273  -1.274
 1303    HB   VAL 185           HB       VAL 185   8.444   8.066  -1.399
 1304   HG11  VAL 185          HG11      VAL 185   9.758   8.364   0.654
 1305   HG12  VAL 185          HG12      VAL 185   9.427   9.905  -0.138
 1306   HG13  VAL 185          HG13      VAL 185   8.509   9.434   1.291
 1307   HG21  VAL 185          HG21      VAL 185   6.856   7.495   1.102
 1308   HG22  VAL 185          HG22      VAL 185   6.659   6.696  -0.457
 1309   HG23  VAL 185          HG23      VAL 185   8.154   6.491   0.456
 1310    H    GLU 186           H        GLU 186   7.333   9.186  -3.348
 1311    HA   GLU 186           HA       GLU 186   4.658   8.190  -4.021
 1312    HB2  GLU 186           HB2      GLU 186   6.738   9.695  -5.602
 1313    HB3  GLU 186           HB3      GLU 186   5.385   8.895  -6.378
 1314    HG2  GLU 186           HG2      GLU 186   5.146  11.010  -4.274
 1315    HG3  GLU 186           HG3      GLU 186   5.016  11.288  -6.011
 1316    H    GLU 187           H        GLU 187   5.418   7.227  -6.592
 1317    HA   GLU 187           HA       GLU 187   6.948   4.850  -5.778
 1318    HB2  GLU 187           HB2      GLU 187   4.745   4.984  -7.837
 1319    HB3  GLU 187           HB3      GLU 187   5.544   3.541  -7.238
 1320    HG2  GLU 187           HG2      GLU 187   3.532   3.502  -6.123
 1321    HG3  GLU 187           HG3      GLU 187   4.603   4.255  -4.943
 1322    H    HIS 188           H        HIS 188   7.844   7.427  -7.131
 1323    HA   HIS 188           HA       HIS 188   8.810   6.183  -9.613
 1324    HB2  HIS 188           HB2      HIS 188   8.583   8.413 -10.759
 1325    HB3  HIS 188           HB3      HIS 188   7.081   7.574 -10.405
 1326    HD1  HIS 188           HD1      HIS 188   5.322   9.030  -9.502
 1327    HD2  HIS 188           HD2      HIS 188   9.117  10.494  -8.620
 1328    HE1  HIS 188           HE1      HIS 188   4.949  11.231  -8.359
 1329    HE2  HIS 188           HE2      HIS 188   7.246  12.172  -7.978
 1330    H    GLU 189           H        GLU 189   9.689   7.766  -6.788
 1331    HA   GLU 189           HA       GLU 189  12.154   8.872  -7.825
 1332    HB2  GLU 189           HB2      GLU 189  11.710   8.138  -4.943
 1333    HB3  GLU 189           HB3      GLU 189  12.699   9.428  -5.606
 1334    HG2  GLU 189           HG2      GLU 189  10.937  10.609  -4.760
 1335    HG3  GLU 189           HG3      GLU 189  10.412  10.372  -6.427
 1336    H    THR 190           H        THR 190  14.282   7.953  -7.539
 1337    HA   THR 190           HA       THR 190  14.296   5.084  -7.614
 1338    HB   THR 190           HB       THR 190  16.652   6.982  -7.562
 1339    HG1  THR 190           HG1      THR 190  15.013   7.057  -9.382
 1340   HG21  THR 190          HG21      THR 190  16.465   4.083  -8.404
 1341   HG22  THR 190          HG22      THR 190  17.254   4.680  -6.943
 1342   HG23  THR 190          HG23      THR 190  17.898   5.104  -8.530
 1343    H    LEU 191           H        LEU 191  14.423   3.765  -5.960
 1344    HA   LEU 191           HA       LEU 191  15.388   4.817  -3.380
 1345    HB2  LEU 191           HB2      LEU 191  13.715   2.334  -3.763
 1346    HB3  LEU 191           HB3      LEU 191  14.051   3.174  -2.266
 1347    HG   LEU 191           HG       LEU 191  11.897   3.828  -2.605
 1348   HD11  LEU 191          HD11      LEU 191  13.202   5.866  -2.499
 1349   HD12  LEU 191          HD12      LEU 191  13.374   5.867  -4.253
 1350   HD13  LEU 191          HD13      LEU 191  11.784   6.084  -3.523
 1351   HD21  LEU 191          HD21      LEU 191  11.566   2.599  -4.666
 1352   HD22  LEU 191          HD22      LEU 191  10.847   4.205  -4.775
 1353   HD23  LEU 191          HD23      LEU 191  12.382   3.870  -5.576
 1354    H    LEU 192           H        LEU 192  17.066   3.693  -2.312
 1355    HA   LEU 192           HA       LEU 192  18.344   1.669  -4.028
 1356    HB2  LEU 192           HB2      LEU 192  19.888   3.309  -2.075
 1357    HB3  LEU 192           HB3      LEU 192  20.403   2.615  -3.600
 1358    HG   LEU 192           HG       LEU 192  18.501   4.947  -3.449
 1359   HD11  LEU 192          HD11      LEU 192  21.499   5.013  -3.722
 1360   HD12  LEU 192          HD12      LEU 192  20.410   6.396  -3.856
 1361   HD13  LEU 192          HD13      LEU 192  20.574   5.547  -2.319
 1362   HD21  LEU 192          HD21      LEU 192  20.317   4.017  -5.671
 1363   HD22  LEU 192          HD22      LEU 192  18.592   3.658  -5.573
 1364   HD23  LEU 192          HD23      LEU 192  19.139   5.330  -5.732
 1365    H    LEU 193           H        LEU 193  18.917  -0.241  -3.117
 1366    HA   LEU 193           HA       LEU 193  18.459  -0.662  -0.286
 1367    HB2  LEU 193           HB2      LEU 193  17.754  -2.326  -1.981
 1368    HB3  LEU 193           HB3      LEU 193  19.423  -2.535  -2.461
 1369    HG   LEU 193           HG       LEU 193  18.593  -3.119   0.364
 1370   HD11  LEU 193          HD11      LEU 193  17.030  -4.340  -1.067
 1371   HD12  LEU 193          HD12      LEU 193  18.383  -4.995  -1.989
 1372   HD13  LEU 193          HD13      LEU 193  18.175  -5.436  -0.295
 1373   HD21  LEU 193          HD21      LEU 193  20.980  -3.068  -0.176
 1374   HD22  LEU 193          HD22      LEU 193  20.451  -4.702   0.225
 1375   HD23  LEU 193          HD23      LEU 193  20.718  -4.250  -1.459
 1376    H    ARG 194           H        ARG 194  20.036  -0.618   1.221
 1377    HA   ARG 194           HA       ARG 194  22.825  -0.513   0.285
 1378    HB2  ARG 194           HB2      ARG 194  21.487   1.239   2.348
 1379    HB3  ARG 194           HB3      ARG 194  23.230   1.124   2.158
 1380    HG2  ARG 194           HG2      ARG 194  21.355   1.988  -0.025
 1381    HG3  ARG 194           HG3      ARG 194  22.187   3.096   1.064
 1382    HD2  ARG 194           HD2      ARG 194  23.498   1.137  -0.817
 1383    HD3  ARG 194           HD3      ARG 194  23.358   2.880  -1.063
 1384    HE   ARG 194           HE       ARG 194  24.698   2.080   1.383
 1385   HH11  ARG 194          HH11      ARG 194  25.039   2.911  -2.003
 1386   HH12  ARG 194          HH12      ARG 194  26.691   3.435  -1.838
 1387   HH21  ARG 194          HH21      ARG 194  26.883   2.752   1.598
 1388   HH22  ARG 194          HH22      ARG 194  27.750   3.308   0.193
 1389    H    ARG 195           H        ARG 195  24.348  -1.468   1.583
 1390    HA   ARG 195           HA       ARG 195  23.319  -3.422   3.448
 1391    HB2  ARG 195           HB2      ARG 195  25.249  -3.721   1.745
 1392    HB3  ARG 195           HB3      ARG 195  26.232  -2.878   2.935
 1393    HG2  ARG 195           HG2      ARG 195  25.797  -4.577   4.576
 1394    HG3  ARG 195           HG3      ARG 195  24.671  -5.389   3.486
 1395    HD2  ARG 195           HD2      ARG 195  26.630  -5.593   1.876
 1396    HD3  ARG 195           HD3      ARG 195  27.654  -5.124   3.235
 1397    HE   ARG 195           HE       ARG 195  26.203  -7.171   4.245
 1398   HH11  ARG 195          HH11      ARG 195  28.127  -6.824   1.334
 1399   HH12  ARG 195          HH12      ARG 195  28.534  -8.519   1.257
 1400   HH21  ARG 195          HH21      ARG 195  26.707  -9.381   4.125
 1401   HH22  ARG 195          HH22      ARG 195  27.731  -9.969   2.845
 1402    H    LYS 196           H        LYS 196  23.113  -3.096   5.556
 1403    HA   LYS 196           HA       LYS 196  24.075  -0.620   6.706
 1404    HB2  LYS 196           HB2      LYS 196  21.783  -1.584   7.173
 1405    HB3  LYS 196           HB3      LYS 196  22.581  -2.848   8.100
 1406    HG2  LYS 196           HG2      LYS 196  23.588  -1.057   9.521
 1407    HG3  LYS 196           HG3      LYS 196  22.571   0.106   8.670
 1408    HD2  LYS 196           HD2      LYS 196  20.589  -1.276   9.373
 1409    HD3  LYS 196           HD3      LYS 196  21.690  -2.198  10.400
 1410    HE2  LYS 196           HE2      LYS 196  21.117   0.757  10.564
 1411    HE3  LYS 196           HE3      LYS 196  20.584  -0.479  11.699
 1412    HZ1  LYS 196           HZ1      LYS 196  22.533   0.800  12.462
 1413    HZ2  LYS 196           HZ2      LYS 196  23.434   0.184  11.165
 1414    HZ3  LYS 196           HZ3      LYS 196  22.841  -0.861  12.361
 1415    H    PHE 197           H        PHE 197  24.515  -4.097   7.207
 1416    HA   PHE 197           HA       PHE 197  26.784  -3.492   8.971
 1417    HB2  PHE 197           HB2      PHE 197  25.481  -6.187   8.591
 1418    HB3  PHE 197           HB3      PHE 197  26.610  -5.701   9.851
 1419    HD1  PHE 197           HD1      PHE 197  25.747  -3.554  11.200
 1420    HD2  PHE 197           HD2      PHE 197  23.278  -6.386   9.213
 1421    HE1  PHE 197           HE1      PHE 197  23.882  -2.943  12.679
 1422    HE2  PHE 197           HE2      PHE 197  21.398  -5.783  10.683
 1423    HZ   PHE 197           HZ       PHE 197  21.647  -4.103  12.372
 1424    H    PHE 198           H        PHE 198  28.787  -4.286   8.556
 1425    HA   PHE 198           HA       PHE 198  29.150  -5.506   5.897
 1426    HB2  PHE 198           HB2      PHE 198  30.965  -3.519   7.286
 1427    HB3  PHE 198           HB3      PHE 198  31.311  -4.314   5.755
 1428    HD1  PHE 198           HD1      PHE 198  29.929  -3.799   3.758
 1429    HD2  PHE 198           HD2      PHE 198  29.543  -1.632   7.399
 1430    HE1  PHE 198           HE1      PHE 198  28.766  -1.995   2.556
 1431    HE2  PHE 198           HE2      PHE 198  28.379   0.176   6.204
 1432    HZ   PHE 198           HZ       PHE 198  27.988  -0.014   3.766
 1433    H    TYR 199           H        TYR 199  28.728  -7.234   7.732
 1434    HA   TYR 199           HA       TYR 199  31.231  -8.037   8.993
 1435    HB2  TYR 199           HB2      TYR 199  29.884  -9.644  10.239
 1436    HB3  TYR 199           HB3      TYR 199  29.177  -8.038  10.360
 1437    HD1  TYR 199           HD1      TYR 199  27.360  -7.552   8.439
 1438    HD2  TYR 199           HD2      TYR 199  28.433 -11.405   9.879
 1439    HE1  TYR 199           HE1      TYR 199  25.205  -8.441   7.660
 1440    HE2  TYR 199           HE2      TYR 199  26.286 -12.302   9.105
 1441    HH   TYR 199           HH       TYR 199  23.951 -11.349   8.648
 1442    H    SER 200           H        SER 200  29.146  -8.832   6.368
 1443    HA   SER 200           HA       SER 200  29.307 -10.276   4.636
 1444    HB2  SER 200           HB2      SER 200  32.164 -10.534   5.540
 1445    HB3  SER 200           HB3      SER 200  31.539 -10.988   3.963
 1446    HG   SER 200           HG       SER 200  32.249  -8.995   3.585
 1447    H    ASP 201           H        ASP 201  28.374 -11.349   7.085
 1448    HA   ASP 201           HA       ASP 201  28.106 -13.222   8.346
 1449    HB2  ASP 201           HB2      ASP 201  27.041 -13.895   6.209
 1450    HB3  ASP 201           HB3      ASP 201  28.571 -14.592   5.689
 1451    H    GLN 202           H        GLN 202  30.384 -12.376   9.000
 1452    HA   GLN 202           HA       GLN 202  32.173 -14.704   8.974
 1453    HB2  GLN 202           HB2      GLN 202  33.026 -12.838   7.559
 1454    HB3  GLN 202           HB3      GLN 202  32.995 -11.791   8.968
 1455    HG2  GLN 202           HG2      GLN 202  34.681 -13.141  10.049
 1456    HG3  GLN 202           HG3      GLN 202  34.666 -14.279   8.699
 1457   HE21  GLN 202          HE21      GLN 202  35.531 -13.650   6.713
 1458   HE22  GLN 202          HE22      GLN 202  36.621 -12.303   6.578
  Start of MODEL    3
    1    H1   GLY  -5           H1       GLY  -5 -33.845  -5.292  -3.095
    2    H2   GLY  -5           H2       GLY  -5 -35.085  -4.241  -2.617
    3    H3   GLY  -5           H3       GLY  -5 -35.005  -4.777  -4.219
    4    HA2  GLY  -5           HA2      GLY  -5 -36.740  -5.917  -2.918
    5    HA3  GLY  -5           HA3      GLY  -5 -35.533  -7.003  -3.596
    6    H    ILE  -4           H        ILE  -4 -34.972  -8.544  -2.225
    7    HA   ILE  -4           HA       ILE  -4 -35.247  -8.145   0.636
    8    HB   ILE  -4           HB       ILE  -4 -34.097 -10.567  -0.763
    9   HG12  ILE  -4          HG12      ILE  -4 -36.977 -10.070   0.038
   10   HG13  ILE  -4          HG13      ILE  -4 -36.374 -10.036  -1.615
   11   HG21  ILE  -4          HG21      ILE  -4 -35.344 -10.193   1.962
   12   HG22  ILE  -4          HG22      ILE  -4 -34.802 -11.731   1.289
   13   HG23  ILE  -4          HG23      ILE  -4 -33.633 -10.451   1.620
   14   HD11  ILE  -4          HD11      ILE  -4 -35.765 -12.392  -1.440
   15   HD12  ILE  -4          HD12      ILE  -4 -36.370 -12.423   0.217
   16   HD13  ILE  -4          HD13      ILE  -4 -37.481 -12.137  -1.124
   17    H    ASP  -3           H        ASP  -3 -33.684  -6.394   0.633
   18    HA   ASP  -3           HA       ASP  -3 -30.891  -7.315   0.483
   19    HB2  ASP  -3           HB2      ASP  -3 -31.998  -4.514   0.172
   20    HB3  ASP  -3           HB3      ASP  -3 -30.290  -4.933   0.148
   21    HA   PRO  -2           HA       PRO  -2 -30.906  -6.432   4.875
   22    HB2  PRO  -2           HB2      PRO  -2 -28.145  -7.294   4.909
   23    HB3  PRO  -2           HB3      PRO  -2 -29.557  -8.127   5.561
   24    HG2  PRO  -2           HG2      PRO  -2 -28.123  -9.018   3.404
   25    HG3  PRO  -2           HG3      PRO  -2 -29.831  -9.398   3.681
   26    HD2  PRO  -2           HD2      PRO  -2 -28.611  -7.359   1.863
   27    HD3  PRO  -2           HD3      PRO  -2 -30.010  -8.422   1.593
   28    H    PHE  -1           H        PHE  -1 -30.473  -4.396   3.001
   29    HA   PHE  -1           HA       PHE  -1 -28.323  -2.849   4.247
   30    HB2  PHE  -1           HB2      PHE  -1 -29.046  -2.974   1.313
   31    HB3  PHE  -1           HB3      PHE  -1 -27.920  -1.828   2.011
   32    HD1  PHE  -1           HD1      PHE  -1 -25.792  -2.664   3.021
   33    HD2  PHE  -1           HD2      PHE  -1 -28.394  -5.150   0.757
   34    HE1  PHE  -1           HE1      PHE  -1 -23.960  -4.276   2.699
   35    HE2  PHE  -1           HE2      PHE  -1 -26.569  -6.771   0.429
   36    HZ   PHE  -1           HZ       PHE  -1 -24.349  -6.334   1.402
   37    H    THR   0           H        THR   0 -31.082  -2.933   4.876
   38    HA   THR   0           HA       THR   0 -32.619  -0.968   3.655
   39    HB   THR   0           HB       THR   0 -33.446  -1.072   6.321
   40    HG1  THR   0           HG1      THR   0 -33.461  -3.588   6.263
   41   HG21  THR   0          HG21      THR   0 -34.896  -1.129   4.347
   42   HG22  THR   0          HG22      THR   0 -35.241  -2.486   5.421
   43   HG23  THR   0          HG23      THR   0 -34.301  -2.742   3.951
   44    H    MET   1           H        MET   1 -31.711  -0.560   6.989
   45    HA   MET   1           HA       MET   1 -30.381   1.940   6.288
   46    HB2  MET   1           HB2      MET   1 -32.683   2.464   7.022
   47    HB3  MET   1           HB3      MET   1 -32.348   1.679   8.556
   48    HG2  MET   1           HG2      MET   1 -32.118   4.335   8.098
   49    HG3  MET   1           HG3      MET   1 -31.274   3.465   9.373
   50    HE1  MET   1           HE1      MET   1 -30.721   5.134   5.668
   51    HE2  MET   1           HE2      MET   1 -29.234   4.259   5.296
   52    HE3  MET   1           HE3      MET   1 -30.744   3.376   5.531
   53    H    VAL   2           H        VAL   2 -29.156  -0.332   6.654
   54    HA   VAL   2           HA       VAL   2 -27.304   0.547   8.696
   55    HB   VAL   2           HB       VAL   2 -26.713  -1.817   9.291
   56   HG11  VAL   2          HG11      VAL   2 -29.523  -0.996  10.007
   57   HG12  VAL   2          HG12      VAL   2 -28.551  -2.190  10.867
   58   HG13  VAL   2          HG13      VAL   2 -28.046  -0.500  10.835
   59   HG21  VAL   2          HG21      VAL   2 -28.351  -3.592   8.891
   60   HG22  VAL   2          HG22      VAL   2 -29.306  -2.479   7.909
   61   HG23  VAL   2          HG23      VAL   2 -27.687  -2.949   7.388
   62    H    ALA   3           H        ALA   3 -27.068   1.335   6.289
   63    HA   ALA   3           HA       ALA   3 -25.031  -0.376   5.071
   64    HB1  ALA   3           HB1      ALA   3 -27.110  -0.970   3.926
   65    HB2  ALA   3           HB2      ALA   3 -27.381   0.728   3.534
   66    HB3  ALA   3           HB3      ALA   3 -26.003  -0.126   2.843
   67    H    LEU   4           H        LEU   4 -23.504   0.688   3.954
   68    HA   LEU   4           HA       LEU   4 -23.520   3.613   4.305
   69    HB2  LEU   4           HB2      LEU   4 -21.325   1.569   4.442
   70    HB3  LEU   4           HB3      LEU   4 -20.958   3.239   4.068
   71    HG   LEU   4           HG       LEU   4 -21.827   3.958   6.227
   72   HD11  LEU   4          HD11      LEU   4 -22.554   2.395   7.909
   73   HD12  LEU   4          HD12      LEU   4 -23.596   2.303   6.489
   74   HD13  LEU   4          HD13      LEU   4 -22.380   1.058   6.771
   75   HD21  LEU   4          HD21      LEU   4 -19.487   3.209   6.014
   76   HD22  LEU   4          HD22      LEU   4 -20.147   2.995   7.636
   77   HD23  LEU   4          HD23      LEU   4 -19.988   1.606   6.559
   78    H    SER   5           H        SER   5 -23.271   4.840   2.557
   79    HA   SER   5           HA       SER   5 -23.154   3.458  -0.017
   80    HB2  SER   5           HB2      SER   5 -23.892   6.331   0.600
   81    HB3  SER   5           HB3      SER   5 -23.946   5.581  -0.990
   82    HG   SER   5           HG       SER   5 -25.520   5.003   1.288
   83    H    LEU   6           H        LEU   6 -21.152   3.105  -0.631
   84    HA   LEU   6           HA       LEU   6 -19.106   5.152  -0.090
   85    HB2  LEU   6           HB2      LEU   6 -19.167   2.214   0.182
   86    HB3  LEU   6           HB3      LEU   6 -17.705   2.859  -0.542
   87    HG   LEU   6           HG       LEU   6 -17.093   4.003   1.416
   88   HD11  LEU   6          HD11      LEU   6 -19.870   3.537   2.487
   89   HD12  LEU   6          HD12      LEU   6 -18.546   4.336   3.336
   90   HD13  LEU   6          HD13      LEU   6 -19.235   5.071   1.888
   91   HD21  LEU   6          HD21      LEU   6 -16.882   1.549   1.579
   92   HD22  LEU   6          HD22      LEU   6 -17.109   2.321   3.149
   93   HD23  LEU   6          HD23      LEU   6 -18.458   1.488   2.374
   94    H    LYS   7           H        LYS   7 -18.401   6.160  -1.847
   95    HA   LYS   7           HA       LYS   7 -18.740   5.141  -4.487
   96    HB2  LYS   7           HB2      LYS   7 -17.243   7.467  -3.325
   97    HB3  LYS   7           HB3      LYS   7 -16.995   7.005  -5.002
   98    HG2  LYS   7           HG2      LYS   7 -19.482   7.215  -5.310
   99    HG3  LYS   7           HG3      LYS   7 -19.532   7.945  -3.703
  100    HD2  LYS   7           HD2      LYS   7 -18.106   9.733  -4.393
  101    HD3  LYS   7           HD3      LYS   7 -17.787   8.951  -5.942
  102    HE2  LYS   7           HE2      LYS   7 -19.369  10.711  -6.294
  103    HE3  LYS   7           HE3      LYS   7 -20.195   9.164  -6.483
  104    HZ1  LYS   7           HZ1      LYS   7 -21.450  10.833  -5.166
  105    HZ2  LYS   7           HZ2      LYS   7 -20.236  10.776  -3.989
  106    HZ3  LYS   7           HZ3      LYS   7 -21.159   9.394  -4.319
  107    H    ILE   8           H        ILE   8 -17.649   3.496  -5.267
  108    HA   ILE   8           HA       ILE   8 -15.015   2.858  -4.208
  109    HB   ILE   8           HB       ILE   8 -16.733   1.370  -6.200
  110   HG12  ILE   8          HG12      ILE   8 -17.735   1.395  -3.974
  111   HG13  ILE   8          HG13      ILE   8 -17.119  -0.211  -4.343
  112   HG21  ILE   8          HG21      ILE   8 -15.178  -0.491  -5.848
  113   HG22  ILE   8          HG22      ILE   8 -14.375   0.917  -6.542
  114   HG23  ILE   8          HG23      ILE   8 -14.179   0.546  -4.830
  115   HD11  ILE   8          HD11      ILE   8 -16.649   0.417  -2.046
  116   HD12  ILE   8          HD12      ILE   8 -15.156   0.224  -2.966
  117   HD13  ILE   8          HD13      ILE   8 -15.766   1.838  -2.604
  118    H    SER   9           H        SER   9 -13.527   4.170  -5.078
  119    HA   SER   9           HA       SER   9 -13.517   4.566  -7.975
  120    HB2  SER   9           HB2      SER   9 -13.201   6.545  -6.483
  121    HB3  SER   9           HB3      SER   9 -11.725   5.809  -5.870
  122    HG   SER   9           HG       SER   9 -12.179   7.156  -8.210
  123    H    ILE  10           H        ILE  10 -12.212   3.399  -9.240
  124    HA   ILE  10           HA       ILE  10  -9.966   1.978  -7.967
  125    HB   ILE  10           HB       ILE  10 -11.717   0.878 -10.179
  126   HG12  ILE  10          HG12      ILE  10 -11.534   0.064  -7.265
  127   HG13  ILE  10          HG13      ILE  10 -12.867   0.957  -7.985
  128   HG21  ILE  10          HG21      ILE  10 -10.467  -1.203  -9.828
  129   HG22  ILE  10          HG22      ILE  10  -9.408   0.115 -10.326
  130   HG23  ILE  10          HG23      ILE  10  -9.453  -0.389  -8.637
  131   HD11  ILE  10          HD11      ILE  10 -13.437  -1.378  -7.702
  132   HD12  ILE  10          HD12      ILE  10 -13.367  -0.964  -9.416
  133   HD13  ILE  10          HD13      ILE  10 -12.040  -1.855  -8.670
  134    H    GLY  11           H        GLY  11  -8.490   3.518  -8.622
  135    HA2  GLY  11           HA2      GLY  11  -6.854   4.283 -10.068
  136    HA3  GLY  11           HA3      GLY  11  -7.588   3.326 -11.348
  137    H    ASN  12           H        ASN  12  -9.591   4.181 -12.299
  138    HA   ASN  12           HA       ASN  12  -9.779   7.112 -12.140
  139    HB2  ASN  12           HB2      ASN  12 -10.002   7.267 -14.560
  140    HB3  ASN  12           HB3      ASN  12  -8.476   6.493 -14.147
  141   HD21  ASN  12          HD21      ASN  12 -10.106   6.404 -16.593
  142   HD22  ASN  12          HD22      ASN  12 -10.409   4.726 -16.889
  143    H    VAL  13           H        VAL  13 -11.326   4.063 -12.393
  144    HA   VAL  13           HA       VAL  13 -13.885   5.142 -13.212
  145    HB   VAL  13           HB       VAL  13 -13.136   2.904 -13.979
  146   HG11  VAL  13          HG11      VAL  13 -13.221   0.997 -12.437
  147   HG12  VAL  13          HG12      VAL  13 -11.962   2.154 -12.003
  148   HG13  VAL  13          HG13      VAL  13 -13.473   2.111 -11.093
  149   HG21  VAL  13          HG21      VAL  13 -15.246   1.716 -13.568
  150   HG22  VAL  13          HG22      VAL  13 -15.644   2.882 -12.307
  151   HG23  VAL  13          HG23      VAL  13 -15.504   3.410 -13.984
  152    H    VAL  14           H        VAL  14 -15.783   5.081 -11.913
  153    HA   VAL  14           HA       VAL  14 -15.388   4.645  -9.048
  154    HB   VAL  14           HB       VAL  14 -15.085   7.004  -9.163
  155   HG11  VAL  14          HG11      VAL  14 -17.592   7.136 -10.824
  156   HG12  VAL  14          HG12      VAL  14 -16.677   8.523 -10.230
  157   HG13  VAL  14          HG13      VAL  14 -15.945   7.414 -11.388
  158   HG21  VAL  14          HG21      VAL  14 -17.038   7.873  -7.919
  159   HG22  VAL  14          HG22      VAL  14 -17.928   6.411  -8.344
  160   HG23  VAL  14          HG23      VAL  14 -16.492   6.302  -7.325
  161    H    LYS  15           H        LYS  15 -16.895   3.397  -8.270
  162    HA   LYS  15           HA       LYS  15 -19.516   3.281  -9.606
  163    HB2  LYS  15           HB2      LYS  15 -17.851   0.963  -8.613
  164    HB3  LYS  15           HB3      LYS  15 -19.542   0.827  -9.074
  165    HG2  LYS  15           HG2      LYS  15 -17.280   1.665 -10.880
  166    HG3  LYS  15           HG3      LYS  15 -18.070   0.088 -10.865
  167    HD2  LYS  15           HD2      LYS  15 -20.196   1.159 -11.474
  168    HD3  LYS  15           HD3      LYS  15 -19.388   2.727 -11.511
  169    HE2  LYS  15           HE2      LYS  15 -19.545   1.953 -13.758
  170    HE3  LYS  15           HE3      LYS  15 -17.861   1.800 -13.264
  171    HZ1  LYS  15           HZ1      LYS  15 -18.261  -0.208 -14.284
  172    HZ2  LYS  15           HZ2      LYS  15 -19.859  -0.312 -13.732
  173    HZ3  LYS  15           HZ3      LYS  15 -18.579  -0.605 -12.664
  174    H    THR  16           H        THR  16 -21.284   2.731  -8.231
  175    HA   THR  16           HA       THR  16 -20.764   3.707  -5.511
  176    HB   THR  16           HB       THR  16 -23.509   3.402  -6.695
  177    HG1  THR  16           HG1      THR  16 -22.032   5.807  -6.981
  178   HG21  THR  16          HG21      THR  16 -22.289   5.349  -4.731
  179   HG22  THR  16          HG22      THR  16 -23.317   3.975  -4.326
  180   HG23  THR  16          HG23      THR  16 -23.976   5.330  -5.241
  181    H    MET  17           H        MET  17 -20.773   2.265  -3.879
  182    HA   MET  17           HA       MET  17 -22.482  -0.096  -4.125
  183    HB2  MET  17           HB2      MET  17 -19.544  -0.055  -3.595
  184    HB3  MET  17           HB3      MET  17 -20.525  -1.215  -2.716
  185    HG2  MET  17           HG2      MET  17 -21.419  -1.907  -5.012
  186    HG3  MET  17           HG3      MET  17 -20.040  -1.019  -5.660
  187    HE1  MET  17           HE1      MET  17 -21.167  -4.132  -3.458
  188    HE2  MET  17           HE2      MET  17 -19.618  -4.581  -2.747
  189    HE3  MET  17           HE3      MET  17 -20.358  -3.032  -2.339
  190    H    GLN  18           H        GLN  18 -23.248  -0.904  -2.181
  191    HA   GLN  18           HA       GLN  18 -22.764   0.837   0.139
  192    HB2  GLN  18           HB2      GLN  18 -25.265  -0.551  -0.787
  193    HB3  GLN  18           HB3      GLN  18 -25.070  -0.011   0.878
  194    HG2  GLN  18           HG2      GLN  18 -25.148   2.194   0.329
  195    HG3  GLN  18           HG3      GLN  18 -24.494   1.929  -1.285
  196   HE21  GLN  18          HE21      GLN  18 -26.031   3.151  -2.260
  197   HE22  GLN  18          HE22      GLN  18 -27.670   2.644  -2.425
  198    H    PHE  19           H        PHE  19 -22.262  -0.077   2.062
  199    HA   PHE  19           HA       PHE  19 -21.917  -2.992   2.114
  200    HB2  PHE  19           HB2      PHE  19 -19.962  -0.900   3.124
  201    HB3  PHE  19           HB3      PHE  19 -19.799  -2.635   3.354
  202    HD1  PHE  19           HD1      PHE  19 -19.579   0.116   0.964
  203    HD2  PHE  19           HD2      PHE  19 -19.056  -4.061   1.567
  204    HE1  PHE  19           HE1      PHE  19 -18.340  -0.032  -1.160
  205    HE2  PHE  19           HE2      PHE  19 -17.816  -4.220  -0.550
  206    HZ   PHE  19           HZ       PHE  19 -17.384  -2.202  -1.874
  207    H    GLU  20           H        GLU  20 -21.898  -3.813   4.352
  208    HA   GLU  20           HA       GLU  20 -23.689  -2.326   6.040
  209    HB2  GLU  20           HB2      GLU  20 -22.166  -4.857   6.684
  210    HB3  GLU  20           HB3      GLU  20 -23.532  -4.196   7.570
  211    HG2  GLU  20           HG2      GLU  20 -25.011  -4.638   5.739
  212    HG3  GLU  20           HG3      GLU  20 -23.662  -5.145   4.720
  213    HA   PRO  21           HA       PRO  21 -20.725  -0.053   8.384
  214    HB2  PRO  21           HB2      PRO  21 -21.946  -0.277  10.880
  215    HB3  PRO  21           HB3      PRO  21 -22.324   0.938   9.659
  216    HG2  PRO  21           HG2      PRO  21 -23.762  -1.567  10.328
  217    HG3  PRO  21           HG3      PRO  21 -24.396  -0.003   9.769
  218    HD2  PRO  21           HD2      PRO  21 -24.190  -2.152   8.153
  219    HD3  PRO  21           HD3      PRO  21 -24.015  -0.486   7.571
  220    H    SER  22           H        SER  22 -21.781  -3.210   9.490
  221    HA   SER  22           HA       SER  22 -19.403  -3.538  11.135
  222    HB2  SER  22           HB2      SER  22 -21.635  -5.518  10.648
  223    HB3  SER  22           HB3      SER  22 -20.446  -5.540  11.951
  224    HG   SER  22           HG       SER  22 -21.371  -3.552  12.699
  225    H    THR  23           H        THR  23 -19.868  -3.722   7.950
  226    HA   THR  23           HA       THR  23 -18.765  -6.264   7.326
  227    HB   THR  23           HB       THR  23 -18.984  -3.778   5.624
  228    HG1  THR  23           HG1      THR  23 -20.546  -6.165   5.545
  229   HG21  THR  23          HG21      THR  23 -17.232  -5.249   4.807
  230   HG22  THR  23          HG22      THR  23 -18.624  -5.263   3.724
  231   HG23  THR  23          HG23      THR  23 -18.352  -6.610   4.831
  232    H    MET  24           H        MET  24 -16.873  -6.706   7.996
  233    HA   MET  24           HA       MET  24 -14.691  -4.987   8.379
  234    HB2  MET  24           HB2      MET  24 -15.215  -7.699   8.729
  235    HB3  MET  24           HB3      MET  24 -13.913  -7.657   7.549
  236    HG2  MET  24           HG2      MET  24 -12.761  -7.744   9.511
  237    HG3  MET  24           HG3      MET  24 -12.821  -6.005   9.217
  238    HE1  MET  24           HE1      MET  24 -12.238  -7.490  12.016
  239    HE2  MET  24           HE2      MET  24 -12.180  -5.736  11.840
  240    HE3  MET  24           HE3      MET  24 -13.133  -6.457  13.136
  241    H    VAL  25           H        VAL  25 -12.874  -4.598   7.081
  242    HA   VAL  25           HA       VAL  25 -12.975  -4.235   4.403
  243    HB   VAL  25           HB       VAL  25 -10.608  -5.078   6.058
  244   HG11  VAL  25          HG11      VAL  25 -10.605  -4.168   3.178
  245   HG12  VAL  25          HG12      VAL  25  -9.175  -4.369   4.192
  246   HG13  VAL  25          HG13      VAL  25 -10.156  -5.770   3.761
  247   HG21  VAL  25          HG21      VAL  25 -11.472  -2.456   4.857
  248   HG22  VAL  25          HG22      VAL  25 -11.592  -2.916   6.556
  249   HG23  VAL  25          HG23      VAL  25 -10.009  -2.721   5.803
  250    H    TYR  26           H        TYR  26 -12.095  -7.302   5.991
  251    HA   TYR  26           HA       TYR  26 -11.560  -8.630   3.577
  252    HB2  TYR  26           HB2      TYR  26 -11.670 -10.747   4.834
  253    HB3  TYR  26           HB3      TYR  26 -10.621  -9.550   5.567
  254    HD1  TYR  26           HD1      TYR  26 -14.098 -10.908   5.826
  255    HD2  TYR  26           HD2      TYR  26 -10.788  -9.171   7.858
  256    HE1  TYR  26           HE1      TYR  26 -15.278 -11.168   7.961
  257    HE2  TYR  26           HE2      TYR  26 -11.957  -9.447  10.001
  258    HH   TYR  26           HH       TYR  26 -14.810 -11.321  10.316
  259    H    ASP  27           H        ASP  27 -14.574  -8.077   5.272
  260    HA   ASP  27           HA       ASP  27 -16.052  -9.954   3.657
  261    HB2  ASP  27           HB2      ASP  27 -17.009  -7.678   5.409
  262    HB3  ASP  27           HB3      ASP  27 -18.071  -8.809   4.584
  263    H    ALA  28           H        ALA  28 -15.559  -6.450   3.733
  264    HA   ALA  28           HA       ALA  28 -17.204  -5.721   1.623
  265    HB1  ALA  28           HB1      ALA  28 -14.565  -4.487   2.400
  266    HB2  ALA  28           HB2      ALA  28 -15.829  -3.719   1.440
  267    HB3  ALA  28           HB3      ALA  28 -16.128  -4.121   3.131
  268    H    CYS  29           H        CYS  29 -13.760  -6.576   1.546
  269    HA   CYS  29           HA       CYS  29 -13.317  -6.218  -1.167
  270    HB2  CYS  29           HB2      CYS  29 -11.506  -6.552   0.429
  271    HB3  CYS  29           HB3      CYS  29 -12.017  -8.215   0.693
  272    HG   CYS  29           HG       CYS  29 -10.868  -7.014  -2.308
  273    H    ARG  30           H        ARG  30 -14.819  -8.955   0.464
  274    HA   ARG  30           HA       ARG  30 -14.495 -10.707  -1.784
  275    HB2  ARG  30           HB2      ARG  30 -15.638 -12.340  -0.568
  276    HB3  ARG  30           HB3      ARG  30 -14.817 -11.403   0.669
  277    HG2  ARG  30           HG2      ARG  30 -16.939 -10.177   1.079
  278    HG3  ARG  30           HG3      ARG  30 -17.726 -11.255  -0.082
  279    HD2  ARG  30           HD2      ARG  30 -17.079 -13.187   1.298
  280    HD3  ARG  30           HD3      ARG  30 -16.352 -12.089   2.470
  281    HE   ARG  30           HE       ARG  30 -19.100 -11.482   1.924
  282   HH11  ARG  30          HH11      ARG  30 -16.986 -13.572   3.764
  283   HH12  ARG  30          HH12      ARG  30 -18.118 -13.798   5.059
  284   HH21  ARG  30          HH21      ARG  30 -20.597 -11.764   3.625
  285   HH22  ARG  30          HH22      ARG  30 -20.189 -12.794   4.967
  286    H    MET  31           H        MET  31 -17.009  -8.553  -0.629
  287    HA   MET  31           HA       MET  31 -18.958  -9.441  -2.528
  288    HB2  MET  31           HB2      MET  31 -18.900  -6.953  -0.822
  289    HB3  MET  31           HB3      MET  31 -20.296  -7.581  -1.687
  290    HG2  MET  31           HG2      MET  31 -20.261  -9.585  -0.325
  291    HG3  MET  31           HG3      MET  31 -18.834  -9.000   0.519
  292    HE1  MET  31           HE1      MET  31 -20.113  -5.947   2.469
  293    HE2  MET  31           HE2      MET  31 -18.739  -6.957   2.005
  294    HE3  MET  31           HE3      MET  31 -19.489  -5.883   0.819
  295    H    ILE  32           H        ILE  32 -16.939  -6.526  -2.205
  296    HA   ILE  32           HA       ILE  32 -17.861  -5.171  -4.450
  297    HB   ILE  32           HB       ILE  32 -16.423  -4.106  -2.808
  298   HG12  ILE  32          HG12      ILE  32 -15.233  -4.108  -5.587
  299   HG13  ILE  32          HG13      ILE  32 -16.586  -3.122  -5.039
  300   HG21  ILE  32          HG21      ILE  32 -14.894  -5.921  -2.322
  301   HG22  ILE  32          HG22      ILE  32 -14.208  -5.805  -3.942
  302   HG23  ILE  32          HG23      ILE  32 -13.999  -4.479  -2.800
  303   HD11  ILE  32          HD11      ILE  32 -14.530  -1.844  -5.129
  304   HD12  ILE  32          HD12      ILE  32 -15.120  -1.979  -3.473
  305   HD13  ILE  32          HD13      ILE  32 -13.768  -2.974  -4.010
  306    H    ARG  33           H        ARG  33 -15.167  -7.485  -4.248
  307    HA   ARG  33           HA       ARG  33 -14.488  -7.525  -6.953
  308    HB2  ARG  33           HB2      ARG  33 -14.321  -9.637  -4.818
  309    HB3  ARG  33           HB3      ARG  33 -13.746  -9.926  -6.454
  310    HG2  ARG  33           HG2      ARG  33 -12.212  -8.011  -6.224
  311    HG3  ARG  33           HG3      ARG  33 -12.757  -7.805  -4.557
  312    HD2  ARG  33           HD2      ARG  33 -11.515 -10.331  -5.637
  313    HD3  ARG  33           HD3      ARG  33 -10.616  -9.067  -4.801
  314    HE   ARG  33           HE       ARG  33 -11.925  -9.554  -2.820
  315   HH11  ARG  33          HH11      ARG  33 -12.123 -11.906  -5.410
  316   HH12  ARG  33          HH12      ARG  33 -12.554 -13.220  -4.355
  317   HH21  ARG  33          HH21      ARG  33 -12.479 -11.287  -1.421
  318   HH22  ARG  33          HH22      ARG  33 -12.782 -12.862  -2.091
  319    H    GLU  34           H        GLU  34 -17.163  -8.899  -5.300
  320    HA   GLU  34           HA       GLU  34 -17.905 -10.747  -7.389
  321    HB2  GLU  34           HB2      GLU  34 -18.501 -11.111  -4.993
  322    HB3  GLU  34           HB3      GLU  34 -19.577  -9.724  -5.086
  323    HG2  GLU  34           HG2      GLU  34 -20.816 -11.791  -5.289
  324    HG3  GLU  34           HG3      GLU  34 -20.903 -10.863  -6.786
  325    H    ARG  35           H        ARG  35 -18.903  -7.543  -6.289
  326    HA   ARG  35           HA       ARG  35 -21.082  -7.322  -8.146
  327    HB2  ARG  35           HB2      ARG  35 -19.786  -4.971  -6.811
  328    HB3  ARG  35           HB3      ARG  35 -21.480  -5.225  -7.196
  329    HG2  ARG  35           HG2      ARG  35 -20.070  -6.872  -5.133
  330    HG3  ARG  35           HG3      ARG  35 -20.774  -5.302  -4.753
  331    HD2  ARG  35           HD2      ARG  35 -22.240  -7.688  -5.869
  332    HD3  ARG  35           HD3      ARG  35 -22.287  -7.106  -4.199
  333    HE   ARG  35           HE       ARG  35 -23.017  -4.968  -5.814
  334   HH11  ARG  35          HH11      ARG  35 -24.279  -8.173  -5.092
  335   HH12  ARG  35          HH12      ARG  35 -25.937  -7.700  -5.358
  336   HH21  ARG  35          HH21      ARG  35 -25.169  -4.366  -6.138
  337   HH22  ARG  35          HH22      ARG  35 -26.444  -5.531  -5.932
  338    H    ILE  36           H        ILE  36 -17.895  -5.789  -7.834
  339    HA   ILE  36           HA       ILE  36 -18.265  -4.550 -10.469
  340    HB   ILE  36           HB       ILE  36 -16.174  -3.850  -8.403
  341   HG12  ILE  36          HG12      ILE  36 -18.865  -2.537  -8.857
  342   HG13  ILE  36          HG13      ILE  36 -18.457  -3.552  -7.478
  343   HG21  ILE  36          HG21      ILE  36 -16.049  -1.738  -9.635
  344   HG22  ILE  36          HG22      ILE  36 -15.684  -3.114 -10.676
  345   HG23  ILE  36          HG23      ILE  36 -17.261  -2.329 -10.770
  346   HD11  ILE  36          HD11      ILE  36 -16.772  -1.938  -6.782
  347   HD12  ILE  36          HD12      ILE  36 -17.161  -0.926  -8.173
  348   HD13  ILE  36          HD13      ILE  36 -18.364  -1.191  -6.911
  349    HA   PRO  37           HA       PRO  37 -15.253  -7.640 -11.824
  350    HB2  PRO  37           HB2      PRO  37 -15.733  -6.423 -14.454
  351    HB3  PRO  37           HB3      PRO  37 -15.991  -8.088 -13.927
  352    HG2  PRO  37           HG2      PRO  37 -18.044  -6.427 -14.440
  353    HG3  PRO  37           HG3      PRO  37 -18.125  -7.658 -13.166
  354    HD2  PRO  37           HD2      PRO  37 -17.608  -4.714 -12.927
  355    HD3  PRO  37           HD3      PRO  37 -18.630  -5.762 -11.918
  356    H    GLU  38           H        GLU  38 -15.201  -4.266 -11.860
  357    HA   GLU  38           HA       GLU  38 -12.659  -3.965 -13.202
  358    HB2  GLU  38           HB2      GLU  38 -14.396  -2.019 -11.679
  359    HB3  GLU  38           HB3      GLU  38 -12.878  -1.579 -12.450
  360    HG2  GLU  38           HG2      GLU  38 -15.335  -2.639 -13.825
  361    HG3  GLU  38           HG3      GLU  38 -14.749  -0.975 -13.850
  362    H    ALA  39           H        ALA  39 -13.641  -4.902 -10.145
  363    HA   ALA  39           HA       ALA  39 -11.709  -3.516  -8.567
  364    HB1  ALA  39           HB1      ALA  39 -12.429  -4.961  -6.756
  365    HB2  ALA  39           HB2      ALA  39 -13.824  -4.338  -7.635
  366    HB3  ALA  39           HB3      ALA  39 -13.286  -5.998  -7.897
  367    H    LEU  40           H        LEU  40 -11.897  -6.787  -9.927
  368    HA   LEU  40           HA       LEU  40  -9.296  -7.356  -8.774
  369    HB2  LEU  40           HB2      LEU  40  -9.764  -9.704  -9.776
  370    HB3  LEU  40           HB3      LEU  40 -10.539  -9.190  -8.296
  371    HG   LEU  40           HG       LEU  40 -11.985 -10.474  -9.906
  372   HD11  LEU  40          HD11      LEU  40 -12.936  -9.125  -8.132
  373   HD12  LEU  40          HD12      LEU  40 -12.917  -7.709  -9.184
  374   HD13  LEU  40          HD13      LEU  40 -13.948  -9.087  -9.577
  375   HD21  LEU  40          HD21      LEU  40 -11.270  -9.553 -12.002
  376   HD22  LEU  40          HD22      LEU  40 -12.984  -9.206 -11.774
  377   HD23  LEU  40          HD23      LEU  40 -11.783  -7.938 -11.511
  378    H    ALA  41           H        ALA  41  -8.472  -5.693 -10.327
  379    HA   ALA  41           HA       ALA  41  -8.033  -6.570 -13.024
  380    HB1  ALA  41           HB1      ALA  41  -8.118  -4.191 -12.475
  381    HB2  ALA  41           HB2      ALA  41  -6.695  -4.373 -11.447
  382    HB3  ALA  41           HB3      ALA  41  -6.561  -4.619 -13.187
  383    H    GLY  42           H        GLY  42  -7.246  -8.287 -10.769
  384    HA2  GLY  42           HA2      GLY  42  -5.038  -9.597 -11.607
  385    HA3  GLY  42           HA3      GLY  42  -4.380  -8.311 -10.596
  386    HA   PRO  43           HA       PRO  43  -5.260 -11.963  -7.782
  387    HB2  PRO  43           HB2      PRO  43  -3.044 -10.479  -6.445
  388    HB3  PRO  43           HB3      PRO  43  -3.288 -12.224  -6.599
  389    HG2  PRO  43           HG2      PRO  43  -1.493 -10.999  -8.115
  390    HG3  PRO  43           HG3      PRO  43  -2.544 -12.241  -8.824
  391    HD2  PRO  43           HD2      PRO  43  -2.711  -9.259  -9.048
  392    HD3  PRO  43           HD3      PRO  43  -3.011 -10.500 -10.283
  393    HA   PRO  44           HA       PRO  44  -7.829  -9.373  -5.112
  394    HB2  PRO  44           HB2      PRO  44  -8.198 -11.439  -3.283
  395    HB3  PRO  44           HB3      PRO  44  -9.228 -11.114  -4.680
  396    HG2  PRO  44           HG2      PRO  44  -6.976 -13.066  -4.395
  397    HG3  PRO  44           HG3      PRO  44  -8.542 -13.269  -5.210
  398    HD2  PRO  44           HD2      PRO  44  -6.329 -12.828  -6.617
  399    HD3  PRO  44           HD3      PRO  44  -7.859 -12.038  -7.074
  400    H    ASN  45           H        ASN  45  -5.048 -11.313  -4.169
  401    HA   ASN  45           HA       ASN  45  -4.758 -10.104  -1.583
  402    HB2  ASN  45           HB2      ASN  45  -2.857 -11.456  -1.306
  403    HB3  ASN  45           HB3      ASN  45  -3.886 -12.406  -2.373
  404   HD21  ASN  45          HD21      ASN  45  -3.246 -12.873  -4.393
  405   HD22  ASN  45          HD22      ASN  45  -1.674 -12.478  -5.020
  406    H    ASP  46           H        ASP  46  -4.183  -9.050  -4.680
  407    HA   ASP  46           HA       ASP  46  -1.904  -7.353  -3.988
  408    HB2  ASP  46           HB2      ASP  46  -1.670  -8.581  -6.042
  409    HB3  ASP  46           HB3      ASP  46  -3.244  -8.045  -6.614
  410    H    PHE  47           H        PHE  47  -5.263  -7.258  -4.071
  411    HA   PHE  47           HA       PHE  47  -5.257  -4.322  -4.295
  412    HB2  PHE  47           HB2      PHE  47  -7.320  -6.280  -5.300
  413    HB3  PHE  47           HB3      PHE  47  -7.627  -4.554  -5.144
  414    HD1  PHE  47           HD1      PHE  47  -6.208  -2.953  -6.481
  415    HD2  PHE  47           HD2      PHE  47  -6.218  -7.150  -7.163
  416    HE1  PHE  47           HE1      PHE  47  -5.256  -2.589  -8.717
  417    HE2  PHE  47           HE2      PHE  47  -5.261  -6.795  -9.400
  418    HZ   PHE  47           HZ       PHE  47  -4.772  -4.483 -10.173
  419    H    GLY  48           H        GLY  48  -6.325  -3.179  -2.794
  420    HA2  GLY  48           HA2      GLY  48  -8.059  -4.551  -0.867
  421    HA3  GLY  48           HA3      GLY  48  -6.610  -3.789  -0.237
  422    H    LEU  49           H        LEU  49  -8.080  -2.509   1.071
  423    HA   LEU  49           HA       LEU  49  -9.702  -0.586  -0.444
  424    HB2  LEU  49           HB2      LEU  49  -9.908  -1.379   2.459
  425    HB3  LEU  49           HB3      LEU  49 -10.979  -0.277   1.617
  426    HG   LEU  49           HG       LEU  49 -10.693  -3.237   1.100
  427   HD11  LEU  49          HD11      LEU  49 -13.000  -3.339   1.893
  428   HD12  LEU  49          HD12      LEU  49 -11.920  -2.703   3.135
  429   HD13  LEU  49          HD13      LEU  49 -12.965  -1.608   2.228
  430   HD21  LEU  49          HD21      LEU  49 -12.470  -1.206  -0.245
  431   HD22  LEU  49          HD22      LEU  49 -11.096  -2.033  -0.980
  432   HD23  LEU  49          HD23      LEU  49 -12.522  -2.950  -0.494
  433    H    PHE  50           H        PHE  50  -8.591   1.177  -0.785
  434    HA   PHE  50           HA       PHE  50  -7.161   2.455   1.441
  435    HB2  PHE  50           HB2      PHE  50  -5.978   2.286  -0.726
  436    HB3  PHE  50           HB3      PHE  50  -7.245   3.246  -1.479
  437    HD1  PHE  50           HD1      PHE  50  -4.400   3.315   0.866
  438    HD2  PHE  50           HD2      PHE  50  -7.335   5.616  -1.202
  439    HE1  PHE  50           HE1      PHE  50  -3.193   5.370   1.432
  440    HE2  PHE  50           HE2      PHE  50  -6.120   7.675  -0.635
  441    HZ   PHE  50           HZ       PHE  50  -4.045   7.553   0.687
  442    H    LEU  51           H        LEU  51  -7.963   4.197   2.462
  443    HA   LEU  51           HA       LEU  51 -10.638   5.047   1.661
  444    HB2  LEU  51           HB2      LEU  51  -9.965   4.302   4.038
  445    HB3  LEU  51           HB3      LEU  51  -9.195   5.868   4.170
  446    HG   LEU  51           HG       LEU  51 -11.518   5.656   5.170
  447   HD11  LEU  51          HD11      LEU  51 -12.238   7.860   4.417
  448   HD12  LEU  51          HD12      LEU  51 -10.503   7.826   4.736
  449   HD13  LEU  51          HD13      LEU  51 -11.095   7.780   3.076
  450   HD21  LEU  51          HD21      LEU  51 -12.301   5.669   2.261
  451   HD22  LEU  51          HD22      LEU  51 -12.534   4.341   3.398
  452   HD23  LEU  51          HD23      LEU  51 -13.403   5.860   3.625
  453    H    SER  52           H        SER  52 -10.840   6.772   0.438
  454    HA   SER  52           HA       SER  52  -8.683   8.640   0.090
  455    HB2  SER  52           HB2      SER  52 -11.501   8.792  -1.002
  456    HB3  SER  52           HB3      SER  52 -10.079   9.642  -1.608
  457    HG   SER  52           HG       SER  52  -9.270   7.287  -1.772
  458    H    ASP  53           H        ASP  53  -8.533   9.417   2.236
  459    HA   ASP  53           HA       ASP  53 -10.645  10.623   3.660
  460    HB2  ASP  53           HB2      ASP  53  -8.569   9.837   4.727
  461    HB3  ASP  53           HB3      ASP  53  -7.662  11.088   3.885
  462    H    ASP  54           H        ASP  54  -7.950  12.071   1.853
  463    HA   ASP  54           HA       ASP  54  -9.397  14.273   0.858
  464    HB2  ASP  54           HB2      ASP  54  -9.566  15.095   3.103
  465    HB3  ASP  54           HB3      ASP  54  -7.876  14.733   3.431
  466    H    ASP  55           H        ASP  55  -6.244  13.773   2.364
  467    HA   ASP  55           HA       ASP  55  -4.954  14.257  -0.242
  468    HB2  ASP  55           HB2      ASP  55  -4.594  16.115   1.375
  469    HB3  ASP  55           HB3      ASP  55  -3.916  14.966   2.522
  470    HA   PRO  56           HA       PRO  56  -3.185  10.170  -0.019
  471    HB2  PRO  56           HB2      PRO  56  -0.511  11.012  -0.512
  472    HB3  PRO  56           HB3      PRO  56  -1.665  10.353  -1.670
  473    HG2  PRO  56           HG2      PRO  56  -0.946  13.171  -1.112
  474    HG3  PRO  56           HG3      PRO  56  -1.525  12.431  -2.615
  475    HD2  PRO  56           HD2      PRO  56  -3.106  14.004  -1.129
  476    HD3  PRO  56           HD3      PRO  56  -3.750  12.582  -1.976
  477    H    LYS  57           H        LYS  57  -1.612  12.818   1.746
  478    HA   LYS  57           HA       LYS  57  -0.088  11.111   3.461
  479    HB2  LYS  57           HB2      LYS  57  -0.960  13.976   3.870
  480    HB3  LYS  57           HB3      LYS  57   0.259  13.134   4.811
  481    HG2  LYS  57           HG2      LYS  57   0.446  13.611   1.863
  482    HG3  LYS  57           HG3      LYS  57   1.167  14.651   3.095
  483    HD2  LYS  57           HD2      LYS  57   2.600  12.935   3.842
  484    HD3  LYS  57           HD3      LYS  57   1.718  11.704   2.931
  485    HE2  LYS  57           HE2      LYS  57   3.719  12.196   1.755
  486    HE3  LYS  57           HE3      LYS  57   2.362  12.871   0.859
  487    HZ1  LYS  57           HZ1      LYS  57   4.137  14.448   0.891
  488    HZ2  LYS  57           HZ2      LYS  57   4.263  14.364   2.578
  489    HZ3  LYS  57           HZ3      LYS  57   2.885  15.043   1.865
  490    H    LYS  58           H        LYS  58  -3.294  12.493   3.569
  491    HA   LYS  58           HA       LYS  58  -3.776  11.654   6.303
  492    HB2  LYS  58           HB2      LYS  58  -5.686  12.788   4.255
  493    HB3  LYS  58           HB3      LYS  58  -5.981  12.632   5.981
  494    HG2  LYS  58           HG2      LYS  58  -4.366  14.299   6.487
  495    HG3  LYS  58           HG3      LYS  58  -3.789  14.330   4.818
  496    HD2  LYS  58           HD2      LYS  58  -5.980  15.138   4.086
  497    HD3  LYS  58           HD3      LYS  58  -6.539  15.131   5.760
  498    HE2  LYS  58           HE2      LYS  58  -4.831  16.786   6.333
  499    HE3  LYS  58           HE3      LYS  58  -4.270  16.788   4.661
  500    HZ1  LYS  58           HZ1      LYS  58  -5.739  18.651   5.079
  501    HZ2  LYS  58           HZ2      LYS  58  -6.973  17.605   5.590
  502    HZ3  LYS  58           HZ3      LYS  58  -6.458  17.579   3.974
  503    H    GLY  59           H        GLY  59  -4.188  10.483   3.102
  504    HA2  GLY  59           HA2      GLY  59  -6.339   8.707   3.435
  505    HA3  GLY  59           HA3      GLY  59  -5.057   8.544   2.244
  506    H    ILE  60           H        ILE  60  -6.317   6.391   3.633
  507    HA   ILE  60           HA       ILE  60  -4.031   5.316   5.101
  508    HB   ILE  60           HB       ILE  60  -5.587   4.349   6.826
  509   HG12  ILE  60          HG12      ILE  60  -7.482   6.455   5.759
  510   HG13  ILE  60          HG13      ILE  60  -7.683   4.717   5.568
  511   HG21  ILE  60          HG21      ILE  60  -4.112   6.200   7.355
  512   HG22  ILE  60          HG22      ILE  60  -5.310   7.350   6.763
  513   HG23  ILE  60          HG23      ILE  60  -5.651   6.379   8.196
  514   HD11  ILE  60          HD11      ILE  60  -7.676   6.214   8.179
  515   HD12  ILE  60          HD12      ILE  60  -9.093   5.583   7.341
  516   HD13  ILE  60          HD13      ILE  60  -7.884   4.473   7.986
  517    H    TRP  61           H        TRP  61  -4.022   3.033   5.266
  518    HA   TRP  61           HA       TRP  61  -5.598   1.699   3.200
  519    HB2  TRP  61           HB2      TRP  61  -3.156   0.889   4.773
  520    HB3  TRP  61           HB3      TRP  61  -4.076  -0.273   3.821
  521    HD1  TRP  61           HD1      TRP  61  -1.315   2.174   3.521
  522    HE1  TRP  61           HE1      TRP  61  -0.649   2.497   1.058
  523    HE3  TRP  61           HE3      TRP  61  -5.267  -0.185   1.334
  524    HZ2  TRP  61           HZ2      TRP  61  -1.679   1.817  -1.482
  525    HZ3  TRP  61           HZ3      TRP  61  -5.356  -0.313  -1.119
  526    HH2  TRP  61           HH2      TRP  61  -3.596   0.667  -2.495
  527    H    LEU  62           H        LEU  62  -7.326   0.589   3.696
  528    HA   LEU  62           HA       LEU  62  -8.055   0.202   6.466
  529    HB2  LEU  62           HB2      LEU  62  -9.523  -0.597   3.948
  530    HB3  LEU  62           HB3      LEU  62 -10.189  -0.554   5.569
  531    HG   LEU  62           HG       LEU  62  -9.256   1.855   4.002
  532   HD11  LEU  62          HD11      LEU  62 -12.028   0.899   4.694
  533   HD12  LEU  62          HD12      LEU  62 -11.631   2.427   3.908
  534   HD13  LEU  62          HD13      LEU  62 -11.297   0.901   3.088
  535   HD21  LEU  62          HD21      LEU  62  -8.952   2.130   6.400
  536   HD22  LEU  62          HD22      LEU  62 -10.273   3.140   5.810
  537   HD23  LEU  62          HD23      LEU  62 -10.626   1.643   6.674
  538    H    GLU  63           H        GLU  63  -7.134  -1.471   7.480
  539    HA   GLU  63           HA       GLU  63  -6.354  -3.842   6.030
  540    HB2  GLU  63           HB2      GLU  63  -5.473  -4.583   8.224
  541    HB3  GLU  63           HB3      GLU  63  -4.871  -3.001   7.750
  542    HG2  GLU  63           HG2      GLU  63  -6.493  -1.938   9.235
  543    HG3  GLU  63           HG3      GLU  63  -7.093  -3.526   9.713
  544    H    ALA  64           H        ALA  64  -6.993  -5.987   6.664
  545    HA   ALA  64           HA       ALA  64  -9.803  -6.280   6.900
  546    HB1  ALA  64           HB1      ALA  64  -7.653  -8.368   7.236
  547    HB2  ALA  64           HB2      ALA  64  -9.364  -8.671   6.939
  548    HB3  ALA  64           HB3      ALA  64  -8.382  -7.880   5.705
  549    H    GLY  65           H        GLY  65  -7.474  -5.675   9.228
  550    HA2  GLY  65           HA2      GLY  65  -8.641  -7.253  11.348
  551    HA3  GLY  65           HA3      GLY  65  -7.295  -6.135  11.494
  552    H    LYS  66           H        LYS  66 -10.043  -4.798   9.942
  553    HA   LYS  66           HA       LYS  66 -11.436  -4.098  12.346
  554    HB2  LYS  66           HB2      LYS  66 -10.818  -1.955  12.675
  555    HB3  LYS  66           HB3      LYS  66  -9.350  -2.443  11.843
  556    HG2  LYS  66           HG2      LYS  66 -11.714  -1.216  10.449
  557    HG3  LYS  66           HG3      LYS  66 -10.370  -0.279  11.097
  558    HD2  LYS  66           HD2      LYS  66  -8.847  -1.217   9.571
  559    HD3  LYS  66           HD3      LYS  66  -9.957  -2.523   9.144
  560    HE2  LYS  66           HE2      LYS  66 -10.416   0.402   8.551
  561    HE3  LYS  66           HE3      LYS  66  -9.804  -0.779   7.394
  562    HZ1  LYS  66           HZ1      LYS  66 -12.129  -0.506   7.066
  563    HZ2  LYS  66           HZ2      LYS  66 -12.462  -0.769   8.706
  564    HZ3  LYS  66           HZ3      LYS  66 -11.881  -2.037   7.747
  565    H    ALA  67           H        ALA  67 -13.394  -2.905  11.939
  566    HA   ALA  67           HA       ALA  67 -14.542  -3.634   9.370
  567    HB1  ALA  67           HB1      ALA  67 -15.848  -2.309  11.744
  568    HB2  ALA  67           HB2      ALA  67 -16.662  -3.063  10.373
  569    HB3  ALA  67           HB3      ALA  67 -15.728  -4.054  11.499
  570    H    LEU  68           H        LEU  68 -16.087  -1.932   8.377
  571    HA   LEU  68           HA       LEU  68 -14.414   0.227   7.562
  572    HB2  LEU  68           HB2      LEU  68 -17.329  -0.267   6.997
  573    HB3  LEU  68           HB3      LEU  68 -16.309   0.898   6.183
  574    HG   LEU  68           HG       LEU  68 -15.922  -2.093   6.120
  575   HD11  LEU  68          HD11      LEU  68 -17.911  -1.391   4.896
  576   HD12  LEU  68          HD12      LEU  68 -16.953  -0.211   4.004
  577   HD13  LEU  68          HD13      LEU  68 -16.643  -1.934   3.799
  578   HD21  LEU  68          HD21      LEU  68 -13.827  -0.874   5.934
  579   HD22  LEU  68          HD22      LEU  68 -14.263  -1.605   4.389
  580   HD23  LEU  68          HD23      LEU  68 -14.506   0.123   4.648
  581    H    ASP  69           H        ASP  69 -17.526   0.142   9.267
  582    HA   ASP  69           HA       ASP  69 -17.636   2.956   9.691
  583    HB2  ASP  69           HB2      ASP  69 -19.712   1.816   9.592
  584    HB3  ASP  69           HB3      ASP  69 -19.207   0.619  10.773
  585    H    TYR  70           H        TYR  70 -15.918   0.496  11.201
  586    HA   TYR  70           HA       TYR  70 -15.646   1.329  13.814
  587    HB2  TYR  70           HB2      TYR  70 -14.611  -0.702  12.994
  588    HB3  TYR  70           HB3      TYR  70 -13.596   0.221  11.889
  589    HD1  TYR  70           HD1      TYR  70 -14.372   0.020  15.516
  590    HD2  TYR  70           HD2      TYR  70 -11.443   0.639  12.511
  591    HE1  TYR  70           HE1      TYR  70 -12.638   0.147  17.252
  592    HE2  TYR  70           HE2      TYR  70  -9.691   0.774  14.229
  593    HH   TYR  70           HH       TYR  70 -10.205  -0.172  17.454
  594    H    TYR  71           H        TYR  71 -14.080   2.522  10.879
  595    HA   TYR  71           HA       TYR  71 -12.749   4.676  12.255
  596    HB2  TYR  71           HB2      TYR  71 -13.019   3.844   9.384
  597    HB3  TYR  71           HB3      TYR  71 -12.403   5.445   9.780
  598    HD1  TYR  71           HD1      TYR  71 -10.246   5.711  10.879
  599    HD2  TYR  71           HD2      TYR  71 -11.723   1.851   9.874
  600    HE1  TYR  71           HE1      TYR  71  -8.000   4.767  11.229
  601    HE2  TYR  71           HE2      TYR  71  -9.484   0.902  10.224
  602    HH   TYR  71           HH       TYR  71  -7.029   2.471  11.812
  603    H    MET  72           H        MET  72 -13.588   6.372   9.756
  604    HA   MET  72           HA       MET  72 -15.976   7.489  11.068
  605    HB2  MET  72           HB2      MET  72 -13.940   8.850   9.296
  606    HB3  MET  72           HB3      MET  72 -15.339   9.629  10.021
  607    HG2  MET  72           HG2      MET  72 -14.448   9.302  12.221
  608    HG3  MET  72           HG3      MET  72 -13.115   8.342  11.583
  609    HE1  MET  72           HE1      MET  72 -12.428  10.010   8.930
  610    HE2  MET  72           HE2      MET  72 -11.132  11.046   9.527
  611    HE3  MET  72           HE3      MET  72 -11.200   9.351  10.011
  612    H    LEU  73           H        LEU  73 -15.589   5.403   8.769
  613    HA   LEU  73           HA       LEU  73 -16.587   6.805   6.456
  614    HB2  LEU  73           HB2      LEU  73 -16.839   3.900   6.371
  615    HB3  LEU  73           HB3      LEU  73 -16.074   4.993   5.245
  616    HG   LEU  73           HG       LEU  73 -14.825   3.856   7.746
  617   HD11  LEU  73          HD11      LEU  73 -13.357   2.714   6.147
  618   HD12  LEU  73          HD12      LEU  73 -15.047   2.249   5.948
  619   HD13  LEU  73          HD13      LEU  73 -14.307   3.381   4.818
  620   HD21  LEU  73          HD21      LEU  73 -12.772   4.938   6.980
  621   HD22  LEU  73          HD22      LEU  73 -13.665   5.708   5.668
  622   HD23  LEU  73          HD23      LEU  73 -14.030   6.118   7.344
  623    H    ARG  74           H        ARG  74 -18.504   6.556   5.468
  624    HA   ARG  74           HA       ARG  74 -20.692   5.087   6.408
  625    HB2  ARG  74           HB2      ARG  74 -21.982   7.027   7.381
  626    HB3  ARG  74           HB3      ARG  74 -20.645   6.453   8.362
  627    HG2  ARG  74           HG2      ARG  74 -19.301   8.331   7.358
  628    HG3  ARG  74           HG3      ARG  74 -20.826   8.938   6.700
  629    HD2  ARG  74           HD2      ARG  74 -20.483  10.028   8.759
  630    HD3  ARG  74           HD3      ARG  74 -21.750   8.848   9.021
  631    HE   ARG  74           HE       ARG  74 -19.737   7.420   9.835
  632   HH11  ARG  74          HH11      ARG  74 -20.201  10.850  10.373
  633   HH12  ARG  74          HH12      ARG  74 -19.335  10.853  11.885
  634   HH21  ARG  74          HH21      ARG  74 -18.596   7.416  11.798
  635   HH22  ARG  74          HH22      ARG  74 -18.418   8.902  12.697
  636    H    ASN  75           H        ASN  75 -22.709   6.920   5.774
  637    HA   ASN  75           HA       ASN  75 -22.673   6.691   2.951
  638    HB2  ASN  75           HB2      ASN  75 -24.560   7.919   4.927
  639    HB3  ASN  75           HB3      ASN  75 -24.787   8.198   3.202
  640   HD21  ASN  75          HD21      ASN  75 -24.654   5.753   5.712
  641   HD22  ASN  75          HD22      ASN  75 -25.494   4.529   4.809
  642    H    GLY  76           H        GLY  76 -21.149   7.825   1.920
  643    HA2  GLY  76           HA2      GLY  76 -21.281  10.121   0.797
  644    HA3  GLY  76           HA3      GLY  76 -21.019  10.719   2.428
  645    H    ASP  77           H        ASP  77 -19.222   8.242   2.828
  646    HA   ASP  77           HA       ASP  77 -16.810   9.643   2.115
  647    HB2  ASP  77           HB2      ASP  77 -17.221   6.966   3.464
  648    HB3  ASP  77           HB3      ASP  77 -15.666   7.775   3.282
  649    H    THR  78           H        THR  78 -15.286   9.080   0.638
  650    HA   THR  78           HA       THR  78 -16.081   7.121  -1.380
  651    HB   THR  78           HB       THR  78 -13.790   9.106  -1.386
  652    HG1  THR  78           HG1      THR  78 -15.498  10.382  -1.693
  653   HG21  THR  78          HG21      THR  78 -14.911   7.389  -3.605
  654   HG22  THR  78          HG22      THR  78 -13.343   7.181  -2.823
  655   HG23  THR  78          HG23      THR  78 -13.662   8.621  -3.791
  656    H    MET  79           H        MET  79 -15.000   5.206  -1.705
  657    HA   MET  79           HA       MET  79 -12.631   4.744  -0.033
  658    HB2  MET  79           HB2      MET  79 -14.890   3.676   0.755
  659    HB3  MET  79           HB3      MET  79 -14.602   2.544  -0.560
  660    HG2  MET  79           HG2      MET  79 -12.411   2.002   0.425
  661    HG3  MET  79           HG3      MET  79 -12.780   3.083   1.768
  662    HE1  MET  79           HE1      MET  79 -14.990  -0.855   0.869
  663    HE2  MET  79           HE2      MET  79 -15.164   0.576  -0.150
  664    HE3  MET  79           HE3      MET  79 -13.604  -0.246  -0.044
  665    H    GLU  80           H        GLU  80 -11.013   4.419  -1.335
  666    HA   GLU  80           HA       GLU  80 -11.436   3.708  -4.108
  667    HB2  GLU  80           HB2      GLU  80  -9.791   5.465  -3.162
  668    HB3  GLU  80           HB3      GLU  80  -8.784   4.096  -2.719
  669    HG2  GLU  80           HG2      GLU  80  -8.477   3.471  -4.980
  670    HG3  GLU  80           HG3      GLU  80  -9.718   4.596  -5.528
  671    H    TYR  81           H        TYR  81 -11.356   1.601  -4.849
  672    HA   TYR  81           HA       TYR  81 -10.025  -0.366  -3.155
  673    HB2  TYR  81           HB2      TYR  81 -12.318  -0.852  -4.111
  674    HB3  TYR  81           HB3      TYR  81 -11.583  -0.836  -5.711
  675    HD1  TYR  81           HD1      TYR  81 -11.866  -2.657  -2.550
  676    HD2  TYR  81           HD2      TYR  81 -10.155  -2.688  -6.446
  677    HE1  TYR  81           HE1      TYR  81 -11.315  -5.033  -2.282
  678    HE2  TYR  81           HE2      TYR  81  -9.610  -5.077  -6.188
  679    HH   TYR  81           HH       TYR  81  -9.198  -6.670  -4.309
  680    H    ARG  82           H        ARG  82  -7.929  -0.384  -3.494
  681    HA   ARG  82           HA       ARG  82  -6.993  -0.221  -6.253
  682    HB2  ARG  82           HB2      ARG  82  -5.240   1.391  -5.664
  683    HB3  ARG  82           HB3      ARG  82  -6.853   2.058  -5.457
  684    HG2  ARG  82           HG2      ARG  82  -6.713   1.780  -3.075
  685    HG3  ARG  82           HG3      ARG  82  -5.155   0.963  -3.230
  686    HD2  ARG  82           HD2      ARG  82  -5.711   3.798  -4.088
  687    HD3  ARG  82           HD3      ARG  82  -4.974   3.342  -2.556
  688    HE   ARG  82           HE       ARG  82  -3.287   2.190  -4.225
  689   HH11  ARG  82          HH11      ARG  82  -4.873   5.275  -4.578
  690   HH12  ARG  82          HH12      ARG  82  -3.489   6.072  -5.278
  691   HH21  ARG  82          HH21      ARG  82  -1.442   3.206  -5.183
  692   HH22  ARG  82          HH22      ARG  82  -1.525   4.888  -5.617
  693    H    LYS  83           H        LYS  83  -4.444  -0.303  -6.070
  694    HA   LYS  83           HA       LYS  83  -3.959  -3.006  -5.361
  695    HB2  LYS  83           HB2      LYS  83  -3.057  -1.725  -7.315
  696    HB3  LYS  83           HB3      LYS  83  -2.043  -0.838  -6.194
  697    HG2  LYS  83           HG2      LYS  83  -0.740  -2.727  -5.717
  698    HG3  LYS  83           HG3      LYS  83  -1.919  -3.821  -6.464
  699    HD2  LYS  83           HD2      LYS  83  -0.018  -3.500  -7.943
  700    HD3  LYS  83           HD3      LYS  83  -1.456  -2.753  -8.644
  701    HE2  LYS  83           HE2      LYS  83  -0.528  -0.650  -7.317
  702    HE3  LYS  83           HE3      LYS  83   0.994  -1.501  -7.532
  703    HZ1  LYS  83           HZ1      LYS  83  -0.848  -0.879  -9.769
  704    HZ2  LYS  83           HZ2      LYS  83   0.745  -1.448  -9.876
  705    HZ3  LYS  83           HZ3      LYS  83   0.438   0.125  -9.317
  706    H    LYS  84           H        LYS  84  -3.544  -3.682  -3.347
  707    HA   LYS  84           HA       LYS  84  -2.682  -2.079  -1.183
  708    HB2  LYS  84           HB2      LYS  84  -2.634  -5.057  -1.661
  709    HB3  LYS  84           HB3      LYS  84  -2.000  -4.347  -0.184
  710    HG2  LYS  84           HG2      LYS  84  -4.815  -3.960  -1.151
  711    HG3  LYS  84           HG3      LYS  84  -4.307  -5.219  -0.027
  712    HD2  LYS  84           HD2      LYS  84  -3.472  -2.492   0.677
  713    HD3  LYS  84           HD3      LYS  84  -5.208  -2.795   0.739
  714    HE2  LYS  84           HE2      LYS  84  -4.268  -3.250   2.898
  715    HE3  LYS  84           HE3      LYS  84  -4.764  -4.773   2.166
  716    HZ1  LYS  84           HZ1      LYS  84  -1.986  -3.716   2.277
  717    HZ2  LYS  84           HZ2      LYS  84  -2.448  -5.165   1.539
  718    HZ3  LYS  84           HZ3      LYS  84  -2.606  -4.985   3.215
  719    H    GLN  85           H        GLN  85  -1.032  -3.969  -3.603
  720    HA   GLN  85           HA       GLN  85   1.581  -3.704  -2.501
  721    HB2  GLN  85           HB2      GLN  85   0.805  -4.346  -5.353
  722    HB3  GLN  85           HB3      GLN  85   2.290  -4.785  -4.521
  723    HG2  GLN  85           HG2      GLN  85  -0.283  -5.789  -3.458
  724    HG3  GLN  85           HG3      GLN  85   0.367  -6.533  -4.914
  725   HE21  GLN  85          HE21      GLN  85   0.798  -6.015  -1.508
  726   HE22  GLN  85          HE22      GLN  85   2.023  -7.216  -1.283
  727    H    ARG  86           H        ARG  86   3.000  -2.971  -4.780
  728    HA   ARG  86           HA       ARG  86   2.331  -0.670  -6.055
  729    HB2  ARG  86           HB2      ARG  86   3.712   1.003  -4.625
  730    HB3  ARG  86           HB3      ARG  86   2.043   0.680  -4.198
  731    HG2  ARG  86           HG2      ARG  86   3.070   0.649  -2.150
  732    HG3  ARG  86           HG3      ARG  86   3.070  -1.064  -2.565
  733    HD2  ARG  86           HD2      ARG  86   5.219  -0.105  -1.614
  734    HD3  ARG  86           HD3      ARG  86   5.357  -1.041  -3.103
  735    HE   ARG  86           HE       ARG  86   6.191   0.815  -4.090
  736   HH11  ARG  86          HH11      ARG  86   4.279   1.903  -1.337
  737   HH12  ARG  86          HH12      ARG  86   4.579   3.583  -1.657
  738   HH21  ARG  86          HH21      ARG  86   6.604   3.023  -4.455
  739   HH22  ARG  86          HH22      ARG  86   5.867   4.219  -3.424
  740    HA   PRO  87           HA       PRO  87   6.089  -1.938  -7.911
  741    HB2  PRO  87           HB2      PRO  87   6.133   0.739  -9.159
  742    HB3  PRO  87           HB3      PRO  87   6.063  -0.853  -9.919
  743    HG2  PRO  87           HG2      PRO  87   3.931   0.765  -9.880
  744    HG3  PRO  87           HG3      PRO  87   3.764  -0.993  -9.722
  745    HD2  PRO  87           HD2      PRO  87   3.650   1.120  -7.604
  746    HD3  PRO  87           HD3      PRO  87   2.654  -0.339  -7.799
  747    H    LEU  88           H        LEU  88   7.854  -2.007  -6.734
  748    HA   LEU  88           HA       LEU  88   8.921   0.451  -5.570
  749    HB2  LEU  88           HB2      LEU  88   9.361  -2.466  -5.001
  750    HB3  LEU  88           HB3      LEU  88  10.475  -1.243  -4.408
  751    HG   LEU  88           HG       LEU  88   7.522  -1.319  -3.788
  752   HD11  LEU  88          HD11      LEU  88   8.228  -2.029  -1.561
  753   HD12  LEU  88          HD12      LEU  88   8.686  -3.203  -2.795
  754   HD13  LEU  88          HD13      LEU  88   9.898  -2.114  -2.121
  755   HD21  LEU  88          HD21      LEU  88   8.457   0.925  -3.731
  756   HD22  LEU  88          HD22      LEU  88   8.108   0.358  -2.097
  757   HD23  LEU  88          HD23      LEU  88   9.769   0.368  -2.693
  758    H    LYS  89           H        LYS  89  10.369   1.498  -6.721
  759    HA   LYS  89           HA       LYS  89  12.030   0.135  -8.673
  760    HB2  LYS  89           HB2      LYS  89  11.949   3.039  -7.807
  761    HB3  LYS  89           HB3      LYS  89  12.923   2.408  -9.125
  762    HG2  LYS  89           HG2      LYS  89   9.914   2.338  -9.016
  763    HG3  LYS  89           HG3      LYS  89  10.874   3.535  -9.887
  764    HD2  LYS  89           HD2      LYS  89  10.922   0.561 -10.391
  765    HD3  LYS  89           HD3      LYS  89  10.030   1.741 -11.353
  766    HE2  LYS  89           HE2      LYS  89  13.021   1.662 -10.974
  767    HE3  LYS  89           HE3      LYS  89  12.149   1.133 -12.411
  768    HZ1  LYS  89           HZ1      LYS  89  12.987   3.312 -12.798
  769    HZ2  LYS  89           HZ2      LYS  89  12.342   3.895 -11.346
  770    HZ3  LYS  89           HZ3      LYS  89  11.305   3.446 -12.610
  771    H    ILE  90           H        ILE  90  13.722  -0.961  -7.853
  772    HA   ILE  90           HA       ILE  90  15.090   0.166  -5.496
  773    HB   ILE  90           HB       ILE  90  14.533  -2.766  -6.000
  774   HG12  ILE  90          HG12      ILE  90  12.518  -1.512  -5.299
  775   HG13  ILE  90          HG13      ILE  90  13.042  -2.666  -4.078
  776   HG21  ILE  90          HG21      ILE  90  15.911  -1.379  -3.707
  777   HG22  ILE  90          HG22      ILE  90  15.457  -3.084  -3.731
  778   HG23  ILE  90          HG23      ILE  90  16.643  -2.472  -4.884
  779   HD11  ILE  90          HD11      ILE  90  14.066  -0.854  -2.805
  780   HD12  ILE  90          HD12      ILE  90  13.544   0.302  -4.031
  781   HD13  ILE  90          HD13      ILE  90  12.346  -0.570  -3.073
  782    H    ARG  91           H        ARG  91  17.291   0.350  -5.717
  783    HA   ARG  91           HA       ARG  91  18.528  -1.122  -7.942
  784    HB2  ARG  91           HB2      ARG  91  18.743   1.392  -7.948
  785    HB3  ARG  91           HB3      ARG  91  19.641   1.253  -6.442
  786    HG2  ARG  91           HG2      ARG  91  21.310  -0.148  -7.592
  787    HG3  ARG  91           HG3      ARG  91  20.442   0.117  -9.105
  788    HD2  ARG  91           HD2      ARG  91  21.536   2.340  -7.396
  789    HD3  ARG  91           HD3      ARG  91  22.435   1.602  -8.720
  790    HE   ARG  91           HE       ARG  91  19.836   2.574  -9.490
  791   HH11  ARG  91          HH11      ARG  91  23.207   3.420  -9.025
  792   HH12  ARG  91          HH12      ARG  91  23.147   4.770 -10.121
  793   HH21  ARG  91          HH21      ARG  91  19.757   4.337 -10.936
  794   HH22  ARG  91          HH22      ARG  91  21.189   5.286 -11.216
  795    H    MET  92           H        MET  92  19.768  -2.781  -7.423
  796    HA   MET  92           HA       MET  92  20.242  -3.432  -4.659
  797    HB2  MET  92           HB2      MET  92  20.269  -4.793  -7.254
  798    HB3  MET  92           HB3      MET  92  21.517  -5.353  -6.152
  799    HG2  MET  92           HG2      MET  92  19.306  -6.574  -6.143
  800    HG3  MET  92           HG3      MET  92  19.964  -6.096  -4.582
  801    HE1  MET  92           HE1      MET  92  17.220  -5.484  -7.292
  802    HE2  MET  92           HE2      MET  92  16.470  -3.993  -6.719
  803    HE3  MET  92           HE3      MET  92  18.131  -3.974  -7.317
  804    H    LEU  93           H        LEU  93  22.494  -4.586  -4.293
  805    HA   LEU  93           HA       LEU  93  24.203  -2.433  -3.817
  806    HB2  LEU  93           HB2      LEU  93  24.890  -5.374  -3.816
  807    HB3  LEU  93           HB3      LEU  93  25.870  -4.109  -3.109
  808    HG   LEU  93           HG       LEU  93  24.838  -5.003  -1.259
  809   HD11  LEU  93          HD11      LEU  93  22.935  -2.845  -2.136
  810   HD12  LEU  93          HD12      LEU  93  23.111  -3.458  -0.492
  811   HD13  LEU  93          HD13      LEU  93  24.456  -2.620  -1.268
  812   HD21  LEU  93          HD21      LEU  93  22.575  -5.809  -1.126
  813   HD22  LEU  93          HD22      LEU  93  22.231  -5.220  -2.751
  814   HD23  LEU  93          HD23      LEU  93  23.378  -6.537  -2.517
  815    H    ASP  94           H        ASP  94  24.331  -4.923  -6.317
  816    HA   ASP  94           HA       ASP  94  26.856  -4.014  -7.341
  817    HB2  ASP  94           HB2      ASP  94  26.397  -5.643  -9.185
  818    HB3  ASP  94           HB3      ASP  94  26.338  -6.347  -7.573
  819    H    GLY  95           H        GLY  95  23.801  -2.765  -7.528
  820    HA2  GLY  95           HA2      GLY  95  23.543  -0.610  -8.527
  821    HA3  GLY  95           HA3      GLY  95  24.683  -1.085  -9.776
  822    H    THR  96           H        THR  96  22.429  -3.504  -9.053
  823    HA   THR  96           HA       THR  96  21.209  -3.080 -11.660
  824    HB   THR  96           HB       THR  96  21.106  -5.435  -9.761
  825    HG1  THR  96           HG1      THR  96  22.990  -5.732 -10.709
  826   HG21  THR  96          HG21      THR  96  19.982  -5.189 -12.555
  827   HG22  THR  96          HG22      THR  96  19.040  -5.314 -11.069
  828   HG23  THR  96          HG23      THR  96  20.043  -6.666 -11.593
  829    H    VAL  97           H        VAL  97  19.124  -2.486 -11.961
  830    HA   VAL  97           HA       VAL  97  17.591  -1.980  -9.507
  831    HB   VAL  97           HB       VAL  97  18.174   0.093 -10.590
  832   HG11  VAL  97          HG11      VAL  97  18.571  -0.710 -12.838
  833   HG12  VAL  97          HG12      VAL  97  16.845  -1.004 -13.057
  834   HG13  VAL  97          HG13      VAL  97  17.441   0.643 -12.853
  835   HG21  VAL  97          HG21      VAL  97  15.976  -0.010  -9.546
  836   HG22  VAL  97          HG22      VAL  97  15.956   1.060 -10.947
  837   HG23  VAL  97          HG23      VAL  97  15.267  -0.561 -11.065
  838    H    LYS  98           H        LYS  98  15.663  -2.793  -9.271
  839    HA   LYS  98           HA       LYS  98  14.228  -3.910 -11.552
  840    HB2  LYS  98           HB2      LYS  98  13.793  -6.063 -10.516
  841    HB3  LYS  98           HB3      LYS  98  15.520  -5.827 -10.728
  842    HG2  LYS  98           HG2      LYS  98  15.907  -5.628  -8.465
  843    HG3  LYS  98           HG3      LYS  98  14.242  -5.150  -8.120
  844    HD2  LYS  98           HD2      LYS  98  15.038  -7.892  -9.083
  845    HD3  LYS  98           HD3      LYS  98  14.820  -7.476  -7.377
  846    HE2  LYS  98           HE2      LYS  98  12.721  -7.251  -9.539
  847    HE3  LYS  98           HE3      LYS  98  12.813  -8.511  -8.300
  848    HZ1  LYS  98           HZ1      LYS  98  11.240  -6.738  -7.774
  849    HZ2  LYS  98           HZ2      LYS  98  12.508  -5.617  -7.757
  850    HZ3  LYS  98           HZ3      LYS  98  12.470  -6.867  -6.619
  851    H    THR  99           H        THR  99  11.967  -4.427 -11.070
  852    HA   THR  99           HA       THR  99  10.968  -2.876  -8.776
  853    HB   THR  99           HB       THR  99   9.679  -3.436 -11.456
  854    HG1  THR  99           HG1      THR  99  11.365  -1.723 -11.217
  855   HG21  THR  99          HG21      THR  99   8.040  -3.464  -9.633
  856   HG22  THR  99          HG22      THR  99   7.824  -2.063 -10.685
  857   HG23  THR  99          HG23      THR  99   8.600  -1.874  -9.112
  858    H    ILE 100           H        ILE 100   9.656  -3.930  -7.325
  859    HA   ILE 100           HA       ILE 100   8.439  -6.460  -8.160
  860    HB   ILE 100           HB       ILE 100  10.541  -6.882  -6.856
  861   HG12  ILE 100          HG12      ILE 100   8.332  -8.330  -6.890
  862   HG13  ILE 100          HG13      ILE 100   9.696  -8.770  -5.875
  863   HG21  ILE 100          HG21      ILE 100  10.479  -5.016  -5.342
  864   HG22  ILE 100          HG22      ILE 100   9.003  -5.629  -4.596
  865   HG23  ILE 100          HG23      ILE 100  10.513  -6.526  -4.430
  866   HD11  ILE 100          HD11      ILE 100   7.221  -7.313  -4.982
  867   HD12  ILE 100          HD12      ILE 100   7.604  -9.010  -4.689
  868   HD13  ILE 100          HD13      ILE 100   8.591  -7.746  -3.957
  869    H    MET 101           H        MET 101   6.422  -6.894  -7.141
  870    HA   MET 101           HA       MET 101   5.122  -4.511  -6.097
  871    HB2  MET 101           HB2      MET 101   3.971  -7.263  -6.582
  872    HB3  MET 101           HB3      MET 101   3.067  -5.777  -6.326
  873    HG2  MET 101           HG2      MET 101   4.818  -6.432  -8.680
  874    HG3  MET 101           HG3      MET 101   3.057  -6.359  -8.659
  875    HE1  MET 101           HE1      MET 101   2.447  -2.556  -7.955
  876    HE2  MET 101           HE2      MET 101   1.702  -4.140  -8.166
  877    HE3  MET 101           HE3      MET 101   2.674  -3.806  -6.732
  878    H    VAL 102           H        VAL 102   5.305  -4.068  -4.073
  879    HA   VAL 102           HA       VAL 102   4.961  -6.210  -2.078
  880    HB   VAL 102           HB       VAL 102   6.604  -3.737  -1.570
  881   HG11  VAL 102          HG11      VAL 102   6.479  -6.440  -0.253
  882   HG12  VAL 102          HG12      VAL 102   7.590  -5.146   0.192
  883   HG13  VAL 102          HG13      VAL 102   5.851  -4.923   0.389
  884   HG21  VAL 102          HG21      VAL 102   7.717  -4.764  -3.407
  885   HG22  VAL 102          HG22      VAL 102   8.611  -5.177  -1.943
  886   HG23  VAL 102          HG23      VAL 102   7.544  -6.368  -2.688
  887    H    ASP 103           H        ASP 103   3.812  -5.633  -0.195
  888    HA   ASP 103           HA       ASP 103   1.610  -3.934  -0.744
  889    HB2  ASP 103           HB2      ASP 103   1.798  -6.086   0.734
  890    HB3  ASP 103           HB3      ASP 103   2.217  -4.945   2.010
  891    H    ASP 104           H        ASP 104   1.126  -1.918  -0.087
  892    HA   ASP 104           HA       ASP 104   3.255  -0.326   1.088
  893    HB2  ASP 104           HB2      ASP 104   1.907   0.512  -0.843
  894    HB3  ASP 104           HB3      ASP 104   0.492   0.539   0.199
  895    H    SER 105           H        SER 105   0.457  -2.009   2.138
  896    HA   SER 105           HA       SER 105  -0.256  -0.171   4.242
  897    HB2  SER 105           HB2      SER 105  -1.055  -3.065   4.013
  898    HB3  SER 105           HB3      SER 105  -1.914  -1.774   4.850
  899    HG   SER 105           HG       SER 105  -1.465  -1.171   2.240
  900    H    LYS 106           H        LYS 106   2.520  -1.770   4.112
  901    HA   LYS 106           HA       LYS 106   2.493  -2.266   6.992
  902    HB2  LYS 106           HB2      LYS 106   4.052  -4.229   6.537
  903    HB3  LYS 106           HB3      LYS 106   2.347  -4.455   6.208
  904    HG2  LYS 106           HG2      LYS 106   3.323  -5.419   4.375
  905    HG3  LYS 106           HG3      LYS 106   2.999  -3.793   3.785
  906    HD2  LYS 106           HD2      LYS 106   5.279  -3.163   4.092
  907    HD3  LYS 106           HD3      LYS 106   5.634  -4.667   4.949
  908    HE2  LYS 106           HE2      LYS 106   4.850  -4.382   2.055
  909    HE3  LYS 106           HE3      LYS 106   6.445  -4.808   2.677
  910    HZ1  LYS 106           HZ1      LYS 106   3.969  -6.426   2.993
  911    HZ2  LYS 106           HZ2      LYS 106   5.491  -6.832   3.615
  912    HZ3  LYS 106           HZ3      LYS 106   5.252  -6.771   1.940
  913    H    THR 107           H        THR 107   5.045  -2.917   7.491
  914    HA   THR 107           HA       THR 107   6.250  -0.309   7.095
  915    HB   THR 107           HB       THR 107   7.875  -1.252   8.883
  916    HG1  THR 107           HG1      THR 107   7.131  -3.021   9.996
  917   HG21  THR 107          HG21      THR 107   4.957  -0.778   9.512
  918   HG22  THR 107          HG22      THR 107   6.191   0.468   9.321
  919   HG23  THR 107          HG23      THR 107   6.288  -0.671  10.665
  920    H    VAL 108           H        VAL 108   8.875  -0.667   7.447
  921    HA   VAL 108           HA       VAL 108   9.602  -1.100   4.749
  922    HB   VAL 108           HB       VAL 108  11.430  -0.647   7.087
  923   HG11  VAL 108          HG11      VAL 108  12.926   0.342   5.416
  924   HG12  VAL 108          HG12      VAL 108  12.595  -1.359   5.089
  925   HG13  VAL 108          HG13      VAL 108  11.786  -0.107   4.147
  926   HG21  VAL 108          HG21      VAL 108  11.250   1.741   6.566
  927   HG22  VAL 108          HG22      VAL 108  10.028   1.375   5.347
  928   HG23  VAL 108          HG23      VAL 108   9.699   1.059   7.050
  929    H    THR 109           H        THR 109  10.840  -2.650   7.711
  930    HA   THR 109           HA       THR 109  12.600  -4.428   6.640
  931    HB   THR 109           HB       THR 109  10.785  -5.057   8.966
  932    HG1  THR 109           HG1      THR 109  12.461  -3.960  10.175
  933   HG21  THR 109          HG21      THR 109  12.722  -6.313   9.795
  934   HG22  THR 109          HG22      THR 109  13.621  -5.896   8.335
  935   HG23  THR 109          HG23      THR 109  12.194  -6.929   8.229
  936    H    ASP 110           H        ASP 110   9.102  -5.015   7.083
  937    HA   ASP 110           HA       ASP 110   9.115  -7.691   6.207
  938    HB2  ASP 110           HB2      ASP 110   7.236  -6.542   7.429
  939    HB3  ASP 110           HB3      ASP 110   6.852  -5.675   5.941
  940    H    MET 111           H        MET 111   8.720  -4.629   4.542
  941    HA   MET 111           HA       MET 111   8.179  -5.668   1.966
  942    HB2  MET 111           HB2      MET 111   7.520  -3.472   2.258
  943    HB3  MET 111           HB3      MET 111   8.991  -3.034   3.109
  944    HG2  MET 111           HG2      MET 111  10.226  -3.073   1.009
  945    HG3  MET 111           HG3      MET 111   8.754  -3.530   0.150
  946    HE1  MET 111           HE1      MET 111  10.005  -0.907   2.795
  947    HE2  MET 111           HE2      MET 111   8.791   0.358   2.580
  948    HE3  MET 111           HE3      MET 111   8.308  -1.232   3.177
  949    H    LEU 112           H        LEU 112  11.163  -4.664   3.587
  950    HA   LEU 112           HA       LEU 112  12.873  -4.850   1.358
  951    HB2  LEU 112           HB2      LEU 112  13.305  -3.840   3.698
  952    HB3  LEU 112           HB3      LEU 112  13.750  -5.471   4.165
  953    HG   LEU 112           HG       LEU 112  15.461  -5.428   2.292
  954   HD11  LEU 112          HD11      LEU 112  14.474  -3.598   1.011
  955   HD12  LEU 112          HD12      LEU 112  14.779  -2.488   2.349
  956   HD13  LEU 112          HD13      LEU 112  16.131  -3.219   1.483
  957   HD21  LEU 112          HD21      LEU 112  15.728  -3.416   4.521
  958   HD22  LEU 112          HD22      LEU 112  16.093  -5.139   4.618
  959   HD23  LEU 112          HD23      LEU 112  17.056  -4.090   3.577
  960    H    MET 113           H        MET 113  11.815  -7.206   3.734
  961    HA   MET 113           HA       MET 113  13.458  -9.368   3.055
  962    HB2  MET 113           HB2      MET 113  11.965  -9.272   5.029
  963    HB3  MET 113           HB3      MET 113  10.575  -9.406   3.968
  964    HG2  MET 113           HG2      MET 113  11.306 -11.615   3.259
  965    HG3  MET 113           HG3      MET 113  12.722 -11.487   4.303
  966    HE1  MET 113           HE1      MET 113   8.799 -11.655   4.179
  967    HE2  MET 113           HE2      MET 113   8.389 -11.608   5.894
  968    HE3  MET 113           HE3      MET 113   9.096 -10.190   5.118
  969    H    THR 114           H        THR 114  10.388  -8.286   1.778
  970    HA   THR 114           HA       THR 114   9.993 -10.419  -0.040
  971    HB   THR 114           HB       THR 114   8.851  -7.626   0.021
  972    HG1  THR 114           HG1      THR 114   8.008 -10.148   1.037
  973   HG21  THR 114          HG21      THR 114   7.881 -10.036  -1.528
  974   HG22  THR 114          HG22      THR 114   8.664  -8.621  -2.234
  975   HG23  THR 114          HG23      THR 114   7.090  -8.461  -1.450
  976    H    ILE 115           H        ILE 115  11.759  -7.376  -0.233
  977    HA   ILE 115           HA       ILE 115  11.972  -7.411  -3.097
  978    HB   ILE 115           HB       ILE 115  13.580  -5.831  -1.083
  979   HG12  ILE 115          HG12      ILE 115  11.174  -4.967  -2.701
  980   HG13  ILE 115          HG13      ILE 115  11.116  -5.419  -1.000
  981   HG21  ILE 115          HG21      ILE 115  13.214  -5.454  -4.054
  982   HG22  ILE 115          HG22      ILE 115  14.083  -4.358  -2.981
  983   HG23  ILE 115          HG23      ILE 115  14.685  -5.995  -3.245
  984   HD11  ILE 115          HD11      ILE 115  12.611  -3.571  -0.460
  985   HD12  ILE 115          HD12      ILE 115  12.672  -3.122  -2.164
  986   HD13  ILE 115          HD13      ILE 115  11.152  -3.010  -1.276
  987    H    CYS 116           H        CYS 116  14.167  -8.093  -0.382
  988    HA   CYS 116           HA       CYS 116  16.424  -8.653  -1.980
  989    HB2  CYS 116           HB2      CYS 116  17.457  -9.453   0.027
  990    HB3  CYS 116           HB3      CYS 116  16.442  -8.086   0.472
  991    HG   CYS 116           HG       CYS 116  16.198 -11.321   1.354
  992    H    ALA 117           H        ALA 117  13.746 -10.592  -0.893
  993    HA   ALA 117           HA       ALA 117  14.804 -13.148  -1.387
  994    HB1  ALA 117           HB1      ALA 117  12.783 -12.770  -0.064
  995    HB2  ALA 117           HB2      ALA 117  11.929 -12.250  -1.516
  996    HB3  ALA 117           HB3      ALA 117  12.492 -13.915  -1.374
  997    H    ARG 118           H        ARG 118  13.563 -10.706  -3.523
  998    HA   ARG 118           HA       ARG 118  12.976 -12.430  -5.716
  999    HB2  ARG 118           HB2      ARG 118  13.742  -9.505  -5.907
 1000    HB3  ARG 118           HB3      ARG 118  12.814 -10.453  -7.065
 1001    HG2  ARG 118           HG2      ARG 118  11.934  -9.640  -4.305
 1002    HG3  ARG 118           HG3      ARG 118  11.339  -9.009  -5.840
 1003    HD2  ARG 118           HD2      ARG 118  11.074 -11.868  -4.927
 1004    HD3  ARG 118           HD3      ARG 118   9.812 -10.647  -4.805
 1005    HE   ARG 118           HE       ARG 118  10.756 -10.904  -7.481
 1006   HH11  ARG 118          HH11      ARG 118   8.608 -12.330  -5.103
 1007   HH12  ARG 118          HH12      ARG 118   7.638 -13.153  -6.294
 1008   HH21  ARG 118          HH21      ARG 118   9.463 -11.957  -9.041
 1009   HH22  ARG 118          HH22      ARG 118   8.102 -12.909  -8.522
 1010    H    ILE 119           H        ILE 119  15.835 -10.686  -4.627
 1011    HA   ILE 119           HA       ILE 119  17.391 -11.359  -6.947
 1012    HB   ILE 119           HB       ILE 119  18.609 -10.596  -4.314
 1013   HG12  ILE 119          HG12      ILE 119  16.663  -9.109  -4.606
 1014   HG13  ILE 119          HG13      ILE 119  18.187  -8.236  -4.739
 1015   HG21  ILE 119          HG21      ILE 119  20.061 -11.089  -6.209
 1016   HG22  ILE 119          HG22      ILE 119  19.236  -9.860  -7.169
 1017   HG23  ILE 119          HG23      ILE 119  20.175  -9.389  -5.751
 1018   HD11  ILE 119          HD11      ILE 119  17.972  -8.270  -7.180
 1019   HD12  ILE 119          HD12      ILE 119  16.429  -9.109  -7.020
 1020   HD13  ILE 119          HD13      ILE 119  16.608  -7.468  -6.400
 1021    H    GLY 120           H        GLY 120  16.952 -12.531  -3.667
 1022    HA2  GLY 120           HA2      GLY 120  17.222 -14.950  -3.316
 1023    HA3  GLY 120           HA3      GLY 120  18.656 -14.843  -4.327
 1024    H    ILE 121           H        ILE 121  18.073 -12.259  -2.152
 1025    HA   ILE 121           HA       ILE 121  20.447 -12.988  -0.639
 1026    HB   ILE 121           HB       ILE 121  18.742 -10.506  -0.420
 1027   HG12  ILE 121          HG12      ILE 121  21.362 -10.872  -1.886
 1028   HG13  ILE 121          HG13      ILE 121  19.786 -10.807  -2.669
 1029   HG21  ILE 121          HG21      ILE 121  20.047 -10.936   1.579
 1030   HG22  ILE 121          HG22      ILE 121  21.508 -11.119   0.607
 1031   HG23  ILE 121          HG23      ILE 121  20.705  -9.552   0.707
 1032   HD11  ILE 121          HD11      ILE 121  20.945  -8.676  -2.822
 1033   HD12  ILE 121          HD12      ILE 121  19.477  -8.526  -1.855
 1034   HD13  ILE 121          HD13      ILE 121  21.051  -8.594  -1.064
 1035    H    THR 122           H        THR 122  20.285 -14.128   1.161
 1036    HA   THR 122           HA       THR 122  17.723 -14.605   2.372
 1037    HB   THR 122           HB       THR 122  20.444 -15.535   3.307
 1038    HG1  THR 122           HG1      THR 122  19.973 -17.410   2.076
 1039   HG21  THR 122          HG21      THR 122  17.672 -16.624   3.818
 1040   HG22  THR 122          HG22      THR 122  18.672 -15.760   4.986
 1041   HG23  THR 122          HG23      THR 122  19.182 -17.338   4.383
 1042    H    ASN 123           H        ASN 123  20.804 -13.177   3.519
 1043    HA   ASN 123           HA       ASN 123  19.510 -12.318   5.971
 1044    HB2  ASN 123           HB2      ASN 123  21.898 -13.140   5.893
 1045    HB3  ASN 123           HB3      ASN 123  22.312 -11.657   5.037
 1046   HD21  ASN 123          HD21      ASN 123  23.698 -11.039   6.699
 1047   HD22  ASN 123          HD22      ASN 123  23.099 -10.429   8.208
 1048    H    HIS 124           H        HIS 124  18.128 -10.697   5.715
 1049    HA   HIS 124           HA       HIS 124  18.868  -8.489   3.916
 1050    HB2  HIS 124           HB2      HIS 124  16.479  -7.914   3.870
 1051    HB3  HIS 124           HB3      HIS 124  16.758  -9.565   3.334
 1052    HD1  HIS 124           HD1      HIS 124  14.976  -7.563   5.890
 1053    HD2  HIS 124           HD2      HIS 124  15.885 -11.562   5.192
 1054    HE1  HIS 124           HE1      HIS 124  13.388  -8.879   7.328
 1055    HE2  HIS 124           HE2      HIS 124  14.014 -11.303   6.959
 1056    H    ASP 125           H        ASP 125  18.933  -9.251   7.111
 1057    HA   ASP 125           HA       ASP 125  17.832  -6.884   8.240
 1058    HB2  ASP 125           HB2      ASP 125  19.565  -9.092   9.311
 1059    HB3  ASP 125           HB3      ASP 125  19.229  -7.658  10.279
 1060    H    GLU 126           H        GLU 126  20.811  -7.661   6.726
 1061    HA   GLU 126           HA       GLU 126  22.452  -5.721   8.015
 1062    HB2  GLU 126           HB2      GLU 126  22.749  -6.896   5.248
 1063    HB3  GLU 126           HB3      GLU 126  23.977  -5.994   6.111
 1064    HG2  GLU 126           HG2      GLU 126  23.901  -7.803   7.859
 1065    HG3  GLU 126           HG3      GLU 126  22.902  -8.718   6.737
 1066    H    TYR 127           H        TYR 127  19.891  -5.441   5.815
 1067    HA   TYR 127           HA       TYR 127  21.093  -3.121   4.496
 1068    HB2  TYR 127           HB2      TYR 127  18.671  -4.724   3.678
 1069    HB3  TYR 127           HB3      TYR 127  19.437  -3.441   2.746
 1070    HD1  TYR 127           HD1      TYR 127  22.035  -3.832   2.344
 1071    HD2  TYR 127           HD2      TYR 127  19.197  -6.887   3.146
 1072    HE1  TYR 127           HE1      TYR 127  23.525  -5.472   1.305
 1073    HE2  TYR 127           HE2      TYR 127  20.676  -8.544   2.122
 1074    HH   TYR 127           HH       TYR 127  23.918  -7.959   1.450
 1075    H    SER 128           H        SER 128  20.198  -1.161   4.476
 1076    HA   SER 128           HA       SER 128  17.650  -0.776   5.880
 1077    HB2  SER 128           HB2      SER 128  18.429   1.668   5.850
 1078    HB3  SER 128           HB3      SER 128  19.304   0.580   6.930
 1079    HG   SER 128           HG       SER 128  20.568   2.039   5.482
 1080    H    LEU 129           H        LEU 129  16.351   1.094   4.820
 1081    HA   LEU 129           HA       LEU 129  16.635   0.789   1.905
 1082    HB2  LEU 129           HB2      LEU 129  14.462   0.103   3.383
 1083    HB3  LEU 129           HB3      LEU 129  14.062   1.765   2.993
 1084    HG   LEU 129           HG       LEU 129  14.785  -0.263   0.878
 1085   HD11  LEU 129          HD11      LEU 129  12.043   0.477   1.890
 1086   HD12  LEU 129          HD12      LEU 129  12.389  -0.527   0.481
 1087   HD13  LEU 129          HD13      LEU 129  12.841  -1.083   2.094
 1088   HD21  LEU 129          HD21      LEU 129  14.969   2.048   0.174
 1089   HD22  LEU 129          HD22      LEU 129  13.573   1.293  -0.590
 1090   HD23  LEU 129          HD23      LEU 129  13.347   2.386   0.776
 1091    H    VAL 130           H        VAL 130  16.565   2.666   0.646
 1092    HA   VAL 130           HA       VAL 130  16.233   5.197   2.056
 1093    HB   VAL 130           HB       VAL 130  18.664   4.682   2.095
 1094   HG11  VAL 130          HG11      VAL 130  18.876   3.410   0.075
 1095   HG12  VAL 130          HG12      VAL 130  18.444   4.818  -0.895
 1096   HG13  VAL 130          HG13      VAL 130  19.952   4.805   0.022
 1097   HG21  VAL 130          HG21      VAL 130  17.896   7.020   0.374
 1098   HG22  VAL 130          HG22      VAL 130  17.959   6.981   2.136
 1099   HG23  VAL 130          HG23      VAL 130  19.442   6.816   1.199
 1100    H    ARG 131           H        ARG 131  15.077   6.609   0.880
 1101    HA   ARG 131           HA       ARG 131  14.487   5.789  -1.891
 1102    HB2  ARG 131           HB2      ARG 131  12.627   7.209   0.020
 1103    HB3  ARG 131           HB3      ARG 131  12.225   6.558  -1.564
 1104    HG2  ARG 131           HG2      ARG 131  12.713   4.290  -0.718
 1105    HG3  ARG 131           HG3      ARG 131  13.004   4.980   0.880
 1106    HD2  ARG 131           HD2      ARG 131  10.771   4.131   0.834
 1107    HD3  ARG 131           HD3      ARG 131  10.691   5.894   0.829
 1108    HE   ARG 131           HE       ARG 131  10.447   5.555  -1.710
 1109   HH11  ARG 131          HH11      ARG 131   9.174   3.406   0.730
 1110   HH12  ARG 131          HH12      ARG 131   7.835   2.878  -0.235
 1111   HH21  ARG 131          HH21      ARG 131   8.671   4.874  -3.003
 1112   HH22  ARG 131          HH22      ARG 131   7.548   3.720  -2.359
 1113    H    GLU 132           H        GLU 132  15.713   7.121  -3.069
 1114    HA   GLU 132           HA       GLU 132  15.946   9.922  -2.504
 1115    HB2  GLU 132           HB2      GLU 132  16.759   8.257  -4.896
 1116    HB3  GLU 132           HB3      GLU 132  17.070   9.985  -4.764
 1117    HG2  GLU 132           HG2      GLU 132  18.353   9.508  -2.679
 1118    HG3  GLU 132           HG3      GLU 132  18.156   7.788  -3.026
 1119    H    LEU 133           H        LEU 133  14.283  11.245  -2.781
 1120    HA   LEU 133           HA       LEU 133  12.384  10.636  -4.929
 1121    HB2  LEU 133           HB2      LEU 133  11.948  12.614  -2.715
 1122    HB3  LEU 133           HB3      LEU 133  10.759  11.928  -3.790
 1123    HG   LEU 133           HG       LEU 133  12.176  10.533  -1.531
 1124   HD11  LEU 133          HD11      LEU 133  10.355  11.977  -0.849
 1125   HD12  LEU 133          HD12      LEU 133   9.290  11.244  -2.051
 1126   HD13  LEU 133          HD13      LEU 133   9.869  10.287  -0.681
 1127   HD21  LEU 133          HD21      LEU 133  10.854   8.561  -2.120
 1128   HD22  LEU 133          HD22      LEU 133  10.246   9.390  -3.552
 1129   HD23  LEU 133          HD23      LEU 133  11.961   8.999  -3.420
 1130    H    MET 134           H        MET 134  11.178  12.734  -5.527
 1131    HA   MET 134           HA       MET 134  13.150  14.698  -6.504
 1132    HB2  MET 134           HB2      MET 134  11.402  15.159  -8.245
 1133    HB3  MET 134           HB3      MET 134  12.033  13.515  -8.292
 1134    HG2  MET 134           HG2      MET 134   9.771  13.154  -8.494
 1135    HG3  MET 134           HG3      MET 134  10.027  12.960  -6.766
 1136    HE1  MET 134           HE1      MET 134   7.154  13.267  -7.681
 1137    HE2  MET 134           HE2      MET 134   7.636  13.295  -5.983
 1138    HE3  MET 134           HE3      MET 134   6.545  14.530  -6.610
 1139    H    GLU 135           H        GLU 135  10.886  14.237  -4.189
 1140    HA   GLU 135           HA       GLU 135   9.101  16.308  -4.195
 1141    HB2  GLU 135           HB2      GLU 135  10.502  14.818  -2.018
 1142    HB3  GLU 135           HB3      GLU 135   9.429  16.151  -1.608
 1143    HG2  GLU 135           HG2      GLU 135   8.663  13.719  -3.211
 1144    HG3  GLU 135           HG3      GLU 135   8.314  13.974  -1.501
 1145    H    GLU 136           H        GLU 136   9.313  18.410  -4.302
 1146    HA   GLU 136           HA       GLU 136  11.815  19.704  -3.955
 1147    HB2  GLU 136           HB2      GLU 136  10.576  21.766  -4.407
 1148    HB3  GLU 136           HB3      GLU 136  10.145  20.500  -5.550
 1149    HG2  GLU 136           HG2      GLU 136   8.079  20.092  -4.425
 1150    HG3  GLU 136           HG3      GLU 136   8.523  21.186  -3.117
 1151    H    LYS 137           H        LYS 137   9.075  19.120  -1.915
 1152    HA   LYS 137           HA       LYS 137   9.747  21.128   0.021
 1153    HB2  LYS 137           HB2      LYS 137   7.924  18.753   0.355
 1154    HB3  LYS 137           HB3      LYS 137   8.005  20.166   1.398
 1155    HG2  LYS 137           HG2      LYS 137   6.971  19.982  -1.408
 1156    HG3  LYS 137           HG3      LYS 137   6.126  20.482   0.049
 1157    HD2  LYS 137           HD2      LYS 137   7.506  22.490   0.177
 1158    HD3  LYS 137           HD3      LYS 137   8.352  21.994  -1.292
 1159    HE2  LYS 137           HE2      LYS 137   6.154  21.990  -2.467
 1160    HE3  LYS 137           HE3      LYS 137   5.434  22.669  -1.009
 1161    HZ1  LYS 137           HZ1      LYS 137   5.939  24.405  -2.588
 1162    HZ2  LYS 137           HZ2      LYS 137   7.557  23.917  -2.670
 1163    HZ3  LYS 137           HZ3      LYS 137   6.944  24.572  -1.231
 1164    H    LYS 138           H        LYS 138   9.759  17.566   0.165
 1165    HA   LYS 138           HA       LYS 138  11.386  17.488   2.496
 1166    HB2  LYS 138           HB2      LYS 138   9.801  15.692   1.867
 1167    HB3  LYS 138           HB3      LYS 138  10.806  15.310   0.482
 1168    HG2  LYS 138           HG2      LYS 138  12.543  14.494   1.835
 1169    HG3  LYS 138           HG3      LYS 138  11.842  15.198   3.293
 1170    HD2  LYS 138           HD2      LYS 138  10.464  13.077   1.666
 1171    HD3  LYS 138           HD3      LYS 138  11.540  12.706   3.014
 1172    HE2  LYS 138           HE2      LYS 138   9.089  14.453   3.212
 1173    HE3  LYS 138           HE3      LYS 138   9.127  12.737   3.617
 1174    HZ1  LYS 138           HZ1      LYS 138   9.371  14.143   5.575
 1175    HZ2  LYS 138           HZ2      LYS 138  10.771  14.845   4.923
 1176    HZ3  LYS 138           HZ3      LYS 138  10.757  13.198   5.329
 1177    H    ASP 169           H        ASP 169  12.130  16.175  -0.726
 1178    HA   ASP 169           HA       ASP 169  14.089  15.744  -1.782
 1179    HB2  ASP 169           HB2      ASP 169  13.895  18.200  -2.136
 1180    HB3  ASP 169           HB3      ASP 169  14.884  18.457  -0.701
 1181    H    GLU 170           H        GLU 170  14.407  14.074  -0.202
 1182    HA   GLU 170           HA       GLU 170  17.039  14.405   1.005
 1183    HB2  GLU 170           HB2      GLU 170  14.657  13.185   2.421
 1184    HB3  GLU 170           HB3      GLU 170  16.318  13.044   2.976
 1185    HG2  GLU 170           HG2      GLU 170  16.395  15.533   3.126
 1186    HG3  GLU 170           HG3      GLU 170  14.666  15.548   2.774
 1187    H    LEU 171           H        LEU 171  17.959  12.219   1.575
 1188    HA   LEU 171           HA       LEU 171  17.571  10.330  -0.524
 1189    HB2  LEU 171           HB2      LEU 171  18.941   9.876   2.129
 1190    HB3  LEU 171           HB3      LEU 171  19.158   8.947   0.657
 1191    HG   LEU 171           HG       LEU 171  20.031  11.769   1.171
 1192   HD11  LEU 171          HD11      LEU 171  21.582   9.248   0.603
 1193   HD12  LEU 171          HD12      LEU 171  22.272  10.859   0.800
 1194   HD13  LEU 171          HD13      LEU 171  21.465  10.072   2.157
 1195   HD21  LEU 171          HD21      LEU 171  20.178  10.142  -1.365
 1196   HD22  LEU 171          HD22      LEU 171  19.206  11.596  -1.105
 1197   HD23  LEU 171          HD23      LEU 171  20.969  11.699  -1.108
 1198    H    ASN 172           H        ASN 172  16.190  10.916   2.543
 1199    HA   ASN 172           HA       ASN 172  14.691   9.861   3.847
 1200    HB2  ASN 172           HB2      ASN 172  13.831   9.036   1.090
 1201    HB3  ASN 172           HB3      ASN 172  12.945   8.507   2.518
 1202   HD21  ASN 172          HD21      ASN 172  12.260  10.349   0.270
 1203   HD22  ASN 172          HD22      ASN 172  11.732  11.793   1.047
 1204    H    TRP 173           H        TRP 173  16.286   8.572   4.938
 1205    HA   TRP 173           HA       TRP 173  16.773   5.894   3.947
 1206    HB2  TRP 173           HB2      TRP 173  17.633   7.334   6.472
 1207    HB3  TRP 173           HB3      TRP 173  18.073   5.677   6.087
 1208    HD1  TRP 173           HD1      TRP 173  18.718   9.280   4.893
 1209    HE1  TRP 173           HE1      TRP 173  20.964   9.328   3.658
 1210    HE3  TRP 173           HE3      TRP 173  19.703   4.271   4.853
 1211    HZ2  TRP 173           HZ2      TRP 173  22.906   7.470   2.764
 1212    HZ3  TRP 173           HZ3      TRP 173  21.773   3.485   3.787
 1213    HH2  TRP 173           HH2      TRP 173  23.343   5.052   2.763
 1214    H    LEU 174           H        LEU 174  15.121   4.508   4.238
 1215    HA   LEU 174           HA       LEU 174  13.079   4.901   6.145
 1216    HB2  LEU 174           HB2      LEU 174  13.837   2.373   4.688
 1217    HB3  LEU 174           HB3      LEU 174  12.347   2.637   5.572
 1218    HG   LEU 174           HG       LEU 174  13.194   3.766   2.937
 1219   HD11  LEU 174          HD11      LEU 174  10.879   3.069   2.371
 1220   HD12  LEU 174          HD12      LEU 174  11.908   1.740   2.911
 1221   HD13  LEU 174          HD13      LEU 174  10.715   2.432   4.011
 1222   HD21  LEU 174          HD21      LEU 174  12.581   5.722   4.205
 1223   HD22  LEU 174          HD22      LEU 174  11.277   5.331   3.081
 1224   HD23  LEU 174          HD23      LEU 174  11.123   4.926   4.792
 1225    H    ASP 175           H        ASP 175  13.190   4.696   8.170
 1226    HA   ASP 175           HA       ASP 175  15.455   3.697   9.553
 1227    HB2  ASP 175           HB2      ASP 175  12.793   4.294  10.829
 1228    HB3  ASP 175           HB3      ASP 175  14.404   4.515  11.501
 1229    H    HIS 176           H        HIS 176  13.068   1.997   8.146
 1230    HA   HIS 176           HA       HIS 176  12.242  -0.098   8.314
 1231    HB2  HIS 176           HB2      HIS 176  14.468  -0.302  10.307
 1232    HB3  HIS 176           HB3      HIS 176  13.311  -1.620  10.136
 1233    HD1  HIS 176           HD1      HIS 176  13.266  -2.844   7.824
 1234    HD2  HIS 176           HD2      HIS 176  16.370  -0.151   8.328
 1235    HE1  HIS 176           HE1      HIS 176  14.833  -3.254   5.902
 1236    HE2  HIS 176           HE2      HIS 176  16.874  -1.904   6.492
 1237    H    GLY 177           H        GLY 177  10.941   2.027   9.604
 1238    HA2  GLY 177           HA2      GLY 177   9.427   0.516  11.583
 1239    HA3  GLY 177           HA3      GLY 177  10.211   1.975  12.162
 1240    H    ARG 178           H        ARG 178   9.798   3.629   9.913
 1241    HA   ARG 178           HA       ARG 178   7.143   4.461  10.571
 1242    HB2  ARG 178           HB2      ARG 178   7.635   6.460   9.477
 1243    HB3  ARG 178           HB3      ARG 178   9.209   5.937  10.063
 1244    HG2  ARG 178           HG2      ARG 178   9.840   5.160   7.900
 1245    HG3  ARG 178           HG3      ARG 178   8.207   5.403   7.279
 1246    HD2  ARG 178           HD2      ARG 178   9.395   7.248   6.492
 1247    HD3  ARG 178           HD3      ARG 178   8.540   7.858   7.907
 1248    HE   ARG 178           HE       ARG 178  11.059   6.948   8.706
 1249   HH11  ARG 178          HH11      ARG 178   9.565   9.581   6.935
 1250   HH12  ARG 178          HH12      ARG 178  10.932  10.641   7.137
 1251   HH21  ARG 178          HH21      ARG 178  12.832   8.309   8.957
 1252   HH22  ARG 178          HH22      ARG 178  12.796   9.920   8.297
 1253    H    THR 179           H        THR 179   5.618   5.176   8.861
 1254    HA   THR 179           HA       THR 179   5.164   3.085   6.914
 1255    HB   THR 179           HB       THR 179   3.243   3.968   8.067
 1256    HG1  THR 179           HG1      THR 179   2.956   3.413   5.829
 1257   HG21  THR 179          HG21      THR 179   4.143   6.190   8.592
 1258   HG22  THR 179          HG22      THR 179   2.544   6.307   7.854
 1259   HG23  THR 179          HG23      THR 179   3.986   6.653   6.898
 1260    H    LEU 180           H        LEU 180   4.575   3.755   4.654
 1261    HA   LEU 180           HA       LEU 180   6.797   5.292   3.592
 1262    HB2  LEU 180           HB2      LEU 180   4.659   3.783   2.100
 1263    HB3  LEU 180           HB3      LEU 180   6.238   4.267   1.504
 1264    HG   LEU 180           HG       LEU 180   5.875   2.334   3.784
 1265   HD11  LEU 180          HD11      LEU 180   6.382   0.566   2.152
 1266   HD12  LEU 180          HD12      LEU 180   4.830   1.355   1.865
 1267   HD13  LEU 180          HD13      LEU 180   6.221   1.752   0.855
 1268   HD21  LEU 180          HD21      LEU 180   8.038   3.506   3.624
 1269   HD22  LEU 180          HD22      LEU 180   8.179   1.766   3.358
 1270   HD23  LEU 180          HD23      LEU 180   8.231   2.876   1.988
 1271    H    ARG 181           H        ARG 181   3.371   5.535   3.994
 1272    HA   ARG 181           HA       ARG 181   2.763   7.411   1.996
 1273    HB2  ARG 181           HB2      ARG 181   1.464   6.257   4.331
 1274    HB3  ARG 181           HB3      ARG 181   0.991   7.928   4.057
 1275    HG2  ARG 181           HG2      ARG 181   0.140   7.442   1.918
 1276    HG3  ARG 181           HG3      ARG 181   0.925   5.861   1.881
 1277    HD2  ARG 181           HD2      ARG 181  -1.153   6.569   3.930
 1278    HD3  ARG 181           HD3      ARG 181  -1.579   5.914   2.352
 1279    HE   ARG 181           HE       ARG 181  -0.279   3.928   2.933
 1280   HH11  ARG 181          HH11      ARG 181  -1.253   6.064   5.545
 1281   HH12  ARG 181          HH12      ARG 181  -1.146   4.830   6.761
 1282   HH21  ARG 181          HH21      ARG 181  -0.108   2.311   4.546
 1283   HH22  ARG 181          HH22      ARG 181  -0.496   2.687   6.199
 1284    H    GLU 182           H        GLU 182   4.051   7.813   5.225
 1285    HA   GLU 182           HA       GLU 182   3.394  10.579   5.453
 1286    HB2  GLU 182           HB2      GLU 182   4.646  10.515   7.505
 1287    HB3  GLU 182           HB3      GLU 182   3.708   9.040   7.382
 1288    HG2  GLU 182           HG2      GLU 182   5.628   8.063   7.989
 1289    HG3  GLU 182           HG3      GLU 182   6.024   8.221   6.281
 1290    H    GLN 183           H        GLN 183   5.777   8.908   3.776
 1291    HA   GLN 183           HA       GLN 183   7.896  10.856   4.041
 1292    HB2  GLN 183           HB2      GLN 183   7.657   8.506   2.161
 1293    HB3  GLN 183           HB3      GLN 183   9.126   9.383   2.555
 1294    HG2  GLN 183           HG2      GLN 183   9.137   8.545   4.765
 1295    HG3  GLN 183           HG3      GLN 183   7.511   7.884   4.587
 1296   HE21  GLN 183          HE21      GLN 183   8.121   5.832   5.078
 1297   HE22  GLN 183          HE22      GLN 183   9.077   4.846   4.027
 1298    H    GLY 184           H        GLY 184   5.200  10.317   1.993
 1299    HA2  GLY 184           HA2      GLY 184   4.455  11.458   0.132
 1300    HA3  GLY 184           HA3      GLY 184   5.821  12.551   0.315
 1301    H    VAL 185           H        VAL 185   6.486   9.193   0.212
 1302    HA   VAL 185           HA       VAL 185   8.048   9.459  -2.155
 1303    HB   VAL 185           HB       VAL 185   8.427   7.018  -1.891
 1304   HG11  VAL 185          HG11      VAL 185   9.836   8.639  -0.727
 1305   HG12  VAL 185          HG12      VAL 185   8.721   8.631   0.640
 1306   HG13  VAL 185          HG13      VAL 185   9.627   7.173   0.231
 1307   HG21  VAL 185          HG21      VAL 185   7.518   5.884   0.089
 1308   HG22  VAL 185          HG22      VAL 185   6.556   7.314   0.460
 1309   HG23  VAL 185          HG23      VAL 185   6.239   6.396  -1.012
 1310    H    GLU 186           H        GLU 186   7.759   8.431  -4.145
 1311    HA   GLU 186           HA       GLU 186   5.022   7.553  -4.729
 1312    HB2  GLU 186           HB2      GLU 186   7.137   8.642  -6.603
 1313    HB3  GLU 186           HB3      GLU 186   5.545   8.086  -7.091
 1314    HG2  GLU 186           HG2      GLU 186   6.085  10.394  -5.240
 1315    HG3  GLU 186           HG3      GLU 186   5.697  10.525  -6.954
 1316    H    GLU 187           H        GLU 187   5.167   6.036  -6.809
 1317    HA   GLU 187           HA       GLU 187   6.684   3.748  -5.905
 1318    HB2  GLU 187           HB2      GLU 187   4.652   4.174  -8.080
 1319    HB3  GLU 187           HB3      GLU 187   5.516   2.655  -7.906
 1320    HG2  GLU 187           HG2      GLU 187   3.454   2.355  -6.822
 1321    HG3  GLU 187           HG3      GLU 187   4.645   2.565  -5.543
 1322    H    HIS 188           H        HIS 188   6.717   5.994  -8.582
 1323    HA   HIS 188           HA       HIS 188   8.642   4.547 -10.145
 1324    HB2  HIS 188           HB2      HIS 188   8.644   6.559 -11.572
 1325    HB3  HIS 188           HB3      HIS 188   7.009   6.015 -11.215
 1326    HD1  HIS 188           HD1      HIS 188   5.448   7.727 -10.286
 1327    HD2  HIS 188           HD2      HIS 188   9.429   8.870  -9.914
 1328    HE1  HIS 188           HE1      HIS 188   5.400  10.092  -9.433
 1329    HE2  HIS 188           HE2      HIS 188   7.809  10.847  -9.510
 1330    H    GLU 189           H        GLU 189   9.033   6.197  -7.324
 1331    HA   GLU 189           HA       GLU 189  11.325   7.792  -8.000
 1332    HB2  GLU 189           HB2      GLU 189  10.138   6.993  -5.342
 1333    HB3  GLU 189           HB3      GLU 189  11.489   8.101  -5.536
 1334    HG2  GLU 189           HG2      GLU 189   8.808   8.550  -6.802
 1335    HG3  GLU 189           HG3      GLU 189   9.252   9.170  -5.212
 1336    H    THR 190           H        THR 190  13.470   7.311  -7.726
 1337    HA   THR 190           HA       THR 190  14.145   4.556  -7.687
 1338    HB   THR 190           HB       THR 190  16.107   6.830  -7.388
 1339    HG1  THR 190           HG1      THR 190  15.435   7.461  -9.300
 1340   HG21  THR 190          HG21      THR 190  17.594   5.297  -8.608
 1341   HG22  THR 190          HG22      THR 190  16.310   4.089  -8.656
 1342   HG23  THR 190          HG23      THR 190  17.013   4.568  -7.111
 1343    H    LEU 191           H        LEU 191  14.257   3.336  -5.982
 1344    HA   LEU 191           HA       LEU 191  15.120   4.489  -3.408
 1345    HB2  LEU 191           HB2      LEU 191  13.778   1.831  -3.589
 1346    HB3  LEU 191           HB3      LEU 191  13.722   3.018  -2.300
 1347    HG   LEU 191           HG       LEU 191  12.265   3.232  -4.936
 1348   HD11  LEU 191          HD11      LEU 191  11.260   2.601  -2.172
 1349   HD12  LEU 191          HD12      LEU 191  10.254   2.880  -3.594
 1350   HD13  LEU 191          HD13      LEU 191  11.340   1.491  -3.540
 1351   HD21  LEU 191          HD21      LEU 191  12.845   5.420  -4.072
 1352   HD22  LEU 191          HD22      LEU 191  11.116   5.131  -3.885
 1353   HD23  LEU 191          HD23      LEU 191  12.190   4.994  -2.491
 1354    H    LEU 192           H        LEU 192  16.909   3.519  -2.392
 1355    HA   LEU 192           HA       LEU 192  18.289   1.577  -4.119
 1356    HB2  LEU 192           HB2      LEU 192  19.727   3.329  -2.179
 1357    HB3  LEU 192           HB3      LEU 192  20.281   2.677  -3.711
 1358    HG   LEU 192           HG       LEU 192  18.223   4.874  -3.491
 1359   HD11  LEU 192          HD11      LEU 192  21.172   5.124  -4.015
 1360   HD12  LEU 192          HD12      LEU 192  19.984   6.431  -4.029
 1361   HD13  LEU 192          HD13      LEU 192  20.352   5.588  -2.523
 1362   HD21  LEU 192          HD21      LEU 192  18.702   5.257  -5.826
 1363   HD22  LEU 192          HD22      LEU 192  19.915   3.972  -5.818
 1364   HD23  LEU 192          HD23      LEU 192  18.211   3.579  -5.585
 1365    H    LEU 193           H        LEU 193  18.755  -0.353  -3.224
 1366    HA   LEU 193           HA       LEU 193  18.283  -0.809  -0.426
 1367    HB2  LEU 193           HB2      LEU 193  17.782  -2.482  -2.201
 1368    HB3  LEU 193           HB3      LEU 193  19.499  -2.626  -2.516
 1369    HG   LEU 193           HG       LEU 193  18.538  -3.167   0.255
 1370   HD11  LEU 193          HD11      LEU 193  18.048  -5.485  -0.337
 1371   HD12  LEU 193          HD12      LEU 193  16.947  -4.377  -1.156
 1372   HD13  LEU 193          HD13      LEU 193  18.287  -5.106  -2.042
 1373   HD21  LEU 193          HD21      LEU 193  20.339  -4.815   0.170
 1374   HD22  LEU 193          HD22      LEU 193  20.638  -4.406  -1.520
 1375   HD23  LEU 193          HD23      LEU 193  20.922  -3.205  -0.259
 1376    H    ARG 194           H        ARG 194  19.730  -0.473   1.138
 1377    HA   ARG 194           HA       ARG 194  22.548  -0.102   0.347
 1378    HB2  ARG 194           HB2      ARG 194  21.117   1.214   2.661
 1379    HB3  ARG 194           HB3      ARG 194  22.745   1.556   2.092
 1380    HG2  ARG 194           HG2      ARG 194  20.200   2.088   0.584
 1381    HG3  ARG 194           HG3      ARG 194  21.177   3.286   1.432
 1382    HD2  ARG 194           HD2      ARG 194  22.113   1.600  -0.883
 1383    HD3  ARG 194           HD3      ARG 194  21.570   3.276  -0.999
 1384    HE   ARG 194           HE       ARG 194  23.698   2.946   0.899
 1385   HH11  ARG 194          HH11      ARG 194  22.966   3.193  -2.506
 1386   HH12  ARG 194          HH12      ARG 194  24.483   3.920  -2.935
 1387   HH21  ARG 194          HH21      ARG 194  25.713   3.922   0.365
 1388   HH22  ARG 194          HH22      ARG 194  26.049   4.335  -1.289
 1389    H    ARG 195           H        ARG 195  24.111  -1.096   1.558
 1390    HA   ARG 195           HA       ARG 195  23.174  -3.002   3.529
 1391    HB2  ARG 195           HB2      ARG 195  25.072  -3.357   1.761
 1392    HB3  ARG 195           HB3      ARG 195  26.079  -2.539   2.954
 1393    HG2  ARG 195           HG2      ARG 195  25.497  -4.198   4.618
 1394    HG3  ARG 195           HG3      ARG 195  24.426  -4.999   3.469
 1395    HD2  ARG 195           HD2      ARG 195  26.496  -5.249   1.995
 1396    HD3  ARG 195           HD3      ARG 195  27.421  -4.826   3.439
 1397    HE   ARG 195           HE       ARG 195  26.112  -6.778   4.482
 1398   HH11  ARG 195          HH11      ARG 195  27.292  -6.622   1.185
 1399   HH12  ARG 195          HH12      ARG 195  27.241  -8.348   0.949
 1400   HH21  ARG 195          HH21      ARG 195  26.012  -9.034   4.178
 1401   HH22  ARG 195          HH22      ARG 195  26.539  -9.725   2.663
 1402    H    LYS 196           H        LYS 196  22.476  -1.808   5.205
 1403    HA   LYS 196           HA       LYS 196  23.744   0.383   6.395
 1404    HB2  LYS 196           HB2      LYS 196  21.420  -0.095   6.817
 1405    HB3  LYS 196           HB3      LYS 196  21.812  -1.670   7.485
 1406    HG2  LYS 196           HG2      LYS 196  21.210  -0.093   9.224
 1407    HG3  LYS 196           HG3      LYS 196  22.887  -0.610   9.391
 1408    HD2  LYS 196           HD2      LYS 196  23.666   1.458   8.427
 1409    HD3  LYS 196           HD3      LYS 196  22.009   1.961   8.084
 1410    HE2  LYS 196           HE2      LYS 196  22.993   1.366  10.864
 1411    HE3  LYS 196           HE3      LYS 196  23.090   2.969  10.143
 1412    HZ1  LYS 196           HZ1      LYS 196  20.723   3.025   9.917
 1413    HZ2  LYS 196           HZ2      LYS 196  21.096   2.635  11.528
 1414    HZ3  LYS 196           HZ3      LYS 196  20.572   1.424  10.462
 1415    H    PHE 197           H        PHE 197  23.836  -3.073   7.190
 1416    HA   PHE 197           HA       PHE 197  26.067  -2.569   9.027
 1417    HB2  PHE 197           HB2      PHE 197  24.574  -5.161   8.569
 1418    HB3  PHE 197           HB3      PHE 197  25.721  -4.804   9.861
 1419    HD1  PHE 197           HD1      PHE 197  24.783  -2.125  10.715
 1420    HD2  PHE 197           HD2      PHE 197  22.609  -5.628   9.674
 1421    HE1  PHE 197           HE1      PHE 197  22.909  -1.373  12.122
 1422    HE2  PHE 197           HE2      PHE 197  20.730  -4.894  11.069
 1423    HZ   PHE 197           HZ       PHE 197  20.878  -2.761  12.304
 1424    H    PHE 198           H        PHE 198  28.059  -3.524   8.722
 1425    HA   PHE 198           HA       PHE 198  28.462  -4.595   6.004
 1426    HB2  PHE 198           HB2      PHE 198  30.118  -2.630   7.574
 1427    HB3  PHE 198           HB3      PHE 198  30.783  -3.523   6.210
 1428    HD1  PHE 198           HD1      PHE 198  29.656  -3.274   3.958
 1429    HD2  PHE 198           HD2      PHE 198  28.872  -0.685   7.242
 1430    HE1  PHE 198           HE1      PHE 198  28.765  -1.585   2.408
 1431    HE2  PHE 198           HE2      PHE 198  27.980   1.010   5.698
 1432    HZ   PHE 198           HZ       PHE 198  27.928   0.563   3.277
 1433    H    TYR 199           H        TYR 199  27.983  -6.335   8.140
 1434    HA   TYR 199           HA       TYR 199  30.633  -7.400   8.729
 1435    HB2  TYR 199           HB2      TYR 199  29.518  -9.043  10.163
 1436    HB3  TYR 199           HB3      TYR 199  29.100  -7.398  10.605
 1437    HD1  TYR 199           HD1      TYR 199  27.845 -10.572   9.263
 1438    HD2  TYR 199           HD2      TYR 199  26.831  -6.582  10.338
 1439    HE1  TYR 199           HE1      TYR 199  25.470 -11.186   9.283
 1440    HE2  TYR 199           HE2      TYR 199  24.449  -7.186  10.350
 1441    HH   TYR 199           HH       TYR 199  23.377 -10.381  10.370
 1442    H    SER 200           H        SER 200  28.059  -7.793   6.536
 1443    HA   SER 200           HA       SER 200  27.893  -9.005   4.627
 1444    HB2  SER 200           HB2      SER 200  30.775  -9.797   5.049
 1445    HB3  SER 200           HB3      SER 200  29.905  -9.642   3.523
 1446    HG   SER 200           HG       SER 200  31.093  -7.711   5.107
 1447    H    ASP 201           H        ASP 201  26.781 -10.287   6.637
 1448    HA   ASP 201           HA       ASP 201  26.010 -12.302   7.337
 1449    HB2  ASP 201           HB2      ASP 201  25.957 -12.827   4.938
 1450    HB3  ASP 201           HB3      ASP 201  27.635 -13.339   5.002
 1451    H    GLN 202           H        GLN 202  29.009 -11.291   7.777
 1452    HA   GLN 202           HA       GLN 202  29.802 -13.680   9.294
 1453    HB2  GLN 202           HB2      GLN 202  31.292 -13.197   7.357
 1454    HB3  GLN 202           HB3      GLN 202  31.640 -11.621   8.056
 1455    HG2  GLN 202           HG2      GLN 202  33.417 -13.231   8.500
 1456    HG3  GLN 202           HG3      GLN 202  32.655 -12.668   9.988
 1457   HE21  GLN 202          HE21      GLN 202  31.365 -14.075  11.166
 1458   HE22  GLN 202          HE22      GLN 202  31.406 -15.786  10.922
  Start of MODEL    4
    1    H1   GLY  -5           H1       GLY  -5 -28.134 -18.655   2.878
    2    H2   GLY  -5           H2       GLY  -5 -27.381 -17.171   3.194
    3    H3   GLY  -5           H3       GLY  -5 -27.196 -17.910   1.681
    4    HA2  GLY  -5           HA2      GLY  -5 -29.543 -17.622   1.215
    5    HA3  GLY  -5           HA3      GLY  -5 -29.738 -16.853   2.787
    6    H    ILE  -4           H        ILE  -4 -30.600 -15.171   1.148
    7    HA   ILE  -4           HA       ILE  -4 -28.387 -13.576   0.069
    8    HB   ILE  -4           HB       ILE  -4 -31.368 -13.310  -0.392
    9   HG12  ILE  -4          HG12      ILE  -4 -30.588 -13.771  -2.807
   10   HG13  ILE  -4          HG13      ILE  -4 -29.094 -14.350  -2.079
   11   HG21  ILE  -4          HG21      ILE  -4 -30.781 -11.582  -2.036
   12   HG22  ILE  -4          HG22      ILE  -4 -30.313 -11.123  -0.398
   13   HG23  ILE  -4          HG23      ILE  -4 -29.092 -11.694  -1.537
   14   HD11  ILE  -4          HD11      ILE  -4 -30.593 -16.182  -2.589
   15   HD12  ILE  -4          HD12      ILE  -4 -30.359 -16.039  -0.847
   16   HD13  ILE  -4          HD13      ILE  -4 -31.849 -15.455  -1.587
   17    H    ASP  -3           H        ASP  -3 -27.546 -12.275   1.530
   18    HA   ASP  -3           HA       ASP  -3 -29.112 -11.247   3.730
   19    HB2  ASP  -3           HB2      ASP  -3 -26.224 -10.862   2.927
   20    HB3  ASP  -3           HB3      ASP  -3 -26.943 -10.103   4.344
   21    HA   PRO  -2           HA       PRO  -2 -30.158  -7.565   1.483
   22    HB2  PRO  -2           HB2      PRO  -2 -31.865  -6.546   3.272
   23    HB3  PRO  -2           HB3      PRO  -2 -32.259  -7.998   2.342
   24    HG2  PRO  -2           HG2      PRO  -2 -31.343  -7.748   5.171
   25    HG3  PRO  -2           HG3      PRO  -2 -32.538  -8.851   4.471
   26    HD2  PRO  -2           HD2      PRO  -2 -29.898  -9.500   5.046
   27    HD3  PRO  -2           HD3      PRO  -2 -30.952 -10.389   3.930
   28    H    PHE  -1           H        PHE  -1 -30.053  -5.254   1.753
   29    HA   PHE  -1           HA       PHE  -1 -28.294  -4.330   3.899
   30    HB2  PHE  -1           HB2      PHE  -1 -28.215  -3.525   0.982
   31    HB3  PHE  -1           HB3      PHE  -1 -27.254  -2.805   2.260
   32    HD1  PHE  -1           HD1      PHE  -1 -25.499  -4.146   3.384
   33    HD2  PHE  -1           HD2      PHE  -1 -27.597  -5.550  -0.035
   34    HE1  PHE  -1           HE1      PHE  -1 -23.743  -5.833   3.007
   35    HE2  PHE  -1           HE2      PHE  -1 -25.849  -7.243  -0.423
   36    HZ   PHE  -1           HZ       PHE  -1 -23.918  -7.385   1.101
   37    H    THR   0           H        THR   0 -30.040  -3.556   5.028
   38    HA   THR   0           HA       THR   0 -31.950  -1.807   3.763
   39    HB   THR   0           HB       THR   0 -32.865  -1.605   6.117
   40    HG1  THR   0           HG1      THR   0 -31.591  -2.287   7.660
   41   HG21  THR   0          HG21      THR   0 -33.738  -3.904   6.145
   42   HG22  THR   0          HG22      THR   0 -32.513  -4.377   4.968
   43   HG23  THR   0          HG23      THR   0 -33.763  -3.216   4.521
   44    H    MET   1           H        MET   1 -32.105  -0.195   6.394
   45    HA   MET   1           HA       MET   1 -30.436   1.942   5.395
   46    HB2  MET   1           HB2      MET   1 -32.800   2.286   6.184
   47    HB3  MET   1           HB3      MET   1 -32.233   1.996   7.820
   48    HG2  MET   1           HG2      MET   1 -32.454   4.366   7.399
   49    HG3  MET   1           HG3      MET   1 -30.765   3.944   7.659
   50    HE1  MET   1           HE1      MET   1 -29.024   4.686   4.372
   51    HE2  MET   1           HE2      MET   1 -28.897   4.681   6.132
   52    HE3  MET   1           HE3      MET   1 -29.280   3.191   5.272
   53    H    VAL   2           H        VAL   2 -28.932  -0.085   6.220
   54    HA   VAL   2           HA       VAL   2 -27.295   1.292   8.184
   55    HB   VAL   2           HB       VAL   2 -26.480  -0.917   9.068
   56   HG11  VAL   2          HG11      VAL   2 -29.397  -0.317   9.545
   57   HG12  VAL   2          HG12      VAL   2 -28.364  -1.290  10.592
   58   HG13  VAL   2          HG13      VAL   2 -28.030   0.429  10.374
   59   HG21  VAL   2          HG21      VAL   2 -27.908  -2.887   8.805
   60   HG22  VAL   2          HG22      VAL   2 -28.925  -1.996   7.672
   61   HG23  VAL   2          HG23      VAL   2 -27.244  -2.347   7.261
   62    H    ALA   3           H        ALA   3 -26.550   2.068   6.096
   63    HA   ALA   3           HA       ALA   3 -24.544   0.316   4.937
   64    HB1  ALA   3           HB1      ALA   3 -26.767   1.488   3.264
   65    HB2  ALA   3           HB2      ALA   3 -25.335   0.671   2.636
   66    HB3  ALA   3           HB3      ALA   3 -26.509  -0.223   3.606
   67    H    LEU   4           H        LEU   4 -22.975   1.358   3.835
   68    HA   LEU   4           HA       LEU   4 -22.918   4.283   4.183
   69    HB2  LEU   4           HB2      LEU   4 -20.810   2.173   4.462
   70    HB3  LEU   4           HB3      LEU   4 -20.346   3.796   4.001
   71    HG   LEU   4           HG       LEU   4 -21.196   4.686   6.092
   72   HD11  LEU   4          HD11      LEU   4 -21.984   1.866   6.774
   73   HD12  LEU   4          HD12      LEU   4 -22.073   3.268   7.841
   74   HD13  LEU   4          HD13      LEU   4 -23.095   3.186   6.408
   75   HD21  LEU   4          HD21      LEU   4 -19.533   2.226   6.555
   76   HD22  LEU   4          HD22      LEU   4 -18.921   3.795   6.025
   77   HD23  LEU   4          HD23      LEU   4 -19.653   3.628   7.620
   78    H    SER   5           H        SER   5 -22.506   5.488   2.423
   79    HA   SER   5           HA       SER   5 -22.456   4.066  -0.124
   80    HB2  SER   5           HB2      SER   5 -23.074   6.220  -1.127
   81    HB3  SER   5           HB3      SER   5 -24.174   5.802   0.176
   82    HG   SER   5           HG       SER   5 -22.833   8.017  -0.093
   83    H    LEU   6           H        LEU   6 -20.473   3.548  -0.782
   84    HA   LEU   6           HA       LEU   6 -18.318   5.471  -0.212
   85    HB2  LEU   6           HB2      LEU   6 -18.084   2.469  -0.444
   86    HB3  LEU   6           HB3      LEU   6 -16.794   3.588  -0.032
   87    HG   LEU   6           HG       LEU   6 -19.229   2.980   1.654
   88   HD11  LEU   6          HD11      LEU   6 -17.596   1.175   1.644
   89   HD12  LEU   6          HD12      LEU   6 -16.316   2.317   2.060
   90   HD13  LEU   6          HD13      LEU   6 -17.621   1.995   3.205
   91   HD21  LEU   6          HD21      LEU   6 -16.898   4.817   2.196
   92   HD22  LEU   6          HD22      LEU   6 -18.568   5.305   1.903
   93   HD23  LEU   6          HD23      LEU   6 -18.159   4.387   3.352
   94    H    LYS   7           H        LYS   7 -17.327   6.295  -1.894
   95    HA   LYS   7           HA       LYS   7 -17.817   5.340  -4.558
   96    HB2  LYS   7           HB2      LYS   7 -16.299   7.580  -3.337
   97    HB3  LYS   7           HB3      LYS   7 -15.765   7.027  -4.917
   98    HG2  LYS   7           HG2      LYS   7 -18.060   7.374  -5.765
   99    HG3  LYS   7           HG3      LYS   7 -18.499   8.047  -4.191
  100    HD2  LYS   7           HD2      LYS   7 -16.982   9.852  -4.444
  101    HD3  LYS   7           HD3      LYS   7 -16.223   9.104  -5.849
  102    HE2  LYS   7           HE2      LYS   7 -18.271   9.384  -7.123
  103    HE3  LYS   7           HE3      LYS   7 -19.066  10.093  -5.715
  104    HZ1  LYS   7           HZ1      LYS   7 -16.760  11.221  -7.213
  105    HZ2  LYS   7           HZ2      LYS   7 -17.361  11.868  -5.767
  106    HZ3  LYS   7           HZ3      LYS   7 -18.340  11.843  -7.154
  107    H    ILE   8           H        ILE   8 -16.909   3.499  -5.217
  108    HA   ILE   8           HA       ILE   8 -14.331   2.714  -4.109
  109    HB   ILE   8           HB       ILE   8 -16.170   1.187  -5.961
  110   HG12  ILE   8          HG12      ILE   8 -17.234   1.531  -3.794
  111   HG13  ILE   8          HG13      ILE   8 -16.730  -0.149  -3.950
  112   HG21  ILE   8          HG21      ILE   8 -13.741   0.297  -4.414
  113   HG22  ILE   8          HG22      ILE   8 -14.802  -0.755  -5.352
  114   HG23  ILE   8          HG23      ILE   8 -13.853   0.493  -6.163
  115   HD11  ILE   8          HD11      ILE   8 -16.284   0.718  -1.725
  116   HD12  ILE   8          HD12      ILE   8 -14.786   0.300  -2.556
  117   HD13  ILE   8          HD13      ILE   8 -15.273   1.989  -2.413
  118    H    SER   9           H        SER   9 -12.759   3.824  -5.125
  119    HA   SER   9           HA       SER   9 -12.827   3.918  -8.058
  120    HB2  SER   9           HB2      SER   9 -11.075   5.446  -6.119
  121    HB3  SER   9           HB3      SER   9 -11.049   5.625  -7.867
  122    HG   SER   9           HG       SER   9 -13.542   5.861  -6.764
  123    H    ILE  10           H        ILE  10 -11.396   2.782  -9.248
  124    HA   ILE  10           HA       ILE  10  -9.334   1.266  -7.785
  125    HB   ILE  10           HB       ILE  10 -11.047   0.183 -10.036
  126   HG12  ILE  10          HG12      ILE  10 -11.078  -0.525  -7.089
  127   HG13  ILE  10          HG13      ILE  10 -12.283   0.476  -7.891
  128   HG21  ILE  10          HG21      ILE  10  -8.968  -1.161  -8.310
  129   HG22  ILE  10          HG22      ILE  10  -9.977  -1.963  -9.512
  130   HG23  ILE  10          HG23      ILE  10  -8.798  -0.753 -10.017
  131   HD11  ILE  10          HD11      ILE  10 -12.934  -1.414  -9.282
  132   HD12  ILE  10          HD12      ILE  10 -11.712  -2.417  -8.499
  133   HD13  ILE  10          HD13      ILE  10 -13.077  -1.800  -7.566
  134    H    GLY  11           H        GLY  11  -7.690   2.630  -8.432
  135    HA2  GLY  11           HA2      GLY  11  -5.951   3.249  -9.809
  136    HA3  GLY  11           HA3      GLY  11  -6.633   2.218 -11.058
  137    H    ASN  12           H        ASN  12  -8.774   3.143 -11.958
  138    HA   ASN  12           HA       ASN  12  -8.545   6.048 -12.329
  139    HB2  ASN  12           HB2      ASN  12  -7.578   5.466 -14.327
  140    HB3  ASN  12           HB3      ASN  12  -8.386   3.917 -14.391
  141   HD21  ASN  12          HD21      ASN  12  -8.698   7.270 -14.907
  142   HD22  ASN  12          HD22      ASN  12 -10.060   7.218 -15.970
  143    H    VAL  13           H        VAL  13 -10.512   3.191 -13.011
  144    HA   VAL  13           HA       VAL  13 -12.944   4.582 -13.382
  145    HB   VAL  13           HB       VAL  13 -12.580   2.334 -14.257
  146   HG11  VAL  13          HG11      VAL  13 -12.470   0.397 -12.814
  147   HG12  VAL  13          HG12      VAL  13 -11.166   1.528 -12.446
  148   HG13  VAL  13          HG13      VAL  13 -12.576   1.430 -11.386
  149   HG21  VAL  13          HG21      VAL  13 -14.669   1.251 -13.561
  150   HG22  VAL  13          HG22      VAL  13 -14.795   2.378 -12.209
  151   HG23  VAL  13          HG23      VAL  13 -14.892   2.975 -13.866
  152    H    VAL  14           H        VAL  14 -14.776   4.642 -11.993
  153    HA   VAL  14           HA       VAL  14 -14.323   4.038  -9.184
  154    HB   VAL  14           HB       VAL  14 -13.794   6.328  -9.073
  155   HG11  VAL  14          HG11      VAL  14 -16.206   6.903 -10.774
  156   HG12  VAL  14          HG12      VAL  14 -15.142   8.108 -10.045
  157   HG13  VAL  14          HG13      VAL  14 -14.518   7.008 -11.274
  158   HG21  VAL  14          HG21      VAL  14 -16.706   5.995  -8.365
  159   HG22  VAL  14          HG22      VAL  14 -15.315   5.699  -7.322
  160   HG23  VAL  14          HG23      VAL  14 -15.698   7.343  -7.839
  161    H    LYS  15           H        LYS  15 -15.930   3.031  -8.334
  162    HA   LYS  15           HA       LYS  15 -18.513   2.970  -9.746
  163    HB2  LYS  15           HB2      LYS  15 -16.992   0.724  -8.403
  164    HB3  LYS  15           HB3      LYS  15 -18.664   0.589  -8.935
  165    HG2  LYS  15           HG2      LYS  15 -16.292   1.144 -10.709
  166    HG3  LYS  15           HG3      LYS  15 -17.095  -0.416 -10.519
  167    HD2  LYS  15           HD2      LYS  15 -19.193   0.622 -11.341
  168    HD3  LYS  15           HD3      LYS  15 -18.299   2.114 -11.636
  169    HE2  LYS  15           HE2      LYS  15 -16.837   0.932 -13.199
  170    HE3  LYS  15           HE3      LYS  15 -17.718  -0.565 -12.894
  171    HZ1  LYS  15           HZ1      LYS  15 -18.797   1.903 -14.147
  172    HZ2  LYS  15           HZ2      LYS  15 -19.729   0.545 -13.750
  173    HZ3  LYS  15           HZ3      LYS  15 -18.506   0.421 -14.915
  174    H    THR  16           H        THR  16 -20.360   2.792  -8.399
  175    HA   THR  16           HA       THR  16 -19.829   3.799  -5.692
  176    HB   THR  16           HB       THR  16 -22.415   3.886  -7.262
  177    HG1  THR  16           HG1      THR  16 -20.679   5.224  -8.089
  178   HG21  THR  16          HG21      THR  16 -23.141   5.478  -5.541
  179   HG22  THR  16          HG22      THR  16 -21.622   5.240  -4.677
  180   HG23  THR  16          HG23      THR  16 -22.765   3.907  -4.832
  181    H    MET  17           H        MET  17 -20.056   2.439  -4.023
  182    HA   MET  17           HA       MET  17 -21.989   0.265  -4.249
  183    HB2  MET  17           HB2      MET  17 -19.066  -0.017  -3.722
  184    HB3  MET  17           HB3      MET  17 -20.167  -1.032  -2.803
  185    HG2  MET  17           HG2      MET  17 -21.166  -1.650  -5.089
  186    HG3  MET  17           HG3      MET  17 -19.679  -0.973  -5.753
  187    HE1  MET  17           HE1      MET  17 -20.106  -2.823  -2.329
  188    HE2  MET  17           HE2      MET  17 -21.203  -3.726  -3.372
  189    HE3  MET  17           HE3      MET  17 -19.736  -4.496  -2.762
  190    H    GLN  18           H        GLN  18 -22.872  -0.381  -2.293
  191    HA   GLN  18           HA       GLN  18 -22.163   1.323  -0.005
  192    HB2  GLN  18           HB2      GLN  18 -24.826   0.333  -0.961
  193    HB3  GLN  18           HB3      GLN  18 -24.582   0.760   0.732
  194    HG2  GLN  18           HG2      GLN  18 -24.137   2.986   0.235
  195    HG3  GLN  18           HG3      GLN  18 -23.825   2.638  -1.465
  196   HE21  GLN  18          HE21      GLN  18 -25.548   2.346  -2.861
  197   HE22  GLN  18          HE22      GLN  18 -27.151   2.863  -2.466
  198    H    PHE  19           H        PHE  19 -21.844   0.366   1.960
  199    HA   PHE  19           HA       PHE  19 -21.926  -2.565   2.048
  200    HB2  PHE  19           HB2      PHE  19 -19.711  -0.802   3.148
  201    HB3  PHE  19           HB3      PHE  19 -19.799  -2.552   3.273
  202    HD1  PHE  19           HD1      PHE  19 -19.063   0.275   1.095
  203    HD2  PHE  19           HD2      PHE  19 -19.278  -3.960   1.383
  204    HE1  PHE  19           HE1      PHE  19 -17.803   0.071  -1.013
  205    HE2  PHE  19           HE2      PHE  19 -18.021  -4.176  -0.718
  206    HZ   PHE  19           HZ       PHE  19 -17.186  -2.152  -1.863
  207    H    GLU  20           H        GLU  20 -22.085  -3.319   4.323
  208    HA   GLU  20           HA       GLU  20 -23.680  -1.500   5.882
  209    HB2  GLU  20           HB2      GLU  20 -22.654  -4.266   6.538
  210    HB3  GLU  20           HB3      GLU  20 -23.738  -3.332   7.557
  211    HG2  GLU  20           HG2      GLU  20 -25.334  -3.291   5.606
  212    HG3  GLU  20           HG3      GLU  20 -24.287  -4.493   4.848
  213    HA   PRO  21           HA       PRO  21 -20.600   0.507   8.315
  214    HB2  PRO  21           HB2      PRO  21 -21.995   0.162  10.758
  215    HB3  PRO  21           HB3      PRO  21 -22.061   1.559   9.686
  216    HG2  PRO  21           HG2      PRO  21 -23.946  -0.713   9.933
  217    HG3  PRO  21           HG3      PRO  21 -24.265   0.969   9.463
  218    HD2  PRO  21           HD2      PRO  21 -24.258  -1.012   7.674
  219    HD3  PRO  21           HD3      PRO  21 -23.656   0.611   7.279
  220    H    SER  22           H        SER  22 -21.989  -2.546   9.433
  221    HA   SER  22           HA       SER  22 -19.538  -3.137  10.916
  222    HB2  SER  22           HB2      SER  22 -21.025  -5.111  11.720
  223    HB3  SER  22           HB3      SER  22 -21.372  -3.486  12.315
  224    HG   SER  22           HG       SER  22 -22.728  -4.958  10.301
  225    H    THR  23           H        THR  23 -20.186  -3.437   7.840
  226    HA   THR  23           HA       THR  23 -20.085  -6.146   7.176
  227    HB   THR  23           HB       THR  23 -19.121  -3.685   5.738
  228    HG1  THR  23           HG1      THR  23 -21.331  -5.445   5.580
  229   HG21  THR  23          HG21      THR  23 -17.662  -5.490   5.012
  230   HG22  THR  23          HG22      THR  23 -18.793  -5.051   3.733
  231   HG23  THR  23          HG23      THR  23 -19.063  -6.510   4.687
  232    H    MET  24           H        MET  24 -17.433  -3.857   7.686
  233    HA   MET  24           HA       MET  24 -15.283  -4.149   8.377
  234    HB2  MET  24           HB2      MET  24 -16.379  -6.284   9.510
  235    HB3  MET  24           HB3      MET  24 -15.424  -7.127   8.302
  236    HG2  MET  24           HG2      MET  24 -13.405  -6.264   9.181
  237    HG3  MET  24           HG3      MET  24 -14.270  -5.120  10.209
  238    HE1  MET  24           HE1      MET  24 -13.472  -5.623  12.519
  239    HE2  MET  24           HE2      MET  24 -13.010  -7.234  13.078
  240    HE3  MET  24           HE3      MET  24 -12.180  -6.504  11.700
  241    H    VAL  25           H        VAL  25 -13.371  -4.325   7.343
  242    HA   VAL  25           HA       VAL  25 -13.248  -4.040   4.670
  243    HB   VAL  25           HB       VAL  25 -11.094  -5.086   6.488
  244   HG11  VAL  25          HG11      VAL  25 -10.812  -4.156   3.628
  245   HG12  VAL  25          HG12      VAL  25  -9.480  -4.490   4.737
  246   HG13  VAL  25          HG13      VAL  25 -10.544  -5.797   4.218
  247   HG21  VAL  25          HG21      VAL  25 -10.278  -2.788   6.317
  248   HG22  VAL  25          HG22      VAL  25 -11.632  -2.386   5.261
  249   HG23  VAL  25          HG23      VAL  25 -11.927  -2.844   6.939
  250    H    TYR  26           H        TYR  26 -12.411  -7.167   6.212
  251    HA   TYR  26           HA       TYR  26 -11.772  -8.442   3.814
  252    HB2  TYR  26           HB2      TYR  26 -11.811 -10.529   4.995
  253    HB3  TYR  26           HB3      TYR  26 -11.134  -9.298   6.047
  254    HD1  TYR  26           HD1      TYR  26 -12.385  -8.518   8.006
  255    HD2  TYR  26           HD2      TYR  26 -13.892 -11.629   5.526
  256    HE1  TYR  26           HE1      TYR  26 -14.010  -9.109   9.749
  257    HE2  TYR  26           HE2      TYR  26 -15.528 -12.224   7.263
  258    HH   TYR  26           HH       TYR  26 -15.871 -11.986   9.646
  259    H    ASP  27           H        ASP  27 -14.881  -7.957   5.296
  260    HA   ASP  27           HA       ASP  27 -16.256  -9.848   3.615
  261    HB2  ASP  27           HB2      ASP  27 -17.003  -9.002   5.924
  262    HB3  ASP  27           HB3      ASP  27 -17.522  -7.544   5.092
  263    H    ALA  28           H        ALA  28 -15.728  -6.351   3.664
  264    HA   ALA  28           HA       ALA  28 -17.342  -5.666   1.484
  265    HB1  ALA  28           HB1      ALA  28 -14.778  -4.356   2.391
  266    HB2  ALA  28           HB2      ALA  28 -16.002  -3.631   1.349
  267    HB3  ALA  28           HB3      ALA  28 -16.388  -4.015   3.027
  268    H    CYS  29           H        CYS  29 -13.952  -6.573   1.679
  269    HA   CYS  29           HA       CYS  29 -13.237  -6.316  -0.987
  270    HB2  CYS  29           HB2      CYS  29 -12.251  -8.200   1.149
  271    HB3  CYS  29           HB3      CYS  29 -11.462  -7.994  -0.406
  272    HG   CYS  29           HG       CYS  29 -10.324  -6.601   1.958
  273    H    ARG  30           H        ARG  30 -15.018  -8.921   0.586
  274    HA   ARG  30           HA       ARG  30 -14.610 -10.710  -1.642
  275    HB2  ARG  30           HB2      ARG  30 -15.902 -12.322  -0.486
  276    HB3  ARG  30           HB3      ARG  30 -14.911 -11.518   0.716
  277    HG2  ARG  30           HG2      ARG  30 -16.893 -10.131   1.335
  278    HG3  ARG  30           HG3      ARG  30 -17.847 -11.107   0.210
  279    HD2  ARG  30           HD2      ARG  30 -17.406 -13.104   1.453
  280    HD3  ARG  30           HD3      ARG  30 -16.259 -12.262   2.491
  281    HE   ARG  30           HE       ARG  30 -18.509 -10.878   2.945
  282   HH11  ARG  30          HH11      ARG  30 -17.905 -14.331   2.814
  283   HH12  ARG  30          HH12      ARG  30 -19.056 -14.709   4.065
  284   HH21  ARG  30          HH21      ARG  30 -20.011 -11.369   4.607
  285   HH22  ARG  30          HH22      ARG  30 -20.284 -13.033   5.055
  286    H    MET  31           H        MET  31 -17.225  -8.642  -0.473
  287    HA   MET  31           HA       MET  31 -19.121  -9.515  -2.384
  288    HB2  MET  31           HB2      MET  31 -19.003  -6.924  -0.846
  289    HB3  MET  31           HB3      MET  31 -20.397  -7.531  -1.728
  290    HG2  MET  31           HG2      MET  31 -20.560  -9.425  -0.256
  291    HG3  MET  31           HG3      MET  31 -19.098  -8.933   0.588
  292    HE1  MET  31           HE1      MET  31 -20.076  -5.678   2.335
  293    HE2  MET  31           HE2      MET  31 -18.820  -6.870   1.971
  294    HE3  MET  31           HE3      MET  31 -19.417  -5.798   0.700
  295    H    ILE  32           H        ILE  32 -16.801  -6.824  -2.356
  296    HA   ILE  32           HA       ILE  32 -17.812  -5.556  -4.661
  297    HB   ILE  32           HB       ILE  32 -16.294  -4.408  -3.154
  298   HG12  ILE  32          HG12      ILE  32 -15.207  -4.729  -5.960
  299   HG13  ILE  32          HG13      ILE  32 -16.471  -3.614  -5.449
  300   HG21  ILE  32          HG21      ILE  32 -14.166  -6.283  -4.176
  301   HG22  ILE  32          HG22      ILE  32 -13.895  -4.888  -3.131
  302   HG23  ILE  32          HG23      ILE  32 -14.838  -6.260  -2.546
  303   HD11  ILE  32          HD11      ILE  32 -13.609  -3.549  -4.541
  304   HD12  ILE  32          HD12      ILE  32 -14.333  -2.502  -5.762
  305   HD13  ILE  32          HD13      ILE  32 -14.876  -2.409  -4.087
  306    H    ARG  33           H        ARG  33 -15.394  -8.084  -4.240
  307    HA   ARG  33           HA       ARG  33 -14.593  -8.411  -6.888
  308    HB2  ARG  33           HB2      ARG  33 -14.739 -10.263  -4.537
  309    HB3  ARG  33           HB3      ARG  33 -14.280 -10.884  -6.116
  310    HG2  ARG  33           HG2      ARG  33 -12.425  -9.307  -6.209
  311    HG3  ARG  33           HG3      ARG  33 -12.890  -8.662  -4.632
  312    HD2  ARG  33           HD2      ARG  33 -12.317 -11.580  -4.996
  313    HD3  ARG  33           HD3      ARG  33 -11.006 -10.426  -4.763
  314    HE   ARG  33           HE       ARG  33 -12.779  -9.908  -2.741
  315   HH11  ARG  33          HH11      ARG  33 -11.073 -12.774  -3.826
  316   HH12  ARG  33          HH12      ARG  33 -10.820 -13.378  -2.216
  317   HH21  ARG  33          HH21      ARG  33 -12.465 -10.741  -0.619
  318   HH22  ARG  33          HH22      ARG  33 -11.613 -12.239  -0.402
  319    H    GLU  34           H        GLU  34 -17.544  -9.264  -5.339
  320    HA   GLU  34           HA       GLU  34 -18.388 -11.325  -7.100
  321    HB2  GLU  34           HB2      GLU  34 -19.867  -9.498  -5.212
  322    HB3  GLU  34           HB3      GLU  34 -20.652 -10.772  -6.116
  323    HG2  GLU  34           HG2      GLU  34 -18.374 -11.246  -4.222
  324    HG3  GLU  34           HG3      GLU  34 -20.071 -11.335  -3.755
  325    H    ARG  35           H        ARG  35 -19.440  -7.935  -6.789
  326    HA   ARG  35           HA       ARG  35 -20.868  -8.147  -9.291
  327    HB2  ARG  35           HB2      ARG  35 -21.563  -5.775  -8.831
  328    HB3  ARG  35           HB3      ARG  35 -22.074  -6.965  -7.646
  329    HG2  ARG  35           HG2      ARG  35 -19.545  -5.518  -7.124
  330    HG3  ARG  35           HG3      ARG  35 -21.055  -4.618  -6.966
  331    HD2  ARG  35           HD2      ARG  35 -20.459  -7.237  -5.600
  332    HD3  ARG  35           HD3      ARG  35 -20.273  -5.661  -4.850
  333    HE   ARG  35           HE       ARG  35 -22.835  -5.582  -5.608
  334   HH11  ARG  35          HH11      ARG  35 -20.983  -8.087  -4.020
  335   HH12  ARG  35          HH12      ARG  35 -22.320  -8.687  -3.090
  336   HH21  ARG  35          HH21      ARG  35 -24.612  -6.339  -4.373
  337   HH22  ARG  35          HH22      ARG  35 -24.400  -7.695  -3.296
  338    H    ILE  36           H        ILE  36 -18.027  -6.360  -8.107
  339    HA   ILE  36           HA       ILE  36 -17.840  -5.054 -10.727
  340    HB   ILE  36           HB       ILE  36 -16.199  -4.444  -8.264
  341   HG12  ILE  36          HG12      ILE  36 -18.726  -3.091  -9.244
  342   HG13  ILE  36          HG13      ILE  36 -18.605  -4.112  -7.814
  343   HG21  ILE  36          HG21      ILE  36 -16.730  -2.873 -10.785
  344   HG22  ILE  36          HG22      ILE  36 -15.806  -2.298  -9.398
  345   HG23  ILE  36          HG23      ILE  36 -15.214  -3.664 -10.347
  346   HD11  ILE  36          HD11      ILE  36 -17.184  -1.493  -8.232
  347   HD12  ILE  36          HD12      ILE  36 -18.612  -1.755  -7.230
  348   HD13  ILE  36          HD13      ILE  36 -17.079  -2.511  -6.796
  349    HA   PRO  37           HA       PRO  37 -14.683  -8.177 -11.506
  350    HB2  PRO  37           HB2      PRO  37 -14.842  -7.331 -14.277
  351    HB3  PRO  37           HB3      PRO  37 -15.341  -8.862 -13.558
  352    HG2  PRO  37           HG2      PRO  37 -17.102  -7.046 -14.559
  353    HG3  PRO  37           HG3      PRO  37 -17.498  -8.158 -13.237
  354    HD2  PRO  37           HD2      PRO  37 -16.716  -5.268 -13.111
  355    HD3  PRO  37           HD3      PRO  37 -17.975  -6.135 -12.203
  356    H    GLU  38           H        GLU  38 -14.622  -4.827 -11.847
  357    HA   GLU  38           HA       GLU  38 -11.998  -4.601 -13.003
  358    HB2  GLU  38           HB2      GLU  38 -13.779  -2.593 -11.621
  359    HB3  GLU  38           HB3      GLU  38 -12.223  -2.196 -12.339
  360    HG2  GLU  38           HG2      GLU  38 -14.613  -3.297 -13.798
  361    HG3  GLU  38           HG3      GLU  38 -14.051  -1.624 -13.827
  362    H    ALA  39           H        ALA  39 -13.232  -5.331  -9.959
  363    HA   ALA  39           HA       ALA  39 -11.333  -4.103  -8.270
  364    HB1  ALA  39           HB1      ALA  39 -12.126  -5.658  -6.570
  365    HB2  ALA  39           HB2      ALA  39 -13.479  -4.973  -7.470
  366    HB3  ALA  39           HB3      ALA  39 -12.937  -6.617  -7.808
  367    H    LEU  40           H        LEU  40 -11.512  -7.416  -9.577
  368    HA   LEU  40           HA       LEU  40  -8.842  -7.906  -8.557
  369    HB2  LEU  40           HB2      LEU  40  -9.306 -10.267  -9.554
  370    HB3  LEU  40           HB3      LEU  40 -10.021  -9.782  -8.037
  371    HG   LEU  40           HG       LEU  40 -11.518 -11.079  -9.590
  372   HD11  LEU  40          HD11      LEU  40 -13.499  -9.696  -9.208
  373   HD12  LEU  40          HD12      LEU  40 -12.465  -9.778  -7.782
  374   HD13  LEU  40          HD13      LEU  40 -12.461  -8.332  -8.794
  375   HD21  LEU  40          HD21      LEU  40 -12.603  -9.800 -11.411
  376   HD22  LEU  40          HD22      LEU  40 -11.394  -8.534 -11.183
  377   HD23  LEU  40          HD23      LEU  40 -10.897 -10.144 -11.702
  378    H    ALA  41           H        ALA  41  -8.228  -6.159 -10.186
  379    HA   ALA  41           HA       ALA  41  -7.950  -6.801 -12.915
  380    HB1  ALA  41           HB1      ALA  41  -7.655  -4.530 -12.041
  381    HB2  ALA  41           HB2      ALA  41  -6.181  -5.039 -11.218
  382    HB3  ALA  41           HB3      ALA  41  -6.254  -5.046 -12.979
  383    H    GLY  42           H        GLY  42  -6.266  -7.784 -10.100
  384    HA2  GLY  42           HA2      GLY  42  -4.730  -9.686 -11.711
  385    HA3  GLY  42           HA3      GLY  42  -3.885  -8.726 -10.497
  386    HA   PRO  43           HA       PRO  43  -5.256 -12.479  -8.179
  387    HB2  PRO  43           HB2      PRO  43  -3.260 -12.196  -6.301
  388    HB3  PRO  43           HB3      PRO  43  -3.116 -13.168  -7.768
  389    HG2  PRO  43           HG2      PRO  43  -2.120 -10.410  -7.213
  390    HG3  PRO  43           HG3      PRO  43  -1.348 -11.722  -8.120
  391    HD2  PRO  43           HD2      PRO  43  -2.554  -9.645  -9.341
  392    HD3  PRO  43           HD3      PRO  43  -2.553 -11.278 -10.036
  393    HA   PRO  44           HA       PRO  44  -7.597  -9.446  -5.806
  394    HB2  PRO  44           HB2      PRO  44  -9.230 -11.311  -4.610
  395    HB3  PRO  44           HB3      PRO  44  -9.506 -10.612  -6.208
  396    HG2  PRO  44           HG2      PRO  44  -8.266 -13.231  -5.473
  397    HG3  PRO  44           HG3      PRO  44  -9.403 -12.854  -6.781
  398    HD2  PRO  44           HD2      PRO  44  -6.783 -13.173  -7.252
  399    HD3  PRO  44           HD3      PRO  44  -7.741 -11.965  -8.135
  400    H    ASN  45           H        ASN  45  -5.893 -12.196  -4.577
  401    HA   ASN  45           HA       ASN  45  -6.217 -11.783  -1.811
  402    HB2  ASN  45           HB2      ASN  45  -3.811 -12.929  -3.245
  403    HB3  ASN  45           HB3      ASN  45  -4.226 -13.166  -1.551
  404   HD21  ASN  45          HD21      ASN  45  -3.861 -15.031  -3.807
  405   HD22  ASN  45          HD22      ASN  45  -5.309 -15.983  -3.856
  406    H    ASP  46           H        ASP  46  -4.299 -10.218  -4.217
  407    HA   ASP  46           HA       ASP  46  -2.738  -8.809  -2.172
  408    HB2  ASP  46           HB2      ASP  46  -2.359  -9.040  -5.164
  409    HB3  ASP  46           HB3      ASP  46  -1.354  -8.042  -4.115
  410    H    PHE  47           H        PHE  47  -5.578  -8.293  -2.816
  411    HA   PHE  47           HA       PHE  47  -5.276  -5.444  -3.503
  412    HB2  PHE  47           HB2      PHE  47  -7.452  -7.389  -4.222
  413    HB3  PHE  47           HB3      PHE  47  -7.804  -5.670  -4.102
  414    HD1  PHE  47           HD1      PHE  47  -6.041  -8.255  -5.975
  415    HD2  PHE  47           HD2      PHE  47  -6.930  -4.106  -5.738
  416    HE1  PHE  47           HE1      PHE  47  -5.235  -7.957  -8.278
  417    HE2  PHE  47           HE2      PHE  47  -6.125  -3.798  -8.038
  418    HZ   PHE  47           HZ       PHE  47  -5.307  -5.683  -9.317
  419    H    GLY  48           H        GLY  48  -6.030  -3.995  -2.039
  420    HA2  GLY  48           HA2      GLY  48  -7.728  -5.007   0.144
  421    HA3  GLY  48           HA3      GLY  48  -6.245  -4.140   0.515
  422    H    LEU  49           H        LEU  49  -8.146  -2.926   1.660
  423    HA   LEU  49           HA       LEU  49  -9.456  -1.069  -0.185
  424    HB2  LEU  49           HB2      LEU  49 -10.036  -1.625   2.725
  425    HB3  LEU  49           HB3      LEU  49 -10.965  -0.569   1.677
  426    HG   LEU  49           HG       LEU  49 -10.667  -3.554   1.325
  427   HD11  LEU  49          HD11      LEU  49 -12.027  -2.933   3.270
  428   HD12  LEU  49          HD12      LEU  49 -13.047  -1.942   2.226
  429   HD13  LEU  49          HD13      LEU  49 -12.984  -3.691   1.995
  430   HD21  LEU  49          HD21      LEU  49 -12.358  -1.555  -0.170
  431   HD22  LEU  49          HD22      LEU  49 -10.939  -2.392  -0.798
  432   HD23  LEU  49          HD23      LEU  49 -12.391  -3.305  -0.388
  433    H    PHE  50           H        PHE  50  -8.346   0.689  -0.521
  434    HA   PHE  50           HA       PHE  50  -6.923   1.991   1.694
  435    HB2  PHE  50           HB2      PHE  50  -5.682   1.665  -0.420
  436    HB3  PHE  50           HB3      PHE  50  -6.884   2.632  -1.268
  437    HD1  PHE  50           HD1      PHE  50  -4.208   2.735   1.273
  438    HD2  PHE  50           HD2      PHE  50  -6.805   4.996  -1.230
  439    HE1  PHE  50           HE1      PHE  50  -2.921   4.772   1.781
  440    HE2  PHE  50           HE2      PHE  50  -5.523   7.033  -0.725
  441    HZ   PHE  50           HZ       PHE  50  -3.581   6.926   0.781
  442    H    LEU  51           H        LEU  51  -7.634   3.836   2.594
  443    HA   LEU  51           HA       LEU  51 -10.173   4.907   1.619
  444    HB2  LEU  51           HB2      LEU  51  -9.700   4.262   4.066
  445    HB3  LEU  51           HB3      LEU  51  -8.732   5.719   4.137
  446    HG   LEU  51           HG       LEU  51 -11.078   5.901   5.047
  447   HD11  LEU  51          HD11      LEU  51  -9.804   7.886   4.472
  448   HD12  LEU  51          HD12      LEU  51 -10.334   7.758   2.794
  449   HD13  LEU  51          HD13      LEU  51 -11.508   8.098   4.067
  450   HD21  LEU  51          HD21      LEU  51 -11.791   5.740   2.125
  451   HD22  LEU  51          HD22      LEU  51 -12.212   4.563   3.369
  452   HD23  LEU  51          HD23      LEU  51 -12.889   6.190   3.430
  453    H    SER  52           H        SER  52 -10.151   6.621   0.332
  454    HA   SER  52           HA       SER  52  -7.695   8.201   0.152
  455    HB2  SER  52           HB2      SER  52 -10.060   8.082  -1.734
  456    HB3  SER  52           HB3      SER  52  -8.540   8.928  -2.026
  457    HG   SER  52           HG       SER  52  -7.493   7.019  -2.232
  458    H    ASP  53           H        ASP  53  -7.602  10.133   1.057
  459    HA   ASP  53           HA       ASP  53 -10.117  11.610   1.492
  460    HB2  ASP  53           HB2      ASP  53  -8.951  11.072   3.587
  461    HB3  ASP  53           HB3      ASP  53  -7.486  11.838   2.979
  462    H    ASP  54           H        ASP  54  -6.656  12.127   0.933
  463    HA   ASP  54           HA       ASP  54  -6.824  13.703  -1.338
  464    HB2  ASP  54           HB2      ASP  54  -8.020  15.356   0.061
  465    HB3  ASP  54           HB3      ASP  54  -6.657  15.393   1.176
  466    H    ASP  55           H        ASP  55  -5.155  14.168   1.754
  467    HA   ASP  55           HA       ASP  55  -2.579  14.177   0.436
  468    HB2  ASP  55           HB2      ASP  55  -2.984  15.748   2.264
  469    HB3  ASP  55           HB3      ASP  55  -3.338  14.418   3.360
  470    HA   PRO  56           HA       PRO  56  -1.549   9.893   0.644
  471    HB2  PRO  56           HB2      PRO  56   1.052  10.327   1.704
  472    HB3  PRO  56           HB3      PRO  56   0.601  10.068   0.018
  473    HG2  PRO  56           HG2      PRO  56   1.131  12.597   1.467
  474    HG3  PRO  56           HG3      PRO  56   1.359  12.209  -0.246
  475    HD2  PRO  56           HD2      PRO  56  -0.648  13.780   0.577
  476    HD3  PRO  56           HD3      PRO  56  -0.861  12.633  -0.764
  477    H    LYS  57           H        LYS  57  -0.806  11.893   3.521
  478    HA   LYS  57           HA       LYS  57  -0.641   9.517   5.175
  479    HB2  LYS  57           HB2      LYS  57  -0.626  12.419   5.997
  480    HB3  LYS  57           HB3      LYS  57  -0.233  11.052   7.026
  481    HG2  LYS  57           HG2      LYS  57   1.614  10.535   5.384
  482    HG3  LYS  57           HG3      LYS  57   1.310  12.142   4.712
  483    HD2  LYS  57           HD2      LYS  57   1.578  13.055   7.023
  484    HD3  LYS  57           HD3      LYS  57   2.110  11.448   7.525
  485    HE2  LYS  57           HE2      LYS  57   4.051  12.709   7.087
  486    HE3  LYS  57           HE3      LYS  57   3.855  11.579   5.753
  487    HZ1  LYS  57           HZ1      LYS  57   3.081  14.448   5.715
  488    HZ2  LYS  57           HZ2      LYS  57   2.907  13.364   4.424
  489    HZ3  LYS  57           HZ3      LYS  57   4.456  13.791   4.973
  490    H    LYS  58           H        LYS  58  -3.041  11.915   4.367
  491    HA   LYS  58           HA       LYS  58  -4.790  11.279   6.546
  492    HB2  LYS  58           HB2      LYS  58  -5.371  12.634   3.905
  493    HB3  LYS  58           HB3      LYS  58  -6.444  12.602   5.303
  494    HG2  LYS  58           HG2      LYS  58  -4.866  13.864   6.603
  495    HG3  LYS  58           HG3      LYS  58  -3.689  13.806   5.289
  496    HD2  LYS  58           HD2      LYS  58  -5.248  15.058   3.870
  497    HD3  LYS  58           HD3      LYS  58  -6.376  15.164   5.224
  498    HE2  LYS  58           HE2      LYS  58  -3.582  16.291   5.123
  499    HE3  LYS  58           HE3      LYS  58  -5.081  17.214   5.025
  500    HZ1  LYS  58           HZ1      LYS  58  -4.200  17.341   7.239
  501    HZ2  LYS  58           HZ2      LYS  58  -4.112  15.652   7.361
  502    HZ3  LYS  58           HZ3      LYS  58  -5.624  16.414   7.278
  503    H    GLY  59           H        GLY  59  -4.211  10.136   3.327
  504    HA2  GLY  59           HA2      GLY  59  -6.384   8.269   3.288
  505    HA3  GLY  59           HA3      GLY  59  -4.957   8.234   2.253
  506    H    ILE  60           H        ILE  60  -6.302   6.051   3.772
  507    HA   ILE  60           HA       ILE  60  -3.971   5.143   5.291
  508    HB   ILE  60           HB       ILE  60  -5.500   4.242   7.081
  509   HG12  ILE  60          HG12      ILE  60  -7.444   6.247   5.915
  510   HG13  ILE  60          HG13      ILE  60  -7.605   4.497   5.796
  511   HG21  ILE  60          HG21      ILE  60  -4.063   6.146   7.495
  512   HG22  ILE  60          HG22      ILE  60  -5.280   7.237   6.829
  513   HG23  ILE  60          HG23      ILE  60  -5.607   6.354   8.322
  514   HD11  ILE  60          HD11      ILE  60  -7.803   4.347   8.216
  515   HD12  ILE  60          HD12      ILE  60  -7.621   6.096   8.343
  516   HD13  ILE  60          HD13      ILE  60  -9.032   5.413   7.535
  517    H    TRP  61           H        TRP  61  -3.868   2.875   5.585
  518    HA   TRP  61           HA       TRP  61  -5.370   1.366   3.606
  519    HB2  TRP  61           HB2      TRP  61  -3.007   0.763   5.352
  520    HB3  TRP  61           HB3      TRP  61  -3.907  -0.546   4.595
  521    HD1  TRP  61           HD1      TRP  61  -1.229   1.952   3.908
  522    HE1  TRP  61           HE1      TRP  61  -0.483   1.800   1.446
  523    HE3  TRP  61           HE3      TRP  61  -4.983  -1.024   2.138
  524    HZ2  TRP  61           HZ2      TRP  61  -1.387   0.560  -0.930
  525    HZ3  TRP  61           HZ3      TRP  61  -4.968  -1.656  -0.238
  526    HH2  TRP  61           HH2      TRP  61  -3.206  -0.878  -1.739
  527    H    LEU  62           H        LEU  62  -7.159   0.323   4.067
  528    HA   LEU  62           HA       LEU  62  -8.001   0.049   6.831
  529    HB2  LEU  62           HB2      LEU  62  -9.442  -0.835   4.329
  530    HB3  LEU  62           HB3      LEU  62 -10.131  -0.611   5.924
  531    HG   LEU  62           HG       LEU  62  -9.045   1.603   4.181
  532   HD11  LEU  62          HD11      LEU  62 -11.383   2.253   3.931
  533   HD12  LEU  62          HD12      LEU  62 -11.091   0.640   3.278
  534   HD13  LEU  62          HD13      LEU  62 -11.879   0.828   4.844
  535   HD21  LEU  62          HD21      LEU  62 -10.540   1.699   6.794
  536   HD22  LEU  62          HD22      LEU  62  -8.830   2.071   6.567
  537   HD23  LEU  62          HD23      LEU  62 -10.059   3.088   5.818
  538    H    GLU  63           H        GLU  63  -7.191  -1.665   7.913
  539    HA   GLU  63           HA       GLU  63  -6.400  -4.055   6.522
  540    HB2  GLU  63           HB2      GLU  63  -5.684  -4.850   8.709
  541    HB3  GLU  63           HB3      GLU  63  -5.113  -3.209   8.440
  542    HG2  GLU  63           HG2      GLU  63  -6.921  -2.348   9.835
  543    HG3  GLU  63           HG3      GLU  63  -7.498  -3.993  10.100
  544    H    ALA  64           H        ALA  64  -7.213  -6.168   6.999
  545    HA   ALA  64           HA       ALA  64 -10.011  -6.339   6.823
  546    HB1  ALA  64           HB1      ALA  64  -9.686  -8.757   6.987
  547    HB2  ALA  64           HB2      ALA  64  -8.526  -8.022   5.881
  548    HB3  ALA  64           HB3      ALA  64  -8.020  -8.496   7.503
  549    H    GLY  65           H        GLY  65  -7.888  -6.285   9.546
  550    HA2  GLY  65           HA2      GLY  65  -9.729  -7.604  11.333
  551    HA3  GLY  65           HA3      GLY  65  -8.176  -6.910  11.755
  552    H    LYS  66           H        LYS  66 -10.493  -4.897  10.082
  553    HA   LYS  66           HA       LYS  66 -11.757  -4.048  12.521
  554    HB2  LYS  66           HB2      LYS  66 -10.811  -2.043  12.885
  555    HB3  LYS  66           HB3      LYS  66  -9.453  -2.702  11.984
  556    HG2  LYS  66           HG2      LYS  66 -11.672  -1.136  10.699
  557    HG3  LYS  66           HG3      LYS  66 -10.224  -0.384  11.363
  558    HD2  LYS  66           HD2      LYS  66  -8.829  -1.510   9.802
  559    HD3  LYS  66           HD3      LYS  66 -10.156  -2.548   9.275
  560    HE2  LYS  66           HE2      LYS  66 -10.073   0.447   8.939
  561    HE3  LYS  66           HE3      LYS  66  -9.665  -0.718   7.679
  562    HZ1  LYS  66           HZ1      LYS  66 -11.911   0.023   7.413
  563    HZ2  LYS  66           HZ2      LYS  66 -12.296  -0.394   9.010
  564    HZ3  LYS  66           HZ3      LYS  66 -11.924  -1.603   7.883
  565    H    ALA  67           H        ALA  67 -13.492  -2.510  12.154
  566    HA   ALA  67           HA       ALA  67 -14.818  -3.197   9.667
  567    HB1  ALA  67           HB1      ALA  67 -16.798  -2.263  10.694
  568    HB2  ALA  67           HB2      ALA  67 -15.986  -3.341  11.834
  569    HB3  ALA  67           HB3      ALA  67 -15.832  -1.591  12.008
  570    H    LEU  68           H        LEU  68 -15.971  -1.501   8.436
  571    HA   LEU  68           HA       LEU  68 -14.121   0.505   7.634
  572    HB2  LEU  68           HB2      LEU  68 -17.035   0.222   6.911
  573    HB3  LEU  68           HB3      LEU  68 -15.840   1.180   6.070
  574    HG   LEU  68           HG       LEU  68 -15.801  -1.828   6.288
  575   HD11  LEU  68          HD11      LEU  68 -16.397  -1.803   3.921
  576   HD12  LEU  68          HD12      LEU  68 -17.648  -1.047   4.907
  577   HD13  LEU  68          HD13      LEU  68 -16.537  -0.045   3.970
  578   HD21  LEU  68          HD21      LEU  68 -14.028  -1.693   4.617
  579   HD22  LEU  68          HD22      LEU  68 -14.093   0.068   4.686
  580   HD23  LEU  68          HD23      LEU  68 -13.578  -0.851   6.100
  581    H    ASP  69           H        ASP  69 -17.314   0.624   9.093
  582    HA   ASP  69           HA       ASP  69 -17.375   3.439   9.459
  583    HB2  ASP  69           HB2      ASP  69 -19.423   2.145   9.187
  584    HB3  ASP  69           HB3      ASP  69 -19.068   1.215  10.635
  585    H    TYR  70           H        TYR  70 -15.798   0.980  11.166
  586    HA   TYR  70           HA       TYR  70 -15.808   2.045  13.768
  587    HB2  TYR  70           HB2      TYR  70 -14.923  -0.093  13.687
  588    HB3  TYR  70           HB3      TYR  70 -14.009   0.216  12.216
  589    HD1  TYR  70           HD1      TYR  70 -14.135   1.068  15.820
  590    HD2  TYR  70           HD2      TYR  70 -11.710   0.646  12.357
  591    HE1  TYR  70           HE1      TYR  70 -12.128   1.402  17.197
  592    HE2  TYR  70           HE2      TYR  70  -9.690   0.982  13.721
  593    HH   TYR  70           HH       TYR  70  -9.786   0.979  17.181
  594    H    TYR  71           H        TYR  71 -13.912   2.745  10.890
  595    HA   TYR  71           HA       TYR  71 -12.446   4.875  12.172
  596    HB2  TYR  71           HB2      TYR  71 -12.572   3.766   9.396
  597    HB3  TYR  71           HB3      TYR  71 -11.913   5.379   9.646
  598    HD1  TYR  71           HD1      TYR  71  -9.851   5.691  10.953
  599    HD2  TYR  71           HD2      TYR  71 -11.387   1.814  10.124
  600    HE1  TYR  71           HE1      TYR  71  -7.681   4.700  11.564
  601    HE2  TYR  71           HE2      TYR  71  -9.228   0.814  10.736
  602    HH   TYR  71           HH       TYR  71  -6.759   2.581  12.307
  603    H    MET  72           H        MET  72 -12.692   6.635   9.815
  604    HA   MET  72           HA       MET  72 -15.035   8.086  10.776
  605    HB2  MET  72           HB2      MET  72 -12.747   8.952   8.999
  606    HB3  MET  72           HB3      MET  72 -14.039  10.000   9.563
  607    HG2  MET  72           HG2      MET  72 -13.311   9.793  11.826
  608    HG3  MET  72           HG3      MET  72 -12.140   8.550  11.387
  609    HE1  MET  72           HE1      MET  72 -10.980   9.719   8.656
  610    HE2  MET  72           HE2      MET  72  -9.565  10.588   9.250
  611    HE3  MET  72           HE3      MET  72  -9.976   9.010   9.920
  612    H    LEU  73           H        LEU  73 -15.119   5.769   8.759
  613    HA   LEU  73           HA       LEU  73 -15.872   7.182   6.318
  614    HB2  LEU  73           HB2      LEU  73 -16.386   4.305   6.373
  615    HB3  LEU  73           HB3      LEU  73 -15.596   5.280   5.161
  616    HG   LEU  73           HG       LEU  73 -14.330   4.106   7.630
  617   HD11  LEU  73          HD11      LEU  73 -12.992   2.883   5.962
  618   HD12  LEU  73          HD12      LEU  73 -14.715   2.512   5.858
  619   HD13  LEU  73          HD13      LEU  73 -13.974   3.599   4.683
  620   HD21  LEU  73          HD21      LEU  73 -13.137   5.896   5.520
  621   HD22  LEU  73          HD22      LEU  73 -13.390   6.297   7.220
  622   HD23  LEU  73          HD23      LEU  73 -12.234   5.043   6.773
  623    H    ARG  74           H        ARG  74 -17.783   7.193   5.417
  624    HA   ARG  74           HA       ARG  74 -20.026   5.773   6.296
  625    HB2  ARG  74           HB2      ARG  74 -21.303   7.875   7.086
  626    HB3  ARG  74           HB3      ARG  74 -20.233   7.066   8.214
  627    HG2  ARG  74           HG2      ARG  74 -19.771   9.294   8.577
  628    HG3  ARG  74           HG3      ARG  74 -18.490   8.818   7.464
  629    HD2  ARG  74           HD2      ARG  74 -20.891   9.763   6.113
  630    HD3  ARG  74           HD3      ARG  74 -20.178  10.970   7.178
  631    HE   ARG  74           HE       ARG  74 -18.236   9.695   5.488
  632   HH11  ARG  74          HH11      ARG  74 -20.627  12.253   5.688
  633   HH12  ARG  74          HH12      ARG  74 -19.921  13.187   4.405
  634   HH21  ARG  74          HH21      ARG  74 -17.285  10.944   3.829
  635   HH22  ARG  74          HH22      ARG  74 -18.026  12.445   3.342
  636    H    ASN  75           H        ASN  75 -22.017   7.467   5.508
  637    HA   ASN  75           HA       ASN  75 -21.941   7.111   2.736
  638    HB2  ASN  75           HB2      ASN  75 -23.776   8.580   4.588
  639    HB3  ASN  75           HB3      ASN  75 -23.967   8.776   2.848
  640   HD21  ASN  75          HD21      ASN  75 -23.986   6.464   5.482
  641   HD22  ASN  75          HD22      ASN  75 -24.891   5.243   4.640
  642    H    GLY  76           H        GLY  76 -20.446   8.071   1.522
  643    HA2  GLY  76           HA2      GLY  76 -20.408  10.235   0.213
  644    HA3  GLY  76           HA3      GLY  76 -20.164  10.999   1.775
  645    H    ASP  77           H        ASP  77 -18.449   8.360   2.303
  646    HA   ASP  77           HA       ASP  77 -15.996   9.728   1.627
  647    HB2  ASP  77           HB2      ASP  77 -16.581   7.218   3.182
  648    HB3  ASP  77           HB3      ASP  77 -14.937   7.721   2.800
  649    H    THR  78           H        THR  78 -14.371   9.034   0.328
  650    HA   THR  78           HA       THR  78 -15.104   7.105  -1.732
  651    HB   THR  78           HB       THR  78 -12.696   8.938  -1.555
  652    HG1  THR  78           HG1      THR  78 -14.681  10.091  -1.757
  653   HG21  THR  78          HG21      THR  78 -12.310   6.999  -2.999
  654   HG22  THR  78          HG22      THR  78 -12.449   8.475  -3.955
  655   HG23  THR  78          HG23      THR  78 -13.802   7.347  -3.875
  656    H    MET  79           H        MET  79 -14.180   5.117  -1.888
  657    HA   MET  79           HA       MET  79 -11.885   4.560  -0.148
  658    HB2  MET  79           HB2      MET  79 -14.128   3.692   0.758
  659    HB3  MET  79           HB3      MET  79 -14.098   2.563  -0.588
  660    HG2  MET  79           HG2      MET  79 -11.977   1.662   0.201
  661    HG3  MET  79           HG3      MET  79 -11.989   2.800   1.545
  662    HE1  MET  79           HE1      MET  79 -14.773  -0.826   1.033
  663    HE2  MET  79           HE2      MET  79 -14.845   0.548  -0.068
  664    HE3  MET  79           HE3      MET  79 -13.385  -0.441   0.011
  665    H    GLU  80           H        GLU  80 -10.293   4.063  -1.405
  666    HA   GLU  80           HA       GLU  80 -10.712   3.212  -4.133
  667    HB2  GLU  80           HB2      GLU  80  -8.897   4.824  -3.266
  668    HB3  GLU  80           HB3      GLU  80  -8.075   3.389  -2.678
  669    HG2  GLU  80           HG2      GLU  80  -7.947   2.506  -4.937
  670    HG3  GLU  80           HG3      GLU  80  -8.815   3.916  -5.548
  671    H    TYR  81           H        TYR  81 -10.838   1.078  -4.746
  672    HA   TYR  81           HA       TYR  81  -9.758  -0.915  -2.912
  673    HB2  TYR  81           HB2      TYR  81 -12.055  -1.258  -3.851
  674    HB3  TYR  81           HB3      TYR  81 -11.353  -1.297  -5.465
  675    HD1  TYR  81           HD1      TYR  81 -10.027  -3.211  -6.195
  676    HD2  TYR  81           HD2      TYR  81 -11.814  -3.141  -2.338
  677    HE1  TYR  81           HE1      TYR  81  -9.646  -5.629  -5.983
  678    HE2  TYR  81           HE2      TYR  81 -11.435  -5.559  -2.116
  679    HH   TYR  81           HH       TYR  81 -11.129  -7.526  -3.673
  680    H    ARG  82           H        ARG  82  -7.665  -1.245  -3.214
  681    HA   ARG  82           HA       ARG  82  -6.659  -1.180  -5.959
  682    HB2  ARG  82           HB2      ARG  82  -4.723   0.181  -5.304
  683    HB3  ARG  82           HB3      ARG  82  -6.237   1.054  -5.120
  684    HG2  ARG  82           HG2      ARG  82  -6.136   0.997  -2.805
  685    HG3  ARG  82           HG3      ARG  82  -4.997  -0.353  -2.792
  686    HD2  ARG  82           HD2      ARG  82  -4.364   2.413  -3.817
  687    HD3  ARG  82           HD3      ARG  82  -3.962   1.830  -2.200
  688    HE   ARG  82           HE       ARG  82  -2.835  -0.040  -3.766
  689   HH11  ARG  82          HH11      ARG  82  -2.674   3.458  -3.853
  690   HH12  ARG  82          HH12      ARG  82  -1.071   3.497  -4.529
  691   HH21  ARG  82          HH21      ARG  82  -0.747   0.006  -4.678
  692   HH22  ARG  82          HH22      ARG  82   0.009   1.537  -5.032
  693    H    LYS  83           H        LYS  83  -4.436  -1.974  -6.123
  694    HA   LYS  83           HA       LYS  83  -4.144  -4.466  -4.855
  695    HB2  LYS  83           HB2      LYS  83  -3.178  -3.737  -7.079
  696    HB3  LYS  83           HB3      LYS  83  -1.967  -2.836  -6.181
  697    HG2  LYS  83           HG2      LYS  83  -1.035  -4.832  -5.285
  698    HG3  LYS  83           HG3      LYS  83  -2.372  -5.806  -5.906
  699    HD2  LYS  83           HD2      LYS  83  -1.689  -5.228  -8.202
  700    HD3  LYS  83           HD3      LYS  83  -0.332  -4.307  -7.551
  701    HE2  LYS  83           HE2      LYS  83   0.485  -6.445  -8.237
  702    HE3  LYS  83           HE3      LYS  83   0.485  -6.398  -6.473
  703    HZ1  LYS  83           HZ1      LYS  83  -1.611  -7.636  -6.507
  704    HZ2  LYS  83           HZ2      LYS  83  -0.365  -8.499  -7.263
  705    HZ3  LYS  83           HZ3      LYS  83  -1.547  -7.715  -8.199
  706    H    LYS  84           H        LYS  84  -3.298  -5.004  -2.953
  707    HA   LYS  84           HA       LYS  84  -2.687  -3.206  -0.924
  708    HB2  LYS  84           HB2      LYS  84  -2.222  -6.106  -1.379
  709    HB3  LYS  84           HB3      LYS  84  -1.278  -5.345  -0.111
  710    HG2  LYS  84           HG2      LYS  84  -4.263  -5.086  -0.213
  711    HG3  LYS  84           HG3      LYS  84  -3.466  -6.471   0.531
  712    HD2  LYS  84           HD2      LYS  84  -2.186  -4.867   1.962
  713    HD3  LYS  84           HD3      LYS  84  -3.202  -3.575   1.317
  714    HE2  LYS  84           HE2      LYS  84  -5.165  -4.540   2.256
  715    HE3  LYS  84           HE3      LYS  84  -4.314  -6.029   2.663
  716    HZ1  LYS  84           HZ1      LYS  84  -2.994  -4.796   4.274
  717    HZ2  LYS  84           HZ2      LYS  84  -4.646  -4.648   4.611
  718    HZ3  LYS  84           HZ3      LYS  84  -3.812  -3.365   3.885
  719    H    GLN  85           H        GLN  85  -0.686  -4.599  -3.412
  720    HA   GLN  85           HA       GLN  85   1.696  -3.360  -2.295
  721    HB2  GLN  85           HB2      GLN  85   2.477  -4.704  -4.555
  722    HB3  GLN  85           HB3      GLN  85   2.568  -5.326  -2.914
  723    HG2  GLN  85           HG2      GLN  85   0.193  -6.157  -3.323
  724    HG3  GLN  85           HG3      GLN  85   0.527  -5.870  -5.026
  725   HE21  GLN  85          HE21      GLN  85   1.367  -7.717  -2.206
  726   HE22  GLN  85          HE22      GLN  85   2.182  -8.992  -3.046
  727    H    ARG  86           H        ARG  86   2.984  -2.038  -3.507
  728    HA   ARG  86           HA       ARG  86   1.592  -0.675  -5.706
  729    HB2  ARG  86           HB2      ARG  86   3.176   1.265  -4.803
  730    HB3  ARG  86           HB3      ARG  86   1.579   0.970  -4.133
  731    HG2  ARG  86           HG2      ARG  86   2.959   1.240  -2.275
  732    HG3  ARG  86           HG3      ARG  86   2.744  -0.503  -2.420
  733    HD2  ARG  86           HD2      ARG  86   5.058   0.089  -1.901
  734    HD3  ARG  86           HD3      ARG  86   4.925  -0.707  -3.469
  735    HE   ARG  86           HE       ARG  86   5.814   1.150  -4.397
  736   HH11  ARG  86          HH11      ARG  86   4.321   2.099  -1.371
  737   HH12  ARG  86          HH12      ARG  86   4.811   3.761  -1.502
  738   HH21  ARG  86          HH21      ARG  86   6.513   3.322  -4.552
  739   HH22  ARG  86          HH22      ARG  86   6.050   4.461  -3.323
  740    HA   PRO  87           HA       PRO  87   5.133  -1.272  -8.300
  741    HB2  PRO  87           HB2      PRO  87   5.360   1.196  -9.491
  742    HB3  PRO  87           HB3      PRO  87   4.197  -0.038  -9.989
  743    HG2  PRO  87           HG2      PRO  87   3.791   2.364  -8.255
  744    HG3  PRO  87           HG3      PRO  87   2.725   1.682  -9.498
  745    HD2  PRO  87           HD2      PRO  87   2.292   1.293  -6.865
  746    HD3  PRO  87           HD3      PRO  87   1.900   0.057  -8.078
  747    H    LEU  88           H        LEU  88   6.792  -1.525  -6.897
  748    HA   LEU  88           HA       LEU  88   7.924   0.846  -5.609
  749    HB2  LEU  88           HB2      LEU  88   7.209  -1.280  -4.371
  750    HB3  LEU  88           HB3      LEU  88   8.609  -2.040  -5.098
  751    HG   LEU  88           HG       LEU  88  10.082  -0.471  -3.929
  752   HD11  LEU  88          HD11      LEU  88   9.174   1.016  -2.211
  753   HD12  LEU  88          HD12      LEU  88   8.569   1.451  -3.810
  754   HD13  LEU  88          HD13      LEU  88   7.535   0.569  -2.685
  755   HD21  LEU  88          HD21      LEU  88   9.530  -2.576  -2.891
  756   HD22  LEU  88          HD22      LEU  88   9.638  -1.319  -1.658
  757   HD23  LEU  88          HD23      LEU  88   8.058  -1.885  -2.208
  758    H    LYS  89           H        LYS  89   9.538   1.771  -6.668
  759    HA   LYS  89           HA       LYS  89  11.155   0.199  -8.509
  760    HB2  LYS  89           HB2      LYS  89  10.716   3.138  -8.112
  761    HB3  LYS  89           HB3      LYS  89  12.169   2.582  -8.931
  762    HG2  LYS  89           HG2      LYS  89  10.556   3.098 -10.595
  763    HG3  LYS  89           HG3      LYS  89  10.707   1.343 -10.528
  764    HD2  LYS  89           HD2      LYS  89   8.401   1.757 -10.679
  765    HD3  LYS  89           HD3      LYS  89   8.688   1.387  -8.980
  766    HE2  LYS  89           HE2      LYS  89   7.195   3.285  -9.178
  767    HE3  LYS  89           HE3      LYS  89   8.735   3.796  -8.484
  768    HZ1  LYS  89           HZ1      LYS  89   8.162   4.022 -11.379
  769    HZ2  LYS  89           HZ2      LYS  89   9.376   4.807 -10.485
  770    HZ3  LYS  89           HZ3      LYS  89   7.752   5.246 -10.288
  771    H    ILE  90           H        ILE  90  12.945  -0.673  -7.827
  772    HA   ILE  90           HA       ILE  90  14.291   0.501  -5.480
  773    HB   ILE  90           HB       ILE  90  13.863  -2.449  -6.022
  774   HG12  ILE  90          HG12      ILE  90  11.846  -1.308  -5.174
  775   HG13  ILE  90          HG13      ILE  90  12.498  -2.447  -4.000
  776   HG21  ILE  90          HG21      ILE  90  15.325  -1.061  -3.781
  777   HG22  ILE  90          HG22      ILE  90  14.941  -2.782  -3.824
  778   HG23  ILE  90          HG23      ILE  90  16.026  -2.091  -5.031
  779   HD11  ILE  90          HD11      ILE  90  11.767  -0.394  -2.932
  780   HD12  ILE  90          HD12      ILE  90  13.511  -0.598  -2.773
  781   HD13  ILE  90          HD13      ILE  90  12.861   0.541  -3.953
  782    H    ARG  91           H        ARG  91  16.447   0.833  -5.785
  783    HA   ARG  91           HA       ARG  91  17.675  -0.498  -8.093
  784    HB2  ARG  91           HB2      ARG  91  17.638   2.052  -8.010
  785    HB3  ARG  91           HB3      ARG  91  18.735   1.922  -6.640
  786    HG2  ARG  91           HG2      ARG  91  20.405   0.865  -7.986
  787    HG3  ARG  91           HG3      ARG  91  19.302   0.781  -9.362
  788    HD2  ARG  91           HD2      ARG  91  20.320   3.307  -8.068
  789    HD3  ARG  91           HD3      ARG  91  20.904   2.622  -9.584
  790    HE   ARG  91           HE       ARG  91  18.074   3.341  -9.351
  791   HH11  ARG  91          HH11      ARG  91  21.233   3.925 -10.725
  792   HH12  ARG  91          HH12      ARG  91  20.642   5.004 -11.953
  793   HH21  ARG  91          HH21      ARG  91  17.277   4.752 -10.980
  794   HH22  ARG  91          HH22      ARG  91  18.396   5.461 -12.107
  795    H    MET  92           H        MET  92  19.120  -2.006  -7.682
  796    HA   MET  92           HA       MET  92  19.692  -2.700  -4.969
  797    HB2  MET  92           HB2      MET  92  19.777  -3.965  -7.603
  798    HB3  MET  92           HB3      MET  92  21.110  -4.437  -6.561
  799    HG2  MET  92           HG2      MET  92  19.026  -5.864  -6.526
  800    HG3  MET  92           HG3      MET  92  19.693  -5.377  -4.973
  801    HE1  MET  92           HE1      MET  92  15.958  -3.526  -6.919
  802    HE2  MET  92           HE2      MET  92  17.587  -3.370  -7.576
  803    HE3  MET  92           HE3      MET  92  16.791  -4.945  -7.561
  804    H    LEU  93           H        LEU  93  21.934  -3.653  -4.646
  805    HA   LEU  93           HA       LEU  93  23.537  -1.456  -4.063
  806    HB2  LEU  93           HB2      LEU  93  24.379  -4.343  -4.145
  807    HB3  LEU  93           HB3      LEU  93  24.994  -3.070  -3.099
  808    HG   LEU  93           HG       LEU  93  22.115  -3.457  -2.838
  809   HD11  LEU  93          HD11      LEU  93  23.957  -5.733  -2.158
  810   HD12  LEU  93          HD12      LEU  93  22.307  -5.554  -1.560
  811   HD13  LEU  93          HD13      LEU  93  22.599  -5.752  -3.288
  812   HD21  LEU  93          HD21      LEU  93  24.356  -3.519  -0.848
  813   HD22  LEU  93          HD22      LEU  93  23.502  -2.074  -1.403
  814   HD23  LEU  93          HD23      LEU  93  22.631  -3.325  -0.514
  815    H    ASP  94           H        ASP  94  23.752  -3.891  -6.604
  816    HA   ASP  94           HA       ASP  94  26.320  -3.036  -7.543
  817    HB2  ASP  94           HB2      ASP  94  26.014  -4.626  -9.327
  818    HB3  ASP  94           HB3      ASP  94  25.423  -5.355  -7.838
  819    H    GLY  95           H        GLY  95  23.258  -1.724  -7.787
  820    HA2  GLY  95           HA2      GLY  95  23.009   0.449  -8.753
  821    HA3  GLY  95           HA3      GLY  95  24.185   0.004  -9.981
  822    H    THR  96           H        THR  96  21.946  -2.460  -9.367
  823    HA   THR  96           HA       THR  96  20.695  -1.889 -11.947
  824    HB   THR  96           HB       THR  96  20.829  -4.427 -10.312
  825    HG1  THR  96           HG1      THR  96  22.683  -4.447 -11.349
  826   HG21  THR  96          HG21      THR  96  18.695  -4.323 -11.512
  827   HG22  THR  96          HG22      THR  96  19.761  -5.540 -12.213
  828   HG23  THR  96          HG23      THR  96  19.552  -3.982 -13.015
  829    H    VAL  97           H        VAL  97  18.547  -1.510 -12.171
  830    HA   VAL  97           HA       VAL  97  17.096  -1.215  -9.636
  831    HB   VAL  97           HB       VAL  97  17.446   0.904 -10.806
  832   HG11  VAL  97          HG11      VAL  97  16.368   1.357 -12.952
  833   HG12  VAL  97          HG12      VAL  97  17.604   0.105 -13.083
  834   HG13  VAL  97          HG13      VAL  97  15.898  -0.339 -13.067
  835   HG21  VAL  97          HG21      VAL  97  15.427   0.667  -9.480
  836   HG22  VAL  97          HG22      VAL  97  15.119   1.676 -10.894
  837   HG23  VAL  97          HG23      VAL  97  14.571  -0.001 -10.871
  838    H    LYS  98           H        LYS  98  15.152  -2.081  -9.374
  839    HA   LYS  98           HA       LYS  98  13.852  -3.403 -11.645
  840    HB2  LYS  98           HB2      LYS  98  13.535  -5.476 -10.609
  841    HB3  LYS  98           HB3      LYS  98  15.208  -5.087 -10.246
  842    HG2  LYS  98           HG2      LYS  98  14.731  -4.616  -8.004
  843    HG3  LYS  98           HG3      LYS  98  12.999  -4.473  -8.315
  844    HD2  LYS  98           HD2      LYS  98  14.521  -7.047  -8.668
  845    HD3  LYS  98           HD3      LYS  98  13.740  -6.606  -7.148
  846    HE2  LYS  98           HE2      LYS  98  12.176  -7.958  -8.236
  847    HE3  LYS  98           HE3      LYS  98  11.610  -6.312  -8.535
  848    HZ1  LYS  98           HZ1      LYS  98  11.594  -7.882 -10.491
  849    HZ2  LYS  98           HZ2      LYS  98  13.290  -7.794 -10.482
  850    HZ3  LYS  98           HZ3      LYS  98  12.370  -6.397 -10.744
  851    H    THR  99           H        THR  99  11.555  -3.681 -11.368
  852    HA   THR  99           HA       THR  99  10.470  -2.047  -9.184
  853    HB   THR  99           HB       THR  99   9.281  -2.544 -11.925
  854    HG1  THR  99           HG1      THR  99  10.851  -1.045 -12.226
  855   HG21  THR  99          HG21      THR  99   8.340  -0.765  -9.675
  856   HG22  THR  99          HG22      THR  99   7.607  -2.300 -10.140
  857   HG23  THR  99          HG23      THR  99   7.579  -0.934 -11.259
  858    H    ILE 100           H        ILE 100   9.630  -3.339  -7.675
  859    HA   ILE 100           HA       ILE 100   8.234  -5.766  -8.565
  860    HB   ILE 100           HB       ILE 100  10.440  -6.260  -7.495
  861   HG12  ILE 100          HG12      ILE 100   8.209  -7.675  -7.312
  862   HG13  ILE 100          HG13      ILE 100   9.677  -8.169  -6.484
  863   HG21  ILE 100          HG21      ILE 100   9.177  -5.058  -5.041
  864   HG22  ILE 100          HG22      ILE 100  10.681  -5.978  -5.065
  865   HG23  ILE 100          HG23      ILE 100  10.574  -4.441  -5.924
  866   HD11  ILE 100          HD11      ILE 100   8.830  -7.196  -4.410
  867   HD12  ILE 100          HD12      ILE 100   7.361  -6.695  -5.248
  868   HD13  ILE 100          HD13      ILE 100   7.729  -8.410  -5.061
  869    H    MET 101           H        MET 101   6.329  -6.260  -7.433
  870    HA   MET 101           HA       MET 101   5.173  -3.923  -6.137
  871    HB2  MET 101           HB2      MET 101   3.889  -6.528  -6.947
  872    HB3  MET 101           HB3      MET 101   3.045  -5.077  -6.417
  873    HG2  MET 101           HG2      MET 101   4.539  -4.102  -8.462
  874    HG3  MET 101           HG3      MET 101   4.212  -5.742  -9.020
  875    HE1  MET 101           HE1      MET 101   1.808  -3.643  -6.680
  876    HE2  MET 101           HE2      MET 101   2.705  -2.468  -7.645
  877    HE3  MET 101           HE3      MET 101   0.971  -2.678  -7.898
  878    H    VAL 102           H        VAL 102   5.485  -3.703  -4.122
  879    HA   VAL 102           HA       VAL 102   5.157  -6.021  -2.327
  880    HB   VAL 102           HB       VAL 102   6.699  -3.601  -1.475
  881   HG11  VAL 102          HG11      VAL 102   6.720  -6.517  -0.738
  882   HG12  VAL 102          HG12      VAL 102   7.881  -5.343  -0.125
  883   HG13  VAL 102          HG13      VAL 102   6.167  -5.160   0.243
  884   HG21  VAL 102          HG21      VAL 102   7.728  -4.190  -3.571
  885   HG22  VAL 102          HG22      VAL 102   8.780  -4.679  -2.241
  886   HG23  VAL 102          HG23      VAL 102   7.812  -5.887  -3.090
  887    H    ASP 103           H        ASP 103   3.943  -5.758  -0.508
  888    HA   ASP 103           HA       ASP 103   1.710  -4.112  -0.802
  889    HB2  ASP 103           HB2      ASP 103   2.615  -5.522   1.704
  890    HB3  ASP 103           HB3      ASP 103   0.976  -5.002   1.317
  891    H    ASP 104           H        ASP 104   1.258  -2.131  -0.222
  892    HA   ASP 104           HA       ASP 104   3.303  -0.458   0.940
  893    HB2  ASP 104           HB2      ASP 104   1.763   0.227  -0.933
  894    HB3  ASP 104           HB3      ASP 104   0.449   0.253   0.228
  895    H    SER 105           H        SER 105   0.653  -2.264   2.049
  896    HA   SER 105           HA       SER 105  -0.133  -0.503   4.195
  897    HB2  SER 105           HB2      SER 105  -1.764  -1.844   2.938
  898    HB3  SER 105           HB3      SER 105  -0.988  -3.317   3.498
  899    HG   SER 105           HG       SER 105  -1.477  -2.338   5.694
  900    H    LYS 106           H        LYS 106   2.656  -1.591   4.279
  901    HA   LYS 106           HA       LYS 106   2.566  -2.496   7.011
  902    HB2  LYS 106           HB2      LYS 106   4.072  -4.503   6.448
  903    HB3  LYS 106           HB3      LYS 106   2.341  -4.650   6.192
  904    HG2  LYS 106           HG2      LYS 106   3.100  -5.553   4.260
  905    HG3  LYS 106           HG3      LYS 106   2.979  -3.872   3.762
  906    HD2  LYS 106           HD2      LYS 106   5.309  -3.558   3.962
  907    HD3  LYS 106           HD3      LYS 106   5.510  -5.083   4.836
  908    HE2  LYS 106           HE2      LYS 106   4.712  -4.734   1.949
  909    HE3  LYS 106           HE3      LYS 106   6.239  -5.374   2.555
  910    HZ1  LYS 106           HZ1      LYS 106   4.758  -7.151   1.851
  911    HZ2  LYS 106           HZ2      LYS 106   3.569  -6.630   2.941
  912    HZ3  LYS 106           HZ3      LYS 106   5.042  -7.239   3.523
  913    H    THR 107           H        THR 107   5.009  -3.229   7.597
  914    HA   THR 107           HA       THR 107   6.336  -0.677   7.394
  915    HB   THR 107           HB       THR 107   7.935  -1.747   9.047
  916    HG1  THR 107           HG1      THR 107   7.265  -3.725   9.941
  917   HG21  THR 107          HG21      THR 107   4.992  -1.668   9.737
  918   HG22  THR 107          HG22      THR 107   6.105  -0.300   9.769
  919   HG23  THR 107          HG23      THR 107   6.317  -1.636  10.901
  920    H    VAL 108           H        VAL 108   8.891  -0.983   7.586
  921    HA   VAL 108           HA       VAL 108   9.691  -1.396   4.914
  922    HB   VAL 108           HB       VAL 108  11.508  -1.107   7.291
  923   HG11  VAL 108          HG11      VAL 108  11.836  -0.322   4.401
  924   HG12  VAL 108          HG12      VAL 108  12.999  -0.005   5.690
  925   HG13  VAL 108          HG13      VAL 108  12.636  -1.666   5.218
  926   HG21  VAL 108          HG21      VAL 108  10.092   1.058   5.749
  927   HG22  VAL 108          HG22      VAL 108   9.817   0.618   7.434
  928   HG23  VAL 108          HG23      VAL 108  11.359   1.322   6.946
  929    H    THR 109           H        THR 109  10.683  -3.032   7.897
  930    HA   THR 109           HA       THR 109  12.417  -4.894   6.913
  931    HB   THR 109           HB       THR 109  10.446  -5.486   9.117
  932    HG1  THR 109           HG1      THR 109  12.142  -4.419  10.421
  933   HG21  THR 109          HG21      THR 109  12.332  -6.734  10.073
  934   HG22  THR 109          HG22      THR 109  13.325  -6.304   8.681
  935   HG23  THR 109          HG23      THR 109  11.919  -7.345   8.470
  936    H    ASP 110           H        ASP 110   8.880  -5.211   7.071
  937    HA   ASP 110           HA       ASP 110   8.788  -7.907   6.191
  938    HB2  ASP 110           HB2      ASP 110   6.954  -6.642   7.388
  939    HB3  ASP 110           HB3      ASP 110   6.647  -5.784   5.883
  940    H    MET 111           H        MET 111   8.410  -4.801   4.575
  941    HA   MET 111           HA       MET 111   7.956  -5.761   1.972
  942    HB2  MET 111           HB2      MET 111   7.346  -3.562   2.270
  943    HB3  MET 111           HB3      MET 111   8.776  -3.179   3.210
  944    HG2  MET 111           HG2      MET 111  10.118  -3.197   1.164
  945    HG3  MET 111           HG3      MET 111   8.669  -3.559   0.228
  946    HE1  MET 111           HE1      MET 111   8.133  -1.331   3.316
  947    HE2  MET 111           HE2      MET 111   9.873  -1.152   3.051
  948    HE3  MET 111           HE3      MET 111   8.797   0.226   2.811
  949    H    LEU 112           H        LEU 112  10.931  -4.863   3.664
  950    HA   LEU 112           HA       LEU 112  12.660  -5.067   1.443
  951    HB2  LEU 112           HB2      LEU 112  13.045  -4.054   3.805
  952    HB3  LEU 112           HB3      LEU 112  13.523  -5.683   4.247
  953    HG   LEU 112           HG       LEU 112  15.206  -5.566   2.342
  954   HD11  LEU 112          HD11      LEU 112  14.191  -3.680   1.162
  955   HD12  LEU 112          HD12      LEU 112  14.534  -2.634   2.541
  956   HD13  LEU 112          HD13      LEU 112  15.861  -3.334   1.613
  957   HD21  LEU 112          HD21      LEU 112  15.471  -3.675   4.672
  958   HD22  LEU 112          HD22      LEU 112  15.866  -5.394   4.664
  959   HD23  LEU 112          HD23      LEU 112  16.802  -4.270   3.681
  960    H    MET 113           H        MET 113  11.449  -7.391   3.755
  961    HA   MET 113           HA       MET 113  13.058  -9.604   3.215
  962    HB2  MET 113           HB2      MET 113  11.364  -9.502   5.013
  963    HB3  MET 113           HB3      MET 113  10.090  -9.542   3.809
  964    HG2  MET 113           HG2      MET 113  10.791 -11.766   3.117
  965    HG3  MET 113           HG3      MET 113  12.095 -11.730   4.303
  966    HE1  MET 113           HE1      MET 113  10.090 -11.650   7.678
  967    HE2  MET 113           HE2      MET 113  11.691 -11.668   6.936
  968    HE3  MET 113           HE3      MET 113  10.648 -10.257   6.750
  969    H    THR 114           H        THR 114  10.273  -8.319   1.598
  970    HA   THR 114           HA       THR 114   9.999 -10.451  -0.281
  971    HB   THR 114           HB       THR 114   8.810  -7.680  -0.205
  972    HG1  THR 114           HG1      THR 114   7.829 -10.263   0.530
  973   HG21  THR 114          HG21      THR 114   7.165  -8.539  -1.837
  974   HG22  THR 114          HG22      THR 114   8.107 -10.024  -1.981
  975   HG23  THR 114          HG23      THR 114   8.798  -8.486  -2.505
  976    H    ILE 115           H        ILE 115  11.637  -7.288  -0.302
  977    HA   ILE 115           HA       ILE 115  11.931  -7.197  -3.139
  978    HB   ILE 115           HB       ILE 115  13.502  -5.695  -1.040
  979   HG12  ILE 115          HG12      ILE 115  11.044  -4.809  -2.569
  980   HG13  ILE 115          HG13      ILE 115  11.029  -5.353  -0.893
  981   HG21  ILE 115          HG21      ILE 115  14.581  -5.695  -3.213
  982   HG22  ILE 115          HG22      ILE 115  13.083  -5.169  -3.980
  983   HG23  ILE 115          HG23      ILE 115  13.924  -4.096  -2.860
  984   HD11  ILE 115          HD11      ILE 115  10.997  -2.933  -1.034
  985   HD12  ILE 115          HD12      ILE 115  12.489  -3.496  -0.281
  986   HD13  ILE 115          HD13      ILE 115  12.499  -2.952  -1.959
  987    H    CYS 116           H        CYS 116  14.188  -7.884  -0.463
  988    HA   CYS 116           HA       CYS 116  16.398  -8.424  -2.142
  989    HB2  CYS 116           HB2      CYS 116  15.910  -9.434   0.669
  990    HB3  CYS 116           HB3      CYS 116  17.466  -9.353  -0.159
  991    HG   CYS 116           HG       CYS 116  17.105  -6.437  -0.417
  992    H    ALA 117           H        ALA 117  13.713 -10.327  -1.066
  993    HA   ALA 117           HA       ALA 117  14.746 -12.894  -1.666
  994    HB1  ALA 117           HB1      ALA 117  12.427 -13.633  -1.598
  995    HB2  ALA 117           HB2      ALA 117  12.778 -12.556  -0.247
  996    HB3  ALA 117           HB3      ALA 117  11.879 -11.958  -1.640
  997    H    ARG 118           H        ARG 118  13.268 -10.366  -3.585
  998    HA   ARG 118           HA       ARG 118  12.623 -11.923  -5.852
  999    HB2  ARG 118           HB2      ARG 118  13.383  -8.984  -5.833
 1000    HB3  ARG 118           HB3      ARG 118  12.486  -9.837  -7.082
 1001    HG2  ARG 118           HG2      ARG 118  11.571  -9.290  -4.274
 1002    HG3  ARG 118           HG3      ARG 118  10.968  -8.548  -5.754
 1003    HD2  ARG 118           HD2      ARG 118  10.791 -11.482  -5.108
 1004    HD3  ARG 118           HD3      ARG 118   9.493 -10.318  -4.856
 1005    HE   ARG 118           HE       ARG 118  10.547 -10.500  -7.565
 1006   HH11  ARG 118          HH11      ARG 118   8.124 -11.604  -5.279
 1007   HH12  ARG 118          HH12      ARG 118   6.941 -11.967  -6.508
 1008   HH21  ARG 118          HH21      ARG 118   9.015 -11.013  -9.185
 1009   HH22  ARG 118          HH22      ARG 118   7.453 -11.634  -8.735
 1010    H    ILE 119           H        ILE 119  15.538 -10.182  -4.887
 1011    HA   ILE 119           HA       ILE 119  16.942 -10.762  -7.322
 1012    HB   ILE 119           HB       ILE 119  18.399 -10.130  -4.790
 1013   HG12  ILE 119          HG12      ILE 119  16.360  -8.702  -4.764
 1014   HG13  ILE 119          HG13      ILE 119  17.854  -7.780  -4.903
 1015   HG21  ILE 119          HG21      ILE 119  19.625 -10.418  -6.874
 1016   HG22  ILE 119          HG22      ILE 119  18.655  -9.152  -7.631
 1017   HG23  ILE 119          HG23      ILE 119  19.745  -8.753  -6.301
 1018   HD11  ILE 119          HD11      ILE 119  15.948  -8.433  -7.139
 1019   HD12  ILE 119          HD12      ILE 119  16.144  -6.870  -6.346
 1020   HD13  ILE 119          HD13      ILE 119  17.461  -7.541  -7.309
 1021    H    GLY 120           H        GLY 120  16.490 -12.236  -4.210
 1022    HA2  GLY 120           HA2      GLY 120  16.879 -14.554  -3.821
 1023    HA3  GLY 120           HA3      GLY 120  18.110 -14.517  -5.075
 1024    H    ILE 121           H        ILE 121  17.956 -12.012  -2.692
 1025    HA   ILE 121           HA       ILE 121  20.668 -12.496  -1.923
 1026    HB   ILE 121           HB       ILE 121  18.639 -10.541  -0.827
 1027   HG12  ILE 121          HG12      ILE 121  20.931 -10.150  -2.760
 1028   HG13  ILE 121          HG13      ILE 121  19.231 -10.212  -3.208
 1029   HG21  ILE 121          HG21      ILE 121  20.589  -9.368   0.122
 1030   HG22  ILE 121          HG22      ILE 121  20.349 -10.967   0.828
 1031   HG23  ILE 121          HG23      ILE 121  21.614 -10.714  -0.374
 1032   HD11  ILE 121          HD11      ILE 121  18.814  -8.196  -1.897
 1033   HD12  ILE 121          HD12      ILE 121  20.517  -8.140  -1.441
 1034   HD13  ILE 121          HD13      ILE 121  20.047  -7.925  -3.128
 1035    H    THR 122           H        THR 122  17.528 -13.101  -0.519
 1036    HA   THR 122           HA       THR 122  16.842 -14.402   1.198
 1037    HB   THR 122           HB       THR 122  19.738 -15.213   1.522
 1038    HG1  THR 122           HG1      THR 122  17.745 -15.912  -0.276
 1039   HG21  THR 122          HG21      THR 122  18.380 -15.697   3.504
 1040   HG22  THR 122          HG22      THR 122  18.815 -17.184   2.660
 1041   HG23  THR 122          HG23      THR 122  17.190 -16.519   2.497
 1042    H    ASN 123           H        ASN 123  20.060 -13.256   2.350
 1043    HA   ASN 123           HA       ASN 123  18.857 -12.560   4.891
 1044    HB2  ASN 123           HB2      ASN 123  21.244 -13.483   4.557
 1045    HB3  ASN 123           HB3      ASN 123  21.670 -11.847   4.071
 1046   HD21  ASN 123          HD21      ASN 123  23.062 -11.633   5.828
 1047   HD22  ASN 123          HD22      ASN 123  22.466 -11.406   7.438
 1048    H    HIS 124           H        HIS 124  17.504 -10.897   4.697
 1049    HA   HIS 124           HA       HIS 124  18.310  -8.565   3.114
 1050    HB2  HIS 124           HB2      HIS 124  15.950  -7.912   3.198
 1051    HB3  HIS 124           HB3      HIS 124  16.122  -9.556   2.592
 1052    HD1  HIS 124           HD1      HIS 124  14.695  -7.584   5.405
 1053    HD2  HIS 124           HD2      HIS 124  15.164 -11.567   4.331
 1054    HE1  HIS 124           HE1      HIS 124  13.175  -8.877   6.936
 1055    HE2  HIS 124           HE2      HIS 124  13.707 -11.300   6.446
 1056    H    ASP 125           H        ASP 125  18.304  -9.581   6.298
 1057    HA   ASP 125           HA       ASP 125  17.349  -7.241   7.579
 1058    HB2  ASP 125           HB2      ASP 125  17.412  -9.431   8.696
 1059    HB3  ASP 125           HB3      ASP 125  19.172  -9.402   8.650
 1060    H    GLU 126           H        GLU 126  20.362  -8.111   6.146
 1061    HA   GLU 126           HA       GLU 126  22.020  -6.312   7.605
 1062    HB2  GLU 126           HB2      GLU 126  22.473  -7.444   4.839
 1063    HB3  GLU 126           HB3      GLU 126  23.686  -6.696   5.866
 1064    HG2  GLU 126           HG2      GLU 126  23.202  -8.544   7.532
 1065    HG3  GLU 126           HG3      GLU 126  22.302  -9.326   6.238
 1066    H    TYR 127           H        TYR 127  19.517  -5.626   5.599
 1067    HA   TYR 127           HA       TYR 127  20.857  -3.287   4.415
 1068    HB2  TYR 127           HB2      TYR 127  18.412  -4.737   3.399
 1069    HB3  TYR 127           HB3      TYR 127  19.212  -3.376   2.622
 1070    HD1  TYR 127           HD1      TYR 127  21.713  -3.738   2.014
 1071    HD2  TYR 127           HD2      TYR 127  18.966  -6.883   2.785
 1072    HE1  TYR 127           HE1      TYR 127  23.161  -5.288   0.790
 1073    HE2  TYR 127           HE2      TYR 127  20.400  -8.449   1.571
 1074    HH   TYR 127           HH       TYR 127  22.134  -8.406  -0.158
 1075    H    SER 128           H        SER 128  19.807  -1.318   4.394
 1076    HA   SER 128           HA       SER 128  17.221  -1.170   5.784
 1077    HB2  SER 128           HB2      SER 128  19.456   0.876   5.686
 1078    HB3  SER 128           HB3      SER 128  17.838   1.211   6.303
 1079    HG   SER 128           HG       SER 128  18.948   0.646   8.076
 1080    H    LEU 129           H        LEU 129  16.051   0.953   4.973
 1081    HA   LEU 129           HA       LEU 129  16.270   0.844   2.038
 1082    HB2  LEU 129           HB2      LEU 129  14.125   0.125   3.503
 1083    HB3  LEU 129           HB3      LEU 129  13.774   1.832   3.306
 1084    HG   LEU 129           HG       LEU 129  14.322  -0.013   0.977
 1085   HD11  LEU 129          HD11      LEU 129  11.672   0.783   2.168
 1086   HD12  LEU 129          HD12      LEU 129  11.899  -0.084   0.649
 1087   HD13  LEU 129          HD13      LEU 129  12.377  -0.834   2.171
 1088   HD21  LEU 129          HD21      LEU 129  13.177   1.734  -0.307
 1089   HD22  LEU 129          HD22      LEU 129  13.035   2.708   1.156
 1090   HD23  LEU 129          HD23      LEU 129  14.626   2.345   0.489
 1091    H    VAL 130           H        VAL 130  16.313   2.758   0.896
 1092    HA   VAL 130           HA       VAL 130  16.066   5.244   2.415
 1093    HB   VAL 130           HB       VAL 130  18.384   5.142   2.441
 1094   HG11  VAL 130          HG11      VAL 130  18.292   3.997  -0.331
 1095   HG12  VAL 130          HG12      VAL 130  19.764   4.375   0.565
 1096   HG13  VAL 130          HG13      VAL 130  18.662   3.136   1.161
 1097   HG21  VAL 130          HG21      VAL 130  17.714   7.247   1.427
 1098   HG22  VAL 130          HG22      VAL 130  19.259   6.701   0.771
 1099   HG23  VAL 130          HG23      VAL 130  17.782   6.511  -0.175
 1100    H    ARG 131           H        ARG 131  14.585   6.432   1.483
 1101    HA   ARG 131           HA       ARG 131  13.906   5.878  -1.321
 1102    HB2  ARG 131           HB2      ARG 131  12.283   7.431   0.693
 1103    HB3  ARG 131           HB3      ARG 131  11.734   6.743  -0.828
 1104    HG2  ARG 131           HG2      ARG 131  12.093   4.490   0.087
 1105    HG3  ARG 131           HG3      ARG 131  12.569   5.215   1.626
 1106    HD2  ARG 131           HD2      ARG 131  10.274   4.594   1.808
 1107    HD3  ARG 131           HD3      ARG 131  10.349   6.356   1.682
 1108    HE   ARG 131           HE       ARG 131   9.636   6.146  -0.618
 1109   HH11  ARG 131          HH11      ARG 131   9.307   3.283   1.351
 1110   HH12  ARG 131          HH12      ARG 131   8.052   2.590   0.381
 1111   HH21  ARG 131          HH21      ARG 131   7.974   5.243  -1.917
 1112   HH22  ARG 131          HH22      ARG 131   7.295   3.706  -1.486
 1113    H    GLU 132           H        GLU 132  15.247   7.218  -2.484
 1114    HA   GLU 132           HA       GLU 132  15.428  10.005  -1.833
 1115    HB2  GLU 132           HB2      GLU 132  16.256   8.511  -4.334
 1116    HB3  GLU 132           HB3      GLU 132  16.597  10.208  -4.023
 1117    HG2  GLU 132           HG2      GLU 132  17.763   9.387  -1.901
 1118    HG3  GLU 132           HG3      GLU 132  17.698   7.791  -2.649
 1119    H    LEU 133           H        LEU 133  13.806  11.364  -2.145
 1120    HA   LEU 133           HA       LEU 133  11.856  10.678  -4.226
 1121    HB2  LEU 133           HB2      LEU 133  11.310  12.631  -2.030
 1122    HB3  LEU 133           HB3      LEU 133  10.174  11.739  -3.009
 1123    HG   LEU 133           HG       LEU 133  11.837  10.668  -0.739
 1124   HD11  LEU 133          HD11      LEU 133   9.909  11.935  -0.049
 1125   HD12  LEU 133          HD12      LEU 133   8.879  11.035  -1.164
 1126   HD13  LEU 133          HD13      LEU 133   9.607  10.216   0.220
 1127   HD21  LEU 133          HD21      LEU 133  10.712   8.530  -1.124
 1128   HD22  LEU 133          HD22      LEU 133   9.969   9.182  -2.584
 1129   HD23  LEU 133          HD23      LEU 133  11.720   8.984  -2.499
 1130    H    MET 134           H        MET 134  10.568  12.684  -4.814
 1131    HA   MET 134           HA       MET 134  12.426  14.753  -5.766
 1132    HB2  MET 134           HB2      MET 134  10.622  15.237  -7.397
 1133    HB3  MET 134           HB3      MET 134  11.144  13.558  -7.480
 1134    HG2  MET 134           HG2      MET 134   8.884  13.264  -7.497
 1135    HG3  MET 134           HG3      MET 134   9.197  13.202  -5.763
 1136    HE1  MET 134           HE1      MET 134   6.835  13.786  -4.923
 1137    HE2  MET 134           HE2      MET 134   5.812  15.037  -5.630
 1138    HE3  MET 134           HE3      MET 134   6.288  13.638  -6.592
 1139    H    GLU 135           H        GLU 135  10.297  14.151  -3.331
 1140    HA   GLU 135           HA       GLU 135   8.404  16.131  -3.301
 1141    HB2  GLU 135           HB2      GLU 135   9.809  14.645  -1.126
 1142    HB3  GLU 135           HB3      GLU 135   8.592  15.857  -0.742
 1143    HG2  GLU 135           HG2      GLU 135   7.166  14.473  -2.468
 1144    HG3  GLU 135           HG3      GLU 135   8.308  13.200  -2.031
 1145    H    GLU 136           H        GLU 136   8.437  18.253  -3.111
 1146    HA   GLU 136           HA       GLU 136  10.745  19.782  -2.612
 1147    HB2  GLU 136           HB2      GLU 136   9.244  21.693  -2.481
 1148    HB3  GLU 136           HB3      GLU 136   8.742  20.638  -3.795
 1149    HG2  GLU 136           HG2      GLU 136   7.019  19.674  -2.306
 1150    HG3  GLU 136           HG3      GLU 136   7.489  20.833  -1.066
 1151    H    LYS 137           H        LYS 137   8.489  18.233  -0.561
 1152    HA   LYS 137           HA       LYS 137   8.970  19.728   1.822
 1153    HB2  LYS 137           HB2      LYS 137   8.072  16.859   1.784
 1154    HB3  LYS 137           HB3      LYS 137   7.628  18.134   2.908
 1155    HG2  LYS 137           HG2      LYS 137   6.308  19.215   1.150
 1156    HG3  LYS 137           HG3      LYS 137   6.743  17.915   0.036
 1157    HD2  LYS 137           HD2      LYS 137   5.740  16.318   1.723
 1158    HD3  LYS 137           HD3      LYS 137   5.089  17.736   2.544
 1159    HE2  LYS 137           HE2      LYS 137   3.392  16.839   1.106
 1160    HE3  LYS 137           HE3      LYS 137   3.951  18.368   0.428
 1161    HZ1  LYS 137           HZ1      LYS 137   5.087  17.289  -1.269
 1162    HZ2  LYS 137           HZ2      LYS 137   3.661  16.379  -1.135
 1163    HZ3  LYS 137           HZ3      LYS 137   5.106  15.799  -0.460
 1164    H    LYS 138           H        LYS 138   9.647  16.281   1.324
 1165    HA   LYS 138           HA       LYS 138  11.793  16.153   3.118
 1166    HB2  LYS 138           HB2      LYS 138  10.978  14.387   0.833
 1167    HB3  LYS 138           HB3      LYS 138  12.398  14.046   1.809
 1168    HG2  LYS 138           HG2      LYS 138  10.887  12.781   2.870
 1169    HG3  LYS 138           HG3      LYS 138  10.674  14.275   3.778
 1170    HD2  LYS 138           HD2      LYS 138   8.723  14.836   2.528
 1171    HD3  LYS 138           HD3      LYS 138   9.005  13.517   1.388
 1172    HE2  LYS 138           HE2      LYS 138   8.734  11.922   3.293
 1173    HE3  LYS 138           HE3      LYS 138   8.265  13.296   4.295
 1174    HZ1  LYS 138           HZ1      LYS 138   6.353  13.658   3.002
 1175    HZ2  LYS 138           HZ2      LYS 138   6.400  11.987   3.281
 1176    HZ3  LYS 138           HZ3      LYS 138   6.872  12.610   1.770
 1177    H    ASP 169           H        ASP 169  12.014  15.688  -0.381
 1178    HA   ASP 169           HA       ASP 169  13.815  15.604  -1.747
 1179    HB2  ASP 169           HB2      ASP 169  13.336  18.068  -1.630
 1180    HB3  ASP 169           HB3      ASP 169  14.573  18.200  -0.384
 1181    H    GLU 170           H        GLU 170  14.046  14.265   0.716
 1182    HA   GLU 170           HA       GLU 170  16.934  14.392   1.174
 1183    HB2  GLU 170           HB2      GLU 170  16.484  13.443   3.401
 1184    HB3  GLU 170           HB3      GLU 170  15.676  14.987   3.169
 1185    HG2  GLU 170           HG2      GLU 170  13.572  13.860   2.766
 1186    HG3  GLU 170           HG3      GLU 170  14.365  12.292   2.912
 1187    H    LEU 171           H        LEU 171  17.379  12.068   2.391
 1188    HA   LEU 171           HA       LEU 171  17.190  10.234   0.168
 1189    HB2  LEU 171           HB2      LEU 171  18.515   9.795   2.838
 1190    HB3  LEU 171           HB3      LEU 171  18.825   8.941   1.338
 1191    HG   LEU 171           HG       LEU 171  19.480  11.821   1.909
 1192   HD11  LEU 171          HD11      LEU 171  20.957  10.271   3.053
 1193   HD12  LEU 171          HD12      LEU 171  21.250   9.412   1.541
 1194   HD13  LEU 171          HD13      LEU 171  21.803  11.075   1.732
 1195   HD21  LEU 171          HD21      LEU 171  20.584  11.782  -0.284
 1196   HD22  LEU 171          HD22      LEU 171  19.956  10.156  -0.559
 1197   HD23  LEU 171          HD23      LEU 171  18.843  11.520  -0.416
 1198    H    ASN 172           H        ASN 172  15.667  10.767   3.194
 1199    HA   ASN 172           HA       ASN 172  14.218   9.587   4.478
 1200    HB2  ASN 172           HB2      ASN 172  13.397   8.562   1.757
 1201    HB3  ASN 172           HB3      ASN 172  12.491   8.259   3.228
 1202   HD21  ASN 172          HD21      ASN 172  12.944  10.286   0.635
 1203   HD22  ASN 172          HD22      ASN 172  12.003  11.629   1.186
 1204    H    TRP 173           H        TRP 173  15.950   8.345   5.499
 1205    HA   TRP 173           HA       TRP 173  16.485   5.718   4.387
 1206    HB2  TRP 173           HB2      TRP 173  17.674   7.414   6.549
 1207    HB3  TRP 173           HB3      TRP 173  17.865   5.667   6.651
 1208    HD1  TRP 173           HD1      TRP 173  18.764   8.612   4.314
 1209    HE1  TRP 173           HE1      TRP 173  20.870   7.966   3.001
 1210    HE3  TRP 173           HE3      TRP 173  19.255   3.780   5.904
 1211    HZ2  TRP 173           HZ2      TRP 173  22.533   5.702   2.678
 1212    HZ3  TRP 173           HZ3      TRP 173  21.133   2.442   5.048
 1213    HH2  TRP 173           HH2      TRP 173  22.737   3.386   3.467
 1214    H    LEU 174           H        LEU 174  14.859   4.344   4.762
 1215    HA   LEU 174           HA       LEU 174  13.055   4.614   6.943
 1216    HB2  LEU 174           HB2      LEU 174  13.508   2.230   5.156
 1217    HB3  LEU 174           HB3      LEU 174  12.141   2.474   6.222
 1218    HG   LEU 174           HG       LEU 174  12.768   3.855   3.640
 1219   HD11  LEU 174          HD11      LEU 174  10.410   2.374   4.784
 1220   HD12  LEU 174          HD12      LEU 174  10.393   3.217   3.228
 1221   HD13  LEU 174          HD13      LEU 174  11.479   1.851   3.483
 1222   HD21  LEU 174          HD21      LEU 174  10.870   5.384   4.117
 1223   HD22  LEU 174          HD22      LEU 174  10.867   4.800   5.783
 1224   HD23  LEU 174          HD23      LEU 174  12.270   5.666   5.158
 1225    H    ASP 175           H        ASP 175  13.302   4.015   8.925
 1226    HA   ASP 175           HA       ASP 175  15.748   2.681   9.718
 1227    HB2  ASP 175           HB2      ASP 175  13.557   3.743  11.506
 1228    HB3  ASP 175           HB3      ASP 175  15.228   3.410  11.948
 1229    H    HIS 176           H        HIS 176  13.282   1.295   8.536
 1230    HA   HIS 176           HA       HIS 176  12.227  -0.698   8.713
 1231    HB2  HIS 176           HB2      HIS 176  14.458  -1.121  10.676
 1232    HB3  HIS 176           HB3      HIS 176  13.216  -2.349  10.445
 1233    HD1  HIS 176           HD1      HIS 176  13.069  -3.435   8.079
 1234    HD2  HIS 176           HD2      HIS 176  16.359  -0.992   8.679
 1235    HE1  HIS 176           HE1      HIS 176  14.565  -3.831   6.097
 1236    HE2  HIS 176           HE2      HIS 176  16.704  -2.626   6.702
 1237    H    GLY 177           H        GLY 177  11.629   1.664  10.533
 1238    HA2  GLY 177           HA2      GLY 177   9.680   0.210  12.191
 1239    HA3  GLY 177           HA3      GLY 177  10.712   1.419  12.949
 1240    H    ARG 178           H        ARG 178   9.743   1.878   9.706
 1241    HA   ARG 178           HA       ARG 178   7.772   3.900  10.517
 1242    HB2  ARG 178           HB2      ARG 178  10.040   4.849   9.954
 1243    HB3  ARG 178           HB3      ARG 178   9.842   4.209   8.331
 1244    HG2  ARG 178           HG2      ARG 178   9.303   6.531   8.313
 1245    HG3  ARG 178           HG3      ARG 178   7.814   5.611   8.083
 1246    HD2  ARG 178           HD2      ARG 178   7.603   7.518   9.668
 1247    HD3  ARG 178           HD3      ARG 178   7.171   5.955  10.359
 1248    HE   ARG 178           HE       ARG 178   9.903   6.767  10.794
 1249   HH11  ARG 178          HH11      ARG 178   6.634   6.807  12.044
 1250   HH12  ARG 178          HH12      ARG 178   7.134   7.094  13.682
 1251   HH21  ARG 178          HH21      ARG 178  10.568   7.077  12.953
 1252   HH22  ARG 178          HH22      ARG 178   9.369   7.204  14.207
 1253    H    THR 179           H        THR 179   5.849   3.517   9.543
 1254    HA   THR 179           HA       THR 179   5.754   1.728   7.268
 1255    HB   THR 179           HB       THR 179   3.941   1.348   8.689
 1256    HG1  THR 179           HG1      THR 179   2.204   1.703   7.359
 1257   HG21  THR 179          HG21      THR 179   2.428   3.055   9.538
 1258   HG22  THR 179          HG22      THR 179   3.322   4.303   8.670
 1259   HG23  THR 179          HG23      THR 179   4.091   3.429   9.994
 1260    H    LEU 180           H        LEU 180   4.717   2.274   5.279
 1261    HA   LEU 180           HA       LEU 180   5.962   4.598   4.194
 1262    HB2  LEU 180           HB2      LEU 180   3.957   2.854   2.786
 1263    HB3  LEU 180           HB3      LEU 180   5.327   3.715   2.101
 1264    HG   LEU 180           HG       LEU 180   5.498   1.317   3.925
 1265   HD11  LEU 180          HD11      LEU 180   5.994   1.588   0.971
 1266   HD12  LEU 180          HD12      LEU 180   6.376   0.167   1.944
 1267   HD13  LEU 180          HD13      LEU 180   4.699   0.678   1.751
 1268   HD21  LEU 180          HD21      LEU 180   7.861   1.378   3.563
 1269   HD22  LEU 180          HD22      LEU 180   7.703   2.743   2.454
 1270   HD23  LEU 180          HD23      LEU 180   7.344   2.949   4.167
 1271    H    ARG 181           H        ARG 181   2.841   3.805   5.364
 1272    HA   ARG 181           HA       ARG 181   1.408   5.789   3.875
 1273    HB2  ARG 181           HB2      ARG 181   0.471   3.607   4.721
 1274    HB3  ARG 181           HB3      ARG 181   0.519   4.285   6.340
 1275    HG2  ARG 181           HG2      ARG 181  -1.697   4.338   5.091
 1276    HG3  ARG 181           HG3      ARG 181  -1.165   5.825   5.878
 1277    HD2  ARG 181           HD2      ARG 181  -2.100   6.038   3.525
 1278    HD3  ARG 181           HD3      ARG 181  -0.547   6.812   3.843
 1279    HE   ARG 181           HE       ARG 181  -0.230   4.165   2.802
 1280   HH11  ARG 181          HH11      ARG 181  -0.983   7.450   1.921
 1281   HH12  ARG 181          HH12      ARG 181  -0.317   7.323   0.317
 1282   HH21  ARG 181          HH21      ARG 181   0.705   3.974   0.716
 1283   HH22  ARG 181          HH22      ARG 181   0.683   5.356  -0.353
 1284    H    GLU 182           H        GLU 182   3.210   5.765   6.805
 1285    HA   GLU 182           HA       GLU 182   1.955   8.246   7.714
 1286    HB2  GLU 182           HB2      GLU 182   3.066   7.937   9.783
 1287    HB3  GLU 182           HB3      GLU 182   2.495   6.346   9.313
 1288    HG2  GLU 182           HG2      GLU 182   4.724   5.770   8.524
 1289    HG3  GLU 182           HG3      GLU 182   5.302   7.371   8.973
 1290    H    GLN 183           H        GLN 183   4.527   7.154   5.839
 1291    HA   GLN 183           HA       GLN 183   6.331   9.347   6.287
 1292    HB2  GLN 183           HB2      GLN 183   6.152   7.374   4.007
 1293    HB3  GLN 183           HB3      GLN 183   7.464   8.520   4.251
 1294    HG2  GLN 183           HG2      GLN 183   8.116   7.430   6.274
 1295    HG3  GLN 183           HG3      GLN 183   6.706   6.372   6.210
 1296   HE21  GLN 183          HE21      GLN 183   7.950   4.513   6.191
 1297   HE22  GLN 183          HE22      GLN 183   8.879   4.046   4.812
 1298    H    GLY 184           H        GLY 184   3.805   8.504   3.993
 1299    HA2  GLY 184           HA2      GLY 184   2.522   9.919   2.674
 1300    HA3  GLY 184           HA3      GLY 184   3.500  11.274   3.223
 1301    H    VAL 185           H        VAL 185   5.221   8.551   2.085
 1302    HA   VAL 185           HA       VAL 185   6.330  10.013  -0.096
 1303    HB   VAL 185           HB       VAL 185   7.485   7.854  -0.628
 1304   HG11  VAL 185          HG11      VAL 185   7.649   8.789   2.236
 1305   HG12  VAL 185          HG12      VAL 185   8.881   7.858   1.383
 1306   HG13  VAL 185          HG13      VAL 185   8.497   9.498   0.861
 1307   HG21  VAL 185          HG21      VAL 185   5.794   6.306   0.147
 1308   HG22  VAL 185          HG22      VAL 185   7.299   6.037   1.026
 1309   HG23  VAL 185          HG23      VAL 185   5.969   6.902   1.796
 1310    H    GLU 186           H        GLU 186   6.300   9.317  -2.344
 1311    HA   GLU 186           HA       GLU 186   3.635   8.479  -3.135
 1312    HB2  GLU 186           HB2      GLU 186   5.914   9.763  -4.646
 1313    HB3  GLU 186           HB3      GLU 186   4.472   9.158  -5.440
 1314    HG2  GLU 186           HG2      GLU 186   4.440  11.230  -3.269
 1315    HG3  GLU 186           HG3      GLU 186   4.477  11.601  -4.991
 1316    H    GLU 187           H        GLU 187   3.731   7.275  -5.374
 1317    HA   GLU 187           HA       GLU 187   5.173   4.802  -4.825
 1318    HB2  GLU 187           HB2      GLU 187   2.798   5.537  -6.486
 1319    HB3  GLU 187           HB3      GLU 187   3.630   4.008  -6.753
 1320    HG2  GLU 187           HG2      GLU 187   3.149   3.267  -4.554
 1321    HG3  GLU 187           HG3      GLU 187   2.587   4.861  -4.066
 1322    H    HIS 188           H        HIS 188   5.190   7.470  -6.989
 1323    HA   HIS 188           HA       HIS 188   6.663   6.098  -9.071
 1324    HB2  HIS 188           HB2      HIS 188   6.722   8.318 -10.179
 1325    HB3  HIS 188           HB3      HIS 188   5.090   7.828  -9.737
 1326    HD1  HIS 188           HD1      HIS 188   3.760   9.543  -8.541
 1327    HD2  HIS 188           HD2      HIS 188   7.845  10.198  -8.165
 1328    HE1  HIS 188           HE1      HIS 188   3.996  11.647  -7.184
 1329    HE2  HIS 188           HE2      HIS 188   6.464  11.850  -6.761
 1330    H    GLU 189           H        GLU 189   7.615   7.038  -6.133
 1331    HA   GLU 189           HA       GLU 189   9.977   8.568  -6.804
 1332    HB2  GLU 189           HB2      GLU 189   9.236   7.285  -4.171
 1333    HB3  GLU 189           HB3      GLU 189  10.421   8.556  -4.430
 1334    HG2  GLU 189           HG2      GLU 189   7.461   8.839  -4.881
 1335    HG3  GLU 189           HG3      GLU 189   8.327   9.371  -3.443
 1336    H    THR 190           H        THR 190  12.073   7.788  -6.984
 1337    HA   THR 190           HA       THR 190  12.455   4.950  -7.124
 1338    HB   THR 190           HB       THR 190  14.499   7.179  -7.265
 1339    HG1  THR 190           HG1      THR 190  12.883   7.154  -8.965
 1340   HG21  THR 190          HG21      THR 190  14.727   4.263  -8.035
 1341   HG22  THR 190          HG22      THR 190  15.535   5.043  -6.673
 1342   HG23  THR 190          HG23      THR 190  15.950   5.501  -8.326
 1343    H    LEU 191           H        LEU 191  13.105   3.605  -5.588
 1344    HA   LEU 191           HA       LEU 191  14.166   4.763  -3.088
 1345    HB2  LEU 191           HB2      LEU 191  12.835   2.064  -3.292
 1346    HB3  LEU 191           HB3      LEU 191  13.184   2.986  -1.848
 1347    HG   LEU 191           HG       LEU 191  10.899   3.194  -2.008
 1348   HD11  LEU 191          HD11      LEU 191  11.842   5.411  -1.829
 1349   HD12  LEU 191          HD12      LEU 191  11.901   5.551  -3.586
 1350   HD13  LEU 191          HD13      LEU 191  10.345   5.446  -2.759
 1351   HD21  LEU 191          HD21      LEU 191   9.644   3.520  -4.073
 1352   HD22  LEU 191          HD22      LEU 191  11.151   3.503  -4.990
 1353   HD23  LEU 191          HD23      LEU 191  10.627   2.057  -4.127
 1354    H    LEU 192           H        LEU 192  16.062   3.799  -2.221
 1355    HA   LEU 192           HA       LEU 192  17.381   1.957  -4.102
 1356    HB2  LEU 192           HB2      LEU 192  18.841   3.655  -2.113
 1357    HB3  LEU 192           HB3      LEU 192  19.419   2.981  -3.622
 1358    HG   LEU 192           HG       LEU 192  17.439   5.247  -3.417
 1359   HD11  LEU 192          HD11      LEU 192  19.609   5.899  -2.545
 1360   HD12  LEU 192          HD12      LEU 192  20.393   5.290  -4.004
 1361   HD13  LEU 192          HD13      LEU 192  19.299   6.671  -4.101
 1362   HD21  LEU 192          HD21      LEU 192  18.976   4.170  -5.778
 1363   HD22  LEU 192          HD22      LEU 192  17.256   3.923  -5.474
 1364   HD23  LEU 192          HD23      LEU 192  17.872   5.546  -5.785
 1365    H    LEU 193           H        LEU 193  18.116   0.032  -3.331
 1366    HA   LEU 193           HA       LEU 193  17.798  -0.577  -0.528
 1367    HB2  LEU 193           HB2      LEU 193  17.244  -2.196  -2.333
 1368    HB3  LEU 193           HB3      LEU 193  18.934  -2.236  -2.788
 1369    HG   LEU 193           HG       LEU 193  18.116  -3.011  -0.005
 1370   HD11  LEU 193          HD11      LEU 193  16.692  -4.309  -1.502
 1371   HD12  LEU 193          HD12      LEU 193  18.107  -4.791  -2.437
 1372   HD13  LEU 193          HD13      LEU 193  17.932  -5.326  -0.767
 1373   HD21  LEU 193          HD21      LEU 193  20.490  -2.739  -0.479
 1374   HD22  LEU 193          HD22      LEU 193  20.099  -4.435  -0.193
 1375   HD23  LEU 193          HD23      LEU 193  20.357  -3.856  -1.838
 1376    H    ARG 194           H        ARG 194  19.339  -0.306   0.957
 1377    HA   ARG 194           HA       ARG 194  22.139  -0.136   0.063
 1378    HB2  ARG 194           HB2      ARG 194  20.706   1.589   2.079
 1379    HB3  ARG 194           HB3      ARG 194  22.456   1.468   2.013
 1380    HG2  ARG 194           HG2      ARG 194  20.642   2.501  -0.153
 1381    HG3  ARG 194           HG3      ARG 194  21.723   3.449   0.869
 1382    HD2  ARG 194           HD2      ARG 194  22.469   1.433  -1.234
 1383    HD3  ARG 194           HD3      ARG 194  22.776   3.168  -1.245
 1384    HE   ARG 194           HE       ARG 194  24.070   2.265   0.993
 1385   HH11  ARG 194          HH11      ARG 194  24.119   1.387  -2.401
 1386   HH12  ARG 194          HH12      ARG 194  25.814   0.966  -2.403
 1387   HH21  ARG 194          HH21      ARG 194  26.300   1.708   1.001
 1388   HH22  ARG 194          HH22      ARG 194  27.043   1.123  -0.462
 1389    H    ARG 195           H        ARG 195  23.678  -0.990   1.447
 1390    HA   ARG 195           HA       ARG 195  22.623  -2.919   3.351
 1391    HB2  ARG 195           HB2      ARG 195  24.363  -3.521   1.608
 1392    HB3  ARG 195           HB3      ARG 195  25.503  -2.539   2.524
 1393    HG2  ARG 195           HG2      ARG 195  25.205  -3.962   4.462
 1394    HG3  ARG 195           HG3      ARG 195  24.011  -4.924   3.591
 1395    HD2  ARG 195           HD2      ARG 195  25.752  -5.522   1.943
 1396    HD3  ARG 195           HD3      ARG 195  26.931  -4.627   2.905
 1397    HE   ARG 195           HE       ARG 195  25.568  -6.558   4.481
 1398   HH11  ARG 195          HH11      ARG 195  28.155  -6.181   2.152
 1399   HH12  ARG 195          HH12      ARG 195  28.963  -7.647   2.629
 1400   HH21  ARG 195          HH21      ARG 195  26.616  -8.459   5.129
 1401   HH22  ARG 195          HH22      ARG 195  28.099  -8.938   4.341
 1402    H    LYS 196           H        LYS 196  22.625  -2.581   5.465
 1403    HA   LYS 196           HA       LYS 196  24.085  -0.258   6.504
 1404    HB2  LYS 196           HB2      LYS 196  21.701  -0.213   6.961
 1405    HB3  LYS 196           HB3      LYS 196  21.767  -1.828   7.657
 1406    HG2  LYS 196           HG2      LYS 196  23.170  -0.984   9.476
 1407    HG3  LYS 196           HG3      LYS 196  23.096   0.634   8.776
 1408    HD2  LYS 196           HD2      LYS 196  20.686   0.681   9.091
 1409    HD3  LYS 196           HD3      LYS 196  20.721  -0.963   9.729
 1410    HE2  LYS 196           HE2      LYS 196  20.579   0.686  11.526
 1411    HE3  LYS 196           HE3      LYS 196  22.087  -0.220  11.604
 1412    HZ1  LYS 196           HZ1      LYS 196  21.817   2.483  10.398
 1413    HZ2  LYS 196           HZ2      LYS 196  23.257   1.624  10.646
 1414    HZ3  LYS 196           HZ3      LYS 196  22.365   2.184  11.974
 1415    H    PHE 197           H        PHE 197  23.389  -3.670   7.235
 1416    HA   PHE 197           HA       PHE 197  25.635  -3.734   9.104
 1417    HB2  PHE 197           HB2      PHE 197  23.803  -6.005   8.318
 1418    HB3  PHE 197           HB3      PHE 197  24.925  -5.971   9.670
 1419    HD1  PHE 197           HD1      PHE 197  24.371  -3.369  10.849
 1420    HD2  PHE 197           HD2      PHE 197  21.691  -6.263   9.262
 1421    HE1  PHE 197           HE1      PHE 197  22.610  -2.515  12.320
 1422    HE2  PHE 197           HE2      PHE 197  19.903  -5.409  10.726
 1423    HZ   PHE 197           HZ       PHE 197  20.297  -3.644  12.245
 1424    H    PHE 198           H        PHE 198  27.453  -5.030   8.762
 1425    HA   PHE 198           HA       PHE 198  27.784  -5.945   5.977
 1426    HB2  PHE 198           HB2      PHE 198  29.810  -4.437   7.647
 1427    HB3  PHE 198           HB3      PHE 198  30.107  -5.101   6.045
 1428    HD1  PHE 198           HD1      PHE 198  28.761  -4.198   4.102
 1429    HD2  PHE 198           HD2      PHE 198  28.877  -2.316   7.917
 1430    HE1  PHE 198           HE1      PHE 198  27.966  -2.101   3.089
 1431    HE2  PHE 198           HE2      PHE 198  28.079  -0.219   6.911
 1432    HZ   PHE 198           HZ       PHE 198  27.637  -0.106   4.488
 1433    H    TYR 199           H        TYR 199  27.204  -7.366   8.556
 1434    HA   TYR 199           HA       TYR 199  29.684  -8.578   9.300
 1435    HB2  TYR 199           HB2      TYR 199  28.249 -10.076  10.742
 1436    HB3  TYR 199           HB3      TYR 199  28.181  -8.358  11.086
 1437    HD1  TYR 199           HD1      TYR 199  26.353 -10.988   9.164
 1438    HD2  TYR 199           HD2      TYR 199  26.101  -7.370  11.382
 1439    HE1  TYR 199           HE1      TYR 199  23.901 -11.051   8.978
 1440    HE2  TYR 199           HE2      TYR 199  23.652  -7.427  11.210
 1441    HH   TYR 199           HH       TYR 199  21.936 -10.172  10.036
 1442    H    SER 200           H        SER 200  27.181  -9.374   7.031
 1443    HA   SER 200           HA       SER 200  27.016 -11.028   5.474
 1444    HB2  SER 200           HB2      SER 200  29.951 -11.457   6.085
 1445    HB3  SER 200           HB3      SER 200  29.098 -12.040   4.657
 1446    HG   SER 200           HG       SER 200  30.351  -9.819   4.799
 1447    H    ASP 201           H        ASP 201  26.326 -11.627   8.126
 1448    HA   ASP 201           HA       ASP 201  25.629 -13.313   9.442
 1449    HB2  ASP 201           HB2      ASP 201  24.991 -14.376   7.302
 1450    HB3  ASP 201           HB3      ASP 201  26.576 -15.129   7.225
 1451    H    GLN 202           H        GLN 202  28.634 -12.497   9.026
 1452    HA   GLN 202           HA       GLN 202  29.772 -14.637  10.686
 1453    HB2  GLN 202           HB2      GLN 202  30.972 -14.104   8.577
 1454    HB3  GLN 202           HB3      GLN 202  31.188 -12.454   9.137
 1455    HG2  GLN 202           HG2      GLN 202  33.218 -13.683   9.461
 1456    HG3  GLN 202           HG3      GLN 202  32.515 -13.296  11.031
 1457   HE21  GLN 202          HE21      GLN 202  33.168 -15.812   8.716
 1458   HE22  GLN 202          HE22      GLN 202  32.930 -17.150   9.802
  Start of MODEL    5
    1    H1   GLY  -5           H1       GLY  -5 -38.155 -10.383   8.306
    2    H2   GLY  -5           H2       GLY  -5 -36.615  -9.779   7.924
    3    H3   GLY  -5           H3       GLY  -5 -37.539  -9.040   9.136
    4    HA2  GLY  -5           HA2      GLY  -5 -37.377 -10.975  10.533
    5    HA3  GLY  -5           HA3      GLY  -5 -36.490 -11.812   9.265
    6    H    ILE  -4           H        ILE  -4 -34.471 -12.051  10.055
    7    HA   ILE  -4           HA       ILE  -4 -33.135  -9.692  11.186
    8    HB   ILE  -4           HB       ILE  -4 -31.976 -12.476  10.913
    9   HG12  ILE  -4          HG12      ILE  -4 -33.414 -11.271  13.293
   10   HG13  ILE  -4          HG13      ILE  -4 -34.055 -12.543  12.258
   11   HG21  ILE  -4          HG21      ILE  -4 -30.355 -10.685  11.259
   12   HG22  ILE  -4          HG22      ILE  -4 -31.247 -10.136  12.678
   13   HG23  ILE  -4          HG23      ILE  -4 -30.461 -11.715  12.688
   14   HD11  ILE  -4          HD11      ILE  -4 -33.197 -13.446  14.337
   15   HD12  ILE  -4          HD12      ILE  -4 -32.250 -14.023  12.965
   16   HD13  ILE  -4          HD13      ILE  -4 -31.612 -12.747  14.001
   17    H    ASP  -3           H        ASP  -3 -33.317  -8.694   9.050
   18    HA   ASP  -3           HA       ASP  -3 -31.878  -9.944   6.860
   19    HB2  ASP  -3           HB2      ASP  -3 -33.458  -7.366   6.997
   20    HB3  ASP  -3           HB3      ASP  -3 -32.733  -8.020   5.533
   21    HA   PRO  -2           HA       PRO  -2 -28.202  -7.448   7.472
   22    HB2  PRO  -2           HB2      PRO  -2 -27.509  -8.285   4.750
   23    HB3  PRO  -2           HB3      PRO  -2 -26.680  -8.635   6.269
   24    HG2  PRO  -2           HG2      PRO  -2 -28.014 -10.530   4.882
   25    HG3  PRO  -2           HG3      PRO  -2 -27.901 -10.546   6.652
   26    HD2  PRO  -2           HD2      PRO  -2 -30.166  -9.662   4.903
   27    HD3  PRO  -2           HD3      PRO  -2 -30.206 -10.593   6.417
   28    H    PHE  -1           H        PHE  -1 -27.148  -5.676   6.274
   29    HA   PHE  -1           HA       PHE  -1 -27.582  -3.495   5.807
   30    HB2  PHE  -1           HB2      PHE  -1 -27.744  -3.251   3.293
   31    HB3  PHE  -1           HB3      PHE  -1 -26.365  -4.101   3.941
   32    HD1  PHE  -1           HD1      PHE  -1 -26.118  -6.482   3.627
   33    HD2  PHE  -1           HD2      PHE  -1 -29.398  -4.372   1.938
   34    HE1  PHE  -1           HE1      PHE  -1 -26.559  -8.384   2.126
   35    HE2  PHE  -1           HE2      PHE  -1 -29.853  -6.269   0.436
   36    HZ   PHE  -1           HZ       PHE  -1 -28.431  -8.279   0.531
   37    H    THR   0           H        THR   0 -29.566  -3.436   7.084
   38    HA   THR   0           HA       THR   0 -32.079  -3.302   5.691
   39    HB   THR   0           HB       THR   0 -32.768  -2.240   7.965
   40    HG1  THR   0           HG1      THR   0 -31.279  -2.275   9.537
   41   HG21  THR   0          HG21      THR   0 -33.306  -4.541   7.317
   42   HG22  THR   0          HG22      THR   0 -32.866  -4.455   9.022
   43   HG23  THR   0          HG23      THR   0 -31.707  -5.069   7.844
   44    H    MET   1           H        MET   1 -32.697  -0.810   7.460
   45    HA   MET   1           HA       MET   1 -32.044   1.111   5.396
   46    HB2  MET   1           HB2      MET   1 -34.293   1.021   6.524
   47    HB3  MET   1           HB3      MET   1 -33.516   1.592   7.992
   48    HG2  MET   1           HG2      MET   1 -34.642   3.397   6.815
   49    HG3  MET   1           HG3      MET   1 -32.904   3.667   6.890
   50    HE1  MET   1           HE1      MET   1 -31.712   3.640   3.308
   51    HE2  MET   1           HE2      MET   1 -31.572   4.421   4.883
   52    HE3  MET   1           HE3      MET   1 -31.322   2.682   4.737
   53    H    VAL   2           H        VAL   2 -29.868   0.102   6.533
   54    HA   VAL   2           HA       VAL   2 -28.539   2.501   7.423
   55    HB   VAL   2           HB       VAL   2 -27.173   1.138   9.106
   56   HG11  VAL   2          HG11      VAL   2 -30.049   1.755   9.763
   57   HG12  VAL   2          HG12      VAL   2 -28.748   1.547  10.935
   58   HG13  VAL   2          HG13      VAL   2 -28.704   2.894   9.797
   59   HG21  VAL   2          HG21      VAL   2 -28.299  -0.752  10.169
   60   HG22  VAL   2          HG22      VAL   2 -29.607  -0.642   8.990
   61   HG23  VAL   2          HG23      VAL   2 -27.978  -1.073   8.462
   62    H    ALA   3           H        ALA   3 -27.771   2.389   5.298
   63    HA   ALA   3           HA       ALA   3 -25.617   0.425   4.996
   64    HB1  ALA   3           HB1      ALA   3 -26.069   0.330   2.570
   65    HB2  ALA   3           HB2      ALA   3 -27.402  -0.310   3.531
   66    HB3  ALA   3           HB3      ALA   3 -27.521   1.301   2.821
   67    H    LEU   4           H        LEU   4 -23.876   1.167   3.732
   68    HA   LEU   4           HA       LEU   4 -23.606   4.088   3.946
   69    HB2  LEU   4           HB2      LEU   4 -21.763   1.817   4.495
   70    HB3  LEU   4           HB3      LEU   4 -21.064   3.303   3.883
   71    HG   LEU   4           HG       LEU   4 -21.889   4.536   5.805
   72   HD11  LEU   4          HD11      LEU   4 -23.036   3.482   7.642
   73   HD12  LEU   4          HD12      LEU   4 -23.980   3.322   6.161
   74   HD13  LEU   4          HD13      LEU   4 -23.062   1.945   6.773
   75   HD21  LEU   4          HD21      LEU   4 -20.542   3.542   7.519
   76   HD22  LEU   4          HD22      LEU   4 -20.595   1.975   6.700
   77   HD23  LEU   4          HD23      LEU   4 -19.746   3.334   5.958
   78    H    SER   5           H        SER   5 -23.197   5.181   2.156
   79    HA   SER   5           HA       SER   5 -22.900   3.657  -0.326
   80    HB2  SER   5           HB2      SER   5 -23.641   6.564   0.090
   81    HB3  SER   5           HB3      SER   5 -23.503   5.777  -1.470
   82    HG   SER   5           HG       SER   5 -25.366   5.273   0.599
   83    H    LEU   6           H        LEU   6 -20.828   3.223  -0.645
   84    HA   LEU   6           HA       LEU   6 -18.862   5.330  -0.046
   85    HB2  LEU   6           HB2      LEU   6 -18.384   2.350  -0.208
   86    HB3  LEU   6           HB3      LEU   6 -17.255   3.574   0.357
   87    HG   LEU   6           HG       LEU   6 -19.829   2.791   1.733
   88   HD11  LEU   6          HD11      LEU   6 -16.971   2.269   2.525
   89   HD12  LEU   6          HD12      LEU   6 -18.416   1.820   3.436
   90   HD13  LEU   6          HD13      LEU   6 -18.091   1.072   1.872
   91   HD21  LEU   6          HD21      LEU   6 -19.029   4.213   3.559
   92   HD22  LEU   6          HD22      LEU   6 -17.669   4.723   2.561
   93   HD23  LEU   6          HD23      LEU   6 -19.318   5.134   2.084
   94    H    LYS   7           H        LYS   7 -17.806   6.166  -1.722
   95    HA   LYS   7           HA       LYS   7 -18.286   5.071  -4.342
   96    HB2  LYS   7           HB2      LYS   7 -16.640   7.443  -3.475
   97    HB3  LYS   7           HB3      LYS   7 -16.902   6.970  -5.149
   98    HG2  LYS   7           HG2      LYS   7 -19.435   7.096  -4.401
   99    HG3  LYS   7           HG3      LYS   7 -18.761   8.216  -3.212
  100    HD2  LYS   7           HD2      LYS   7 -19.370   9.523  -5.063
  101    HD3  LYS   7           HD3      LYS   7 -17.620   9.368  -5.158
  102    HE2  LYS   7           HE2      LYS   7 -17.966   7.490  -6.763
  103    HE3  LYS   7           HE3      LYS   7 -19.688   7.867  -6.751
  104    HZ1  LYS   7           HZ1      LYS   7 -17.471   9.601  -7.683
  105    HZ2  LYS   7           HZ2      LYS   7 -19.056  10.161  -7.469
  106    HZ3  LYS   7           HZ3      LYS   7 -18.736   8.950  -8.613
  107    H    ILE   8           H        ILE   8 -17.095   3.716  -5.355
  108    HA   ILE   8           HA       ILE   8 -14.583   2.894  -4.087
  109    HB   ILE   8           HB       ILE   8 -16.252   1.429  -6.137
  110   HG12  ILE   8          HG12      ILE   8 -17.392   1.596  -3.976
  111   HG13  ILE   8          HG13      ILE   8 -16.869  -0.057  -4.276
  112   HG21  ILE   8          HG21      ILE   8 -13.848   0.525  -4.560
  113   HG22  ILE   8          HG22      ILE   8 -14.826  -0.495  -5.615
  114   HG23  ILE   8          HG23      ILE   8 -13.901   0.846  -6.293
  115   HD11  ILE   8          HD11      ILE   8 -14.964   0.283  -2.786
  116   HD12  ILE   8          HD12      ILE   8 -15.500   1.935  -2.483
  117   HD13  ILE   8          HD13      ILE   8 -16.499   0.576  -1.966
  118    H    SER   9           H        SER   9 -12.997   4.129  -4.889
  119    HA   SER   9           HA       SER   9 -12.817   4.585  -7.755
  120    HB2  SER   9           HB2      SER   9 -10.698   5.838  -7.037
  121    HB3  SER   9           HB3      SER   9 -12.229   6.487  -6.459
  122    HG   SER   9           HG       SER   9 -10.291   5.009  -5.044
  123    H    ILE  10           H        ILE  10 -11.958   3.029  -8.987
  124    HA   ILE  10           HA       ILE  10  -9.877   1.320  -7.798
  125    HB   ILE  10           HB       ILE  10 -11.554   0.720 -10.246
  126   HG12  ILE  10          HG12      ILE  10 -11.862  -0.351  -7.428
  127   HG13  ILE  10          HG13      ILE  10 -12.908   0.864  -8.155
  128   HG21  ILE  10          HG21      ILE  10  -9.403  -0.426 -10.206
  129   HG22  ILE  10          HG22      ILE  10  -9.737  -1.023  -8.580
  130   HG23  ILE  10          HG23      ILE  10 -10.721  -1.568  -9.938
  131   HD11  ILE  10          HD11      ILE  10 -13.936  -1.338  -8.193
  132   HD12  ILE  10          HD12      ILE  10 -13.627  -0.753  -9.830
  133   HD13  ILE  10          HD13      ILE  10 -12.569  -1.969  -9.114
  134    H    GLY  11           H        GLY  11  -8.198   2.776  -8.183
  135    HA2  GLY  11           HA2      GLY  11  -6.388   3.495  -9.444
  136    HA3  GLY  11           HA3      GLY  11  -7.137   2.781 -10.867
  137    H    ASN  12           H        ASN  12  -8.682   3.974 -12.037
  138    HA   ASN  12           HA       ASN  12  -8.773   6.849 -11.379
  139    HB2  ASN  12           HB2      ASN  12  -7.387   6.591 -13.331
  140    HB3  ASN  12           HB3      ASN  12  -8.562   5.524 -14.090
  141   HD21  ASN  12          HD21      ASN  12 -10.310   6.377 -15.130
  142   HD22  ASN  12          HD22      ASN  12 -10.511   8.076 -15.422
  143    H    VAL  13           H        VAL  13 -10.449   4.056 -12.679
  144    HA   VAL  13           HA       VAL  13 -12.902   5.362 -13.256
  145    HB   VAL  13           HB       VAL  13 -12.221   3.167 -14.217
  146   HG11  VAL  13          HG11      VAL  13 -11.268   2.119 -12.266
  147   HG12  VAL  13          HG12      VAL  13 -12.836   2.120 -11.459
  148   HG13  VAL  13          HG13      VAL  13 -12.582   1.122 -12.892
  149   HG21  VAL  13          HG21      VAL  13 -14.435   2.107 -14.097
  150   HG22  VAL  13          HG22      VAL  13 -14.856   3.169 -12.754
  151   HG23  VAL  13          HG23      VAL  13 -14.539   3.850 -14.350
  152    H    VAL  14           H        VAL  14 -14.918   5.136 -12.086
  153    HA   VAL  14           HA       VAL  14 -14.575   4.624  -9.221
  154    HB   VAL  14           HB       VAL  14 -14.466   7.074  -9.545
  155   HG11  VAL  14          HG11      VAL  14 -16.456   8.324 -10.207
  156   HG12  VAL  14          HG12      VAL  14 -15.877   7.292 -11.516
  157   HG13  VAL  14          HG13      VAL  14 -17.288   6.811 -10.572
  158   HG21  VAL  14          HG21      VAL  14 -16.928   6.089  -8.110
  159   HG22  VAL  14          HG22      VAL  14 -15.295   6.167  -7.454
  160   HG23  VAL  14          HG23      VAL  14 -16.156   7.654  -7.855
  161    H    LYS  15           H        LYS  15 -16.018   3.293  -8.454
  162    HA   LYS  15           HA       LYS  15 -18.602   3.030  -9.841
  163    HB2  LYS  15           HB2      LYS  15 -16.864   0.847  -8.674
  164    HB3  LYS  15           HB3      LYS  15 -18.536   0.606  -9.169
  165    HG2  LYS  15           HG2      LYS  15 -16.315   1.530 -10.985
  166    HG3  LYS  15           HG3      LYS  15 -16.927  -0.123 -10.878
  167    HD2  LYS  15           HD2      LYS  15 -19.035   0.494 -11.736
  168    HD3  LYS  15           HD3      LYS  15 -18.717   2.212 -11.494
  169    HE2  LYS  15           HE2      LYS  15 -18.580   1.560 -13.858
  170    HE3  LYS  15           HE3      LYS  15 -17.051   2.185 -13.247
  171    HZ1  LYS  15           HZ1      LYS  15 -17.650  -0.715 -13.400
  172    HZ2  LYS  15           HZ2      LYS  15 -16.138   0.029 -13.170
  173    HZ3  LYS  15           HZ3      LYS  15 -16.920   0.143 -14.667
  174    H    THR  16           H        THR  16 -20.400   2.588  -8.507
  175    HA   THR  16           HA       THR  16 -19.922   3.558  -5.770
  176    HB   THR  16           HB       THR  16 -22.457   3.725  -7.412
  177    HG1  THR  16           HG1      THR  16 -20.602   5.087  -8.057
  178   HG21  THR  16          HG21      THR  16 -23.239   5.236  -5.645
  179   HG22  THR  16          HG22      THR  16 -21.749   4.958  -4.742
  180   HG23  THR  16          HG23      THR  16 -22.887   3.634  -4.994
  181    H    MET  17           H        MET  17 -20.205   2.184  -4.150
  182    HA   MET  17           HA       MET  17 -22.113  -0.016  -4.461
  183    HB2  MET  17           HB2      MET  17 -19.202  -0.205  -3.928
  184    HB3  MET  17           HB3      MET  17 -20.230  -1.193  -2.901
  185    HG2  MET  17           HG2      MET  17 -20.481  -1.247  -5.883
  186    HG3  MET  17           HG3      MET  17 -19.288  -2.228  -5.038
  187    HE1  MET  17           HE1      MET  17 -21.470  -4.656  -2.914
  188    HE2  MET  17           HE2      MET  17 -19.847  -4.104  -3.325
  189    HE3  MET  17           HE3      MET  17 -20.894  -3.092  -2.328
  190    H    GLN  18           H        GLN  18 -23.142  -0.618  -2.567
  191    HA   GLN  18           HA       GLN  18 -22.581   1.123  -0.272
  192    HB2  GLN  18           HB2      GLN  18 -25.119   0.042  -1.390
  193    HB3  GLN  18           HB3      GLN  18 -25.012   0.292   0.352
  194    HG2  GLN  18           HG2      GLN  18 -24.711   2.572   0.140
  195    HG3  GLN  18           HG3      GLN  18 -24.191   2.446  -1.540
  196   HE21  GLN  18          HE21      GLN  18 -25.683   2.330  -3.145
  197   HE22  GLN  18          HE22      GLN  18 -27.350   2.678  -2.894
  198    H    PHE  19           H        PHE  19 -22.379   0.288   1.738
  199    HA   PHE  19           HA       PHE  19 -22.193  -2.628   1.957
  200    HB2  PHE  19           HB2      PHE  19 -20.183  -0.572   2.928
  201    HB3  PHE  19           HB3      PHE  19 -20.146  -2.280   3.344
  202    HD1  PHE  19           HD1      PHE  19 -19.628   0.188   0.706
  203    HD2  PHE  19           HD2      PHE  19 -19.390  -3.925   1.760
  204    HE1  PHE  19           HE1      PHE  19 -18.267  -0.249  -1.305
  205    HE2  PHE  19           HE2      PHE  19 -18.032  -4.371  -0.242
  206    HZ   PHE  19           HZ       PHE  19 -17.456  -2.553  -1.768
  207    H    GLU  20           H        GLU  20 -22.384  -3.321   4.208
  208    HA   GLU  20           HA       GLU  20 -24.223  -1.772   5.734
  209    HB2  GLU  20           HB2      GLU  20 -22.537  -4.114   6.635
  210    HB3  GLU  20           HB3      GLU  20 -23.993  -3.510   7.414
  211    HG2  GLU  20           HG2      GLU  20 -25.304  -4.137   5.451
  212    HG3  GLU  20           HG3      GLU  20 -23.839  -4.750   4.678
  213    HA   PRO  21           HA       PRO  21 -21.618   0.916   8.126
  214    HB2  PRO  21           HB2      PRO  21 -22.675  -0.157  10.620
  215    HB3  PRO  21           HB3      PRO  21 -22.850   1.459   9.936
  216    HG2  PRO  21           HG2      PRO  21 -24.779  -0.633   9.992
  217    HG3  PRO  21           HG3      PRO  21 -24.939   0.965   9.249
  218    HD2  PRO  21           HD2      PRO  21 -24.765  -1.524   7.932
  219    HD3  PRO  21           HD3      PRO  21 -24.716   0.088   7.195
  220    H    SER  22           H        SER  22 -22.050  -2.361   9.471
  221    HA   SER  22           HA       SER  22 -19.392  -2.395  10.524
  222    HB2  SER  22           HB2      SER  22 -21.268  -3.750  11.479
  223    HB3  SER  22           HB3      SER  22 -21.232  -4.748  10.026
  224    HG   SER  22           HG       SER  22 -19.295  -4.498  12.068
  225    H    THR  23           H        THR  23 -20.875  -4.465   8.019
  226    HA   THR  23           HA       THR  23 -19.975  -5.836   6.490
  227    HB   THR  23           HB       THR  23 -18.449  -3.308   5.884
  228    HG1  THR  23           HG1      THR  23 -20.822  -4.502   4.827
  229   HG21  THR  23          HG21      THR  23 -17.326  -5.225   4.886
  230   HG22  THR  23          HG22      THR  23 -18.136  -4.263   3.649
  231   HG23  THR  23          HG23      THR  23 -18.856  -5.774   4.204
  232    H    MET  24           H        MET  24 -17.102  -3.974   7.419
  233    HA   MET  24           HA       MET  24 -15.060  -4.587   8.200
  234    HB2  MET  24           HB2      MET  24 -16.484  -6.635   9.205
  235    HB3  MET  24           HB3      MET  24 -15.489  -7.516   8.056
  236    HG2  MET  24           HG2      MET  24 -13.522  -6.945   9.142
  237    HG3  MET  24           HG3      MET  24 -14.279  -5.605  10.009
  238    HE1  MET  24           HE1      MET  24 -13.588  -7.665  13.116
  239    HE2  MET  24           HE2      MET  24 -12.560  -7.135  11.781
  240    HE3  MET  24           HE3      MET  24 -13.781  -6.044  12.442
  241    H    VAL  25           H        VAL  25 -13.287  -4.701   7.081
  242    HA   VAL  25           HA       VAL  25 -13.197  -4.453   4.424
  243    HB   VAL  25           HB       VAL  25 -11.011  -5.611   6.130
  244   HG11  VAL  25          HG11      VAL  25 -10.839  -4.421   3.363
  245   HG12  VAL  25          HG12      VAL  25  -9.466  -4.852   4.382
  246   HG13  VAL  25          HG13      VAL  25 -10.551  -6.108   3.788
  247   HG21  VAL  25          HG21      VAL  25 -11.638  -2.815   5.207
  248   HG22  VAL  25          HG22      VAL  25 -11.815  -3.442   6.847
  249   HG23  VAL  25          HG23      VAL  25 -10.211  -3.289   6.129
  250    H    TYR  26           H        TYR  26 -12.498  -7.594   5.983
  251    HA   TYR  26           HA       TYR  26 -11.986  -8.953   3.598
  252    HB2  TYR  26           HB2      TYR  26 -12.357 -11.053   4.842
  253    HB3  TYR  26           HB3      TYR  26 -11.292  -9.935   5.679
  254    HD1  TYR  26           HD1      TYR  26 -14.757 -11.277   5.635
  255    HD2  TYR  26           HD2      TYR  26 -11.774  -9.223   7.863
  256    HE1  TYR  26           HE1      TYR  26 -16.125 -11.504   7.666
  257    HE2  TYR  26           HE2      TYR  26 -13.133  -9.440   9.893
  258    HH   TYR  26           HH       TYR  26 -15.489  -9.748  10.504
  259    H    ASP  27           H        ASP  27 -15.019  -8.230   5.154
  260    HA   ASP  27           HA       ASP  27 -16.568 -10.024   3.515
  261    HB2  ASP  27           HB2      ASP  27 -17.341  -9.423   5.762
  262    HB3  ASP  27           HB3      ASP  27 -17.428  -7.730   5.294
  263    H    ALA  28           H        ALA  28 -15.911  -6.541   3.621
  264    HA   ALA  28           HA       ALA  28 -17.418  -5.742   1.429
  265    HB1  ALA  28           HB1      ALA  28 -15.909  -3.839   1.268
  266    HB2  ALA  28           HB2      ALA  28 -16.290  -4.188   2.955
  267    HB3  ALA  28           HB3      ALA  28 -14.731  -4.669   2.283
  268    H    CYS  29           H        CYS  29 -14.055  -6.835   1.534
  269    HA   CYS  29           HA       CYS  29 -13.401  -6.587  -1.139
  270    HB2  CYS  29           HB2      CYS  29 -11.763  -7.073   0.606
  271    HB3  CYS  29           HB3      CYS  29 -12.451  -8.677   0.830
  272    HG   CYS  29           HG       CYS  29 -10.784  -7.563  -1.950
  273    H    ARG  30           H        ARG  30 -15.312  -9.101   0.394
  274    HA   ARG  30           HA       ARG  30 -15.017 -10.897  -1.839
  275    HB2  ARG  30           HB2      ARG  30 -16.353 -12.443  -0.694
  276    HB3  ARG  30           HB3      ARG  30 -15.400 -11.647   0.545
  277    HG2  ARG  30           HG2      ARG  30 -17.330 -10.254   1.133
  278    HG3  ARG  30           HG3      ARG  30 -18.276 -11.069  -0.118
  279    HD2  ARG  30           HD2      ARG  30 -18.019 -13.189   1.003
  280    HD3  ARG  30           HD3      ARG  30 -16.969 -12.456   2.214
  281    HE   ARG  30           HE       ARG  30 -18.979 -11.072   2.811
  282   HH11  ARG  30          HH11      ARG  30 -19.330 -14.220   1.310
  283   HH12  ARG  30          HH12      ARG  30 -20.840 -14.570   2.102
  284   HH21  ARG  30          HH21      ARG  30 -20.962 -11.506   3.822
  285   HH22  ARG  30          HH22      ARG  30 -21.774 -13.019   3.536
  286    H    MET  31           H        MET  31 -17.464  -8.631  -0.706
  287    HA   MET  31           HA       MET  31 -19.379  -9.398  -2.681
  288    HB2  MET  31           HB2      MET  31 -19.254  -6.851  -1.061
  289    HB3  MET  31           HB3      MET  31 -20.643  -7.466  -1.942
  290    HG2  MET  31           HG2      MET  31 -20.778  -9.383  -0.497
  291    HG3  MET  31           HG3      MET  31 -19.320  -8.880   0.351
  292    HE1  MET  31           HE1      MET  31 -19.078  -6.931   1.851
  293    HE2  MET  31           HE2      MET  31 -19.659  -5.757   0.665
  294    HE3  MET  31           HE3      MET  31 -20.341  -5.775   2.295
  295    H    ILE  32           H        ILE  32 -17.126  -6.666  -2.363
  296    HA   ILE  32           HA       ILE  32 -17.937  -5.293  -4.653
  297    HB   ILE  32           HB       ILE  32 -16.470  -4.265  -3.002
  298   HG12  ILE  32          HG12      ILE  32 -15.240  -4.400  -5.761
  299   HG13  ILE  32          HG13      ILE  32 -16.572  -3.355  -5.277
  300   HG21  ILE  32          HG21      ILE  32 -14.304  -6.065  -4.078
  301   HG22  ILE  32          HG22      ILE  32 -14.086  -4.760  -2.910
  302   HG23  ILE  32          HG23      ILE  32 -15.046  -6.179  -2.482
  303   HD11  ILE  32          HD11      ILE  32 -15.099  -2.217  -3.709
  304   HD12  ILE  32          HD12      ILE  32 -13.767  -3.258  -4.211
  305   HD13  ILE  32          HD13      ILE  32 -14.490  -2.134  -5.362
  306    H    ARG  33           H        ARG  33 -15.373  -7.740  -4.327
  307    HA   ARG  33           HA       ARG  33 -14.704  -7.879  -7.049
  308    HB2  ARG  33           HB2      ARG  33 -14.494  -9.877  -4.811
  309    HB3  ARG  33           HB3      ARG  33 -13.958 -10.254  -6.443
  310    HG2  ARG  33           HG2      ARG  33 -12.429  -8.317  -6.348
  311    HG3  ARG  33           HG3      ARG  33 -12.919  -8.054  -4.673
  312    HD2  ARG  33           HD2      ARG  33 -11.746 -10.637  -5.678
  313    HD3  ARG  33           HD3      ARG  33 -10.780  -9.336  -4.987
  314    HE   ARG  33           HE       ARG  33 -12.227  -9.646  -2.946
  315   HH11  ARG  33          HH11      ARG  33 -11.721 -12.267  -5.207
  316   HH12  ARG  33          HH12      ARG  33 -11.749 -13.500  -3.985
  317   HH21  ARG  33          HH21      ARG  33 -12.303 -11.268  -1.334
  318   HH22  ARG  33          HH22      ARG  33 -12.133 -12.935  -1.784
  319    H    GLU  34           H        GLU  34 -17.351  -9.150  -5.275
  320    HA   GLU  34           HA       GLU  34 -18.103 -11.171  -7.174
  321    HB2  GLU  34           HB2      GLU  34 -18.717 -11.161  -4.710
  322    HB3  GLU  34           HB3      GLU  34 -19.880  -9.899  -5.089
  323    HG2  GLU  34           HG2      GLU  34 -21.014 -12.001  -5.001
  324    HG3  GLU  34           HG3      GLU  34 -20.980 -11.444  -6.675
  325    H    ARG  35           H        ARG  35 -19.073  -7.844  -6.474
  326    HA   ARG  35           HA       ARG  35 -21.129  -7.832  -8.509
  327    HB2  ARG  35           HB2      ARG  35 -20.002  -5.292  -7.418
  328    HB3  ARG  35           HB3      ARG  35 -21.664  -5.695  -7.802
  329    HG2  ARG  35           HG2      ARG  35 -20.165  -6.740  -5.418
  330    HG3  ARG  35           HG3      ARG  35 -21.227  -5.335  -5.400
  331    HD2  ARG  35           HD2      ARG  35 -22.011  -8.173  -6.042
  332    HD3  ARG  35           HD3      ARG  35 -22.367  -7.284  -4.557
  333    HE   ARG  35           HE       ARG  35 -23.359  -6.128  -7.047
  334   HH11  ARG  35          HH11      ARG  35 -24.044  -8.056  -4.199
  335   HH12  ARG  35          HH12      ARG  35 -25.765  -7.838  -4.316
  336   HH21  ARG  35          HH21      ARG  35 -25.626  -5.863  -7.214
  337   HH22  ARG  35          HH22      ARG  35 -26.662  -6.598  -6.026
  338    H    ILE  36           H        ILE  36 -17.967  -6.294  -8.045
  339    HA   ILE  36           HA       ILE  36 -18.091  -5.275 -10.794
  340    HB   ILE  36           HB       ILE  36 -16.232  -4.387  -8.585
  341   HG12  ILE  36          HG12      ILE  36 -18.839  -3.113  -9.447
  342   HG13  ILE  36          HG13      ILE  36 -18.631  -4.060  -7.978
  343   HG21  ILE  36          HG21      ILE  36 -15.985  -2.380  -9.975
  344   HG22  ILE  36          HG22      ILE  36 -15.486  -3.839 -10.833
  345   HG23  ILE  36          HG23      ILE  36 -17.047  -3.098 -11.187
  346   HD11  ILE  36          HD11      ILE  36 -17.022  -2.427  -7.152
  347   HD12  ILE  36          HD12      ILE  36 -17.224  -1.481  -8.627
  348   HD13  ILE  36          HD13      ILE  36 -18.577  -1.679  -7.515
  349    HA   PRO  37           HA       PRO  37 -14.836  -8.346 -11.539
  350    HB2  PRO  37           HB2      PRO  37 -14.954  -8.227 -14.234
  351    HB3  PRO  37           HB3      PRO  37 -16.138  -9.127 -13.279
  352    HG2  PRO  37           HG2      PRO  37 -16.370  -6.412 -14.512
  353    HG3  PRO  37           HG3      PRO  37 -17.567  -7.717 -14.443
  354    HD2  PRO  37           HD2      PRO  37 -17.584  -5.562 -12.762
  355    HD3  PRO  37           HD3      PRO  37 -18.243  -7.151 -12.327
  356    H    GLU  38           H        GLU  38 -15.075  -5.064 -12.093
  357    HA   GLU  38           HA       GLU  38 -12.541  -4.696 -13.434
  358    HB2  GLU  38           HB2      GLU  38 -14.517  -3.300 -13.924
  359    HB3  GLU  38           HB3      GLU  38 -14.519  -2.730 -12.267
  360    HG2  GLU  38           HG2      GLU  38 -12.426  -1.601 -12.601
  361    HG3  GLU  38           HG3      GLU  38 -12.295  -2.266 -14.232
  362    H    ALA  39           H        ALA  39 -13.608  -5.223 -10.308
  363    HA   ALA  39           HA       ALA  39 -11.838  -3.467  -8.898
  364    HB1  ALA  39           HB1      ALA  39 -12.584  -4.643  -6.902
  365    HB2  ALA  39           HB2      ALA  39 -13.956  -4.210  -7.923
  366    HB3  ALA  39           HB3      ALA  39 -13.362  -5.869  -7.903
  367    H    LEU  40           H        LEU  40 -11.803  -6.905  -9.758
  368    HA   LEU  40           HA       LEU  40  -9.255  -7.212  -8.386
  369    HB2  LEU  40           HB2      LEU  40  -9.540  -9.669  -9.077
  370    HB3  LEU  40           HB3      LEU  40 -10.553  -9.026  -7.811
  371    HG   LEU  40           HG       LEU  40 -11.680 -10.599  -9.406
  372   HD11  LEU  40          HD11      LEU  40 -12.982  -9.088  -8.032
  373   HD12  LEU  40          HD12      LEU  40 -12.841  -7.828  -9.258
  374   HD13  LEU  40          HD13      LEU  40 -13.730  -9.307  -9.613
  375   HD21  LEU  40          HD21      LEU  40 -12.405  -9.718 -11.576
  376   HD22  LEU  40          HD22      LEU  40 -11.368  -8.312 -11.334
  377   HD23  LEU  40          HD23      LEU  40 -10.656  -9.919 -11.478
  378    H    ALA  41           H        ALA  41  -8.827  -5.563 -10.365
  379    HA   ALA  41           HA       ALA  41  -8.316  -6.664 -12.904
  380    HB1  ALA  41           HB1      ALA  41  -7.066  -4.625 -13.349
  381    HB2  ALA  41           HB2      ALA  41  -8.583  -4.267 -12.523
  382    HB3  ALA  41           HB3      ALA  41  -7.065  -4.237 -11.628
  383    H    GLY  42           H        GLY  42  -6.487  -6.719  -9.969
  384    HA2  GLY  42           HA2      GLY  42  -4.342  -8.147 -11.408
  385    HA3  GLY  42           HA3      GLY  42  -4.025  -7.115 -10.017
  386    HA   PRO  43           HA       PRO  43  -4.642 -11.251  -8.151
  387    HB2  PRO  43           HB2      PRO  43  -2.739 -11.007  -6.254
  388    HB3  PRO  43           HB3      PRO  43  -2.366 -11.493  -7.910
  389    HG2  PRO  43           HG2      PRO  43  -2.050  -8.824  -6.607
  390    HG3  PRO  43           HG3      PRO  43  -0.964  -9.657  -7.733
  391    HD2  PRO  43           HD2      PRO  43  -2.701  -7.665  -8.468
  392    HD3  PRO  43           HD3      PRO  43  -2.116  -8.927  -9.570
  393    HA   PRO  44           HA       PRO  44  -7.482  -8.928  -5.497
  394    HB2  PRO  44           HB2      PRO  44  -8.830 -11.187  -4.637
  395    HB3  PRO  44           HB3      PRO  44  -9.210 -10.273  -6.101
  396    HG2  PRO  44           HG2      PRO  44  -7.619 -12.783  -5.789
  397    HG3  PRO  44           HG3      PRO  44  -8.777 -12.336  -7.055
  398    HD2  PRO  44           HD2      PRO  44  -6.135 -12.221  -7.476
  399    HD3  PRO  44           HD3      PRO  44  -7.236 -11.014  -8.173
  400    H    ASN  45           H        ASN  45  -5.491 -11.635  -4.572
  401    HA   ASN  45           HA       ASN  45  -5.897 -11.650  -1.799
  402    HB2  ASN  45           HB2      ASN  45  -3.324 -12.219  -3.293
  403    HB3  ASN  45           HB3      ASN  45  -3.695 -12.720  -1.647
  404   HD21  ASN  45          HD21      ASN  45  -3.030 -14.222  -4.095
  405   HD22  ASN  45          HD22      ASN  45  -4.306 -15.384  -4.279
  406    H    ASP  46           H        ASP  46  -4.077  -9.549  -3.881
  407    HA   ASP  46           HA       ASP  46  -2.838  -8.233  -1.566
  408    HB2  ASP  46           HB2      ASP  46  -2.143  -8.055  -4.509
  409    HB3  ASP  46           HB3      ASP  46  -1.294  -7.221  -3.209
  410    H    PHE  47           H        PHE  47  -5.637  -7.955  -2.839
  411    HA   PHE  47           HA       PHE  47  -5.534  -5.065  -3.349
  412    HB2  PHE  47           HB2      PHE  47  -7.410  -7.223  -4.218
  413    HB3  PHE  47           HB3      PHE  47  -8.037  -5.587  -4.039
  414    HD1  PHE  47           HD1      PHE  47  -4.836  -6.980  -5.369
  415    HD2  PHE  47           HD2      PHE  47  -8.274  -4.583  -6.093
  416    HE1  PHE  47           HE1      PHE  47  -3.978  -6.429  -7.603
  417    HE2  PHE  47           HE2      PHE  47  -7.416  -4.023  -8.327
  418    HZ   PHE  47           HZ       PHE  47  -5.260  -4.905  -9.073
  419    H    GLY  48           H        GLY  48  -6.076  -3.773  -1.789
  420    HA2  GLY  48           HA2      GLY  48  -7.847  -4.792   0.349
  421    HA3  GLY  48           HA3      GLY  48  -6.403  -3.856   0.701
  422    H    LEU  49           H        LEU  49  -8.384  -2.779   1.854
  423    HA   LEU  49           HA       LEU  49  -9.745  -0.927   0.043
  424    HB2  LEU  49           HB2      LEU  49 -10.275  -1.527   2.954
  425    HB3  LEU  49           HB3      LEU  49 -11.233  -0.471   1.935
  426    HG   LEU  49           HG       LEU  49 -10.930  -3.458   1.601
  427   HD11  LEU  49          HD11      LEU  49 -13.292  -3.515   2.221
  428   HD12  LEU  49          HD12      LEU  49 -12.306  -2.827   3.512
  429   HD13  LEU  49          HD13      LEU  49 -13.269  -1.770   2.478
  430   HD21  LEU  49          HD21      LEU  49 -12.635  -3.229  -0.138
  431   HD22  LEU  49          HD22      LEU  49 -12.589  -1.475   0.048
  432   HD23  LEU  49          HD23      LEU  49 -11.171  -2.336  -0.551
  433    H    PHE  50           H        PHE  50  -8.542   0.787  -0.295
  434    HA   PHE  50           HA       PHE  50  -7.168   2.096   1.934
  435    HB2  PHE  50           HB2      PHE  50  -5.972   1.861  -0.220
  436    HB3  PHE  50           HB3      PHE  50  -7.209   2.835  -1.003
  437    HD1  PHE  50           HD1      PHE  50  -4.432   2.897   1.437
  438    HD2  PHE  50           HD2      PHE  50  -7.199   5.202  -0.843
  439    HE1  PHE  50           HE1      PHE  50  -3.177   4.937   1.976
  440    HE2  PHE  50           HE2      PHE  50  -5.942   7.245  -0.303
  441    HZ   PHE  50           HZ       PHE  50  -3.929   7.113   1.106
  442    H    LEU  51           H        LEU  51  -7.917   3.892   2.906
  443    HA   LEU  51           HA       LEU  51 -10.567   4.786   2.078
  444    HB2  LEU  51           HB2      LEU  51  -9.882   4.127   4.490
  445    HB3  LEU  51           HB3      LEU  51  -9.104   5.695   4.545
  446    HG   LEU  51           HG       LEU  51 -11.416   5.562   5.563
  447   HD11  LEU  51          HD11      LEU  51 -11.013   7.537   3.322
  448   HD12  LEU  51          HD12      LEU  51 -12.153   7.706   4.659
  449   HD13  LEU  51          HD13      LEU  51 -10.418   7.699   4.975
  450   HD21  LEU  51          HD21      LEU  51 -13.315   5.656   4.018
  451   HD22  LEU  51          HD22      LEU  51 -12.222   5.365   2.664
  452   HD23  LEU  51          HD23      LEU  51 -12.448   4.126   3.899
  453    H    SER  52           H        SER  52 -10.628   6.379   0.683
  454    HA   SER  52           HA       SER  52  -8.405   8.147   0.282
  455    HB2  SER  52           HB2      SER  52 -11.159   8.314  -0.958
  456    HB3  SER  52           HB3      SER  52  -9.660   9.005  -1.580
  457    HG   SER  52           HG       SER  52  -9.538   7.189  -2.639
  458    H    ASP  53           H        ASP  53  -8.435   8.987   2.461
  459    HA   ASP  53           HA       ASP  53 -10.550  10.473   3.566
  460    HB2  ASP  53           HB2      ASP  53  -8.612   9.557   4.837
  461    HB3  ASP  53           HB3      ASP  53  -7.584  10.769   4.085
  462    H    ASP  54           H        ASP  54  -7.537  11.620   2.082
  463    HA   ASP  54           HA       ASP  54  -8.728  13.774   0.683
  464    HB2  ASP  54           HB2      ASP  54  -8.995  14.756   2.898
  465    HB3  ASP  54           HB3      ASP  54  -7.306  14.446   3.274
  466    H    ASP  55           H        ASP  55  -5.752  13.138   2.497
  467    HA   ASP  55           HA       ASP  55  -4.229  13.185  -0.031
  468    HB2  ASP  55           HB2      ASP  55  -3.498  14.914   1.565
  469    HB3  ASP  55           HB3      ASP  55  -3.312  13.700   2.822
  470    HA   PRO  56           HA       PRO  56  -3.526   8.797   0.332
  471    HB2  PRO  56           HB2      PRO  56  -0.732   8.806  -0.016
  472    HB3  PRO  56           HB3      PRO  56  -1.950   8.619  -1.279
  473    HG2  PRO  56           HG2      PRO  56  -0.452  11.049  -0.432
  474    HG3  PRO  56           HG3      PRO  56  -1.004  10.571  -2.048
  475    HD2  PRO  56           HD2      PRO  56  -2.260  12.486  -0.672
  476    HD3  PRO  56           HD3      PRO  56  -3.172  11.325  -1.663
  477    H    LYS  57           H        LYS  57  -1.407  10.990   2.119
  478    HA   LYS  57           HA       LYS  57  -0.577   8.938   3.981
  479    HB2  LYS  57           HB2      LYS  57  -0.196  11.928   4.084
  480    HB3  LYS  57           HB3      LYS  57   0.621  10.741   5.095
  481    HG2  LYS  57           HG2      LYS  57   1.533   9.732   2.983
  482    HG3  LYS  57           HG3      LYS  57   0.907  11.147   2.134
  483    HD2  LYS  57           HD2      LYS  57   2.889  11.156   4.397
  484    HD3  LYS  57           HD3      LYS  57   3.257  11.426   2.693
  485    HE2  LYS  57           HE2      LYS  57   1.612  13.161   4.521
  486    HE3  LYS  57           HE3      LYS  57   3.153  13.556   3.762
  487    HZ1  LYS  57           HZ1      LYS  57   1.390  14.631   2.574
  488    HZ2  LYS  57           HZ2      LYS  57   0.541  13.175   2.384
  489    HZ3  LYS  57           HZ3      LYS  57   2.020  13.403   1.585
  490    H    LYS  58           H        LYS  58  -2.985  11.452   3.808
  491    HA   LYS  58           HA       LYS  58  -3.711  11.324   6.577
  492    HB2  LYS  58           HB2      LYS  58  -5.184  12.456   4.188
  493    HB3  LYS  58           HB3      LYS  58  -5.647  12.693   5.871
  494    HG2  LYS  58           HG2      LYS  58  -3.634  13.911   6.319
  495    HG3  LYS  58           HG3      LYS  58  -3.003  13.548   4.713
  496    HD2  LYS  58           HD2      LYS  58  -3.840  15.809   4.763
  497    HD3  LYS  58           HD3      LYS  58  -4.871  14.819   3.729
  498    HE2  LYS  58           HE2      LYS  58  -6.518  14.637   5.484
  499    HE3  LYS  58           HE3      LYS  58  -5.468  15.505   6.603
  500    HZ1  LYS  58           HZ1      LYS  58  -5.659  17.471   5.272
  501    HZ2  LYS  58           HZ2      LYS  58  -7.221  16.905   5.631
  502    HZ3  LYS  58           HZ3      LYS  58  -6.558  16.651   4.087
  503    H    GLY  59           H        GLY  59  -4.576   9.700   3.645
  504    HA2  GLY  59           HA2      GLY  59  -6.835   8.301   4.754
  505    HA3  GLY  59           HA3      GLY  59  -6.028   7.951   3.228
  506    H    ILE  60           H        ILE  60  -6.611   5.731   4.364
  507    HA   ILE  60           HA       ILE  60  -4.170   4.755   5.612
  508    HB   ILE  60           HB       ILE  60  -5.485   3.565   7.401
  509   HG12  ILE  60          HG12      ILE  60  -7.601   5.606   6.689
  510   HG13  ILE  60          HG13      ILE  60  -7.711   3.879   6.369
  511   HG21  ILE  60          HG21      ILE  60  -4.085   5.461   7.951
  512   HG22  ILE  60          HG22      ILE  60  -5.395   6.572   7.548
  513   HG23  ILE  60          HG23      ILE  60  -5.554   5.484   8.927
  514   HD11  ILE  60          HD11      ILE  60  -8.995   4.501   8.329
  515   HD12  ILE  60          HD12      ILE  60  -7.661   3.432   8.763
  516   HD13  ILE  60          HD13      ILE  60  -7.545   5.161   9.085
  517    H    TRP  61           H        TRP  61  -4.182   2.389   5.830
  518    HA   TRP  61           HA       TRP  61  -5.788   1.116   3.748
  519    HB2  TRP  61           HB2      TRP  61  -3.363   0.195   5.292
  520    HB3  TRP  61           HB3      TRP  61  -4.326  -0.912   4.320
  521    HD1  TRP  61           HD1      TRP  61  -1.623   1.657   4.057
  522    HE1  TRP  61           HE1      TRP  61  -0.902   1.942   1.605
  523    HE3  TRP  61           HE3      TRP  61  -5.346  -1.022   1.837
  524    HZ2  TRP  61           HZ2      TRP  61  -1.807   1.116  -0.942
  525    HZ3  TRP  61           HZ3      TRP  61  -5.354  -1.233  -0.613
  526    HH2  TRP  61           HH2      TRP  61  -3.617  -0.186  -1.972
  527    H    LEU  62           H        LEU  62  -7.563   0.093   4.242
  528    HA   LEU  62           HA       LEU  62  -8.319  -0.271   6.999
  529    HB2  LEU  62           HB2      LEU  62  -9.788  -1.081   4.489
  530    HB3  LEU  62           HB3      LEU  62 -10.469  -0.925   6.097
  531    HG   LEU  62           HG       LEU  62  -9.377   1.362   4.452
  532   HD11  LEU  62          HD11      LEU  62 -12.215   0.556   5.055
  533   HD12  LEU  62          HD12      LEU  62 -11.716   2.034   4.233
  534   HD13  LEU  62          HD13      LEU  62 -11.414   0.465   3.487
  535   HD21  LEU  62          HD21      LEU  62  -9.169   1.734   6.847
  536   HD22  LEU  62          HD22      LEU  62 -10.413   2.772   6.148
  537   HD23  LEU  62          HD23      LEU  62 -10.875   1.335   7.063
  538    H    GLU  63           H        GLU  63  -7.562  -1.983   8.077
  539    HA   GLU  63           HA       GLU  63  -6.837  -4.408   6.683
  540    HB2  GLU  63           HB2      GLU  63  -6.049  -5.171   8.875
  541    HB3  GLU  63           HB3      GLU  63  -5.422  -3.573   8.495
  542    HG2  GLU  63           HG2      GLU  63  -7.148  -2.572   9.924
  543    HG3  GLU  63           HG3      GLU  63  -7.722  -4.188  10.334
  544    H    ALA  64           H        ALA  64  -7.620  -6.512   7.318
  545    HA   ALA  64           HA       ALA  64 -10.439  -6.656   7.284
  546    HB1  ALA  64           HB1      ALA  64  -8.998  -8.358   6.285
  547    HB2  ALA  64           HB2      ALA  64  -8.445  -8.833   7.892
  548    HB3  ALA  64           HB3      ALA  64 -10.132  -9.066   7.435
  549    H    GLY  65           H        GLY  65  -8.258  -6.294   9.859
  550    HA2  GLY  65           HA2      GLY  65  -9.783  -7.722  11.834
  551    HA3  GLY  65           HA3      GLY  65  -8.374  -6.718  12.125
  552    H    LYS  66           H        LYS  66 -10.739  -5.015  10.353
  553    HA   LYS  66           HA       LYS  66 -12.258  -4.247  12.692
  554    HB2  LYS  66           HB2      LYS  66 -11.480  -2.163  13.049
  555    HB3  LYS  66           HB3      LYS  66 -10.020  -2.766  12.280
  556    HG2  LYS  66           HG2      LYS  66 -12.220  -1.377  10.776
  557    HG3  LYS  66           HG3      LYS  66 -10.861  -0.525  11.506
  558    HD2  LYS  66           HD2      LYS  66  -9.313  -1.565  10.065
  559    HD3  LYS  66           HD3      LYS  66 -10.492  -2.774   9.547
  560    HE2  LYS  66           HE2      LYS  66 -10.745   0.186   9.016
  561    HE3  LYS  66           HE3      LYS  66 -10.082  -0.975   7.867
  562    HZ1  LYS  66           HZ1      LYS  66 -12.838  -0.911   8.958
  563    HZ2  LYS  66           HZ2      LYS  66 -12.226  -2.162   7.995
  564    HZ3  LYS  66           HZ3      LYS  66 -12.361  -0.598   7.362
  565    H    ALA  67           H        ALA  67 -14.071  -2.833  12.184
  566    HA   ALA  67           HA       ALA  67 -15.134  -3.531   9.563
  567    HB1  ALA  67           HB1      ALA  67 -16.436  -3.958  11.605
  568    HB2  ALA  67           HB2      ALA  67 -16.489  -2.222  11.914
  569    HB3  ALA  67           HB3      ALA  67 -17.273  -2.885  10.478
  570    H    LEU  68           H        LEU  68 -16.765  -1.574   8.804
  571    HA   LEU  68           HA       LEU  68 -14.814   0.389   7.947
  572    HB2  LEU  68           HB2      LEU  68 -17.727   0.181   7.223
  573    HB3  LEU  68           HB3      LEU  68 -16.502   1.136   6.418
  574    HG   LEU  68           HG       LEU  68 -16.560  -1.878   6.525
  575   HD11  LEU  68          HD11      LEU  68 -17.169   0.024   4.263
  576   HD12  LEU  68          HD12      LEU  68 -17.091  -1.734   4.143
  577   HD13  LEU  68          HD13      LEU  68 -18.341  -0.973   5.127
  578   HD21  LEU  68          HD21      LEU  68 -14.298  -0.986   6.428
  579   HD22  LEU  68          HD22      LEU  68 -14.742  -1.737   4.895
  580   HD23  LEU  68          HD23      LEU  68 -14.743   0.019   5.050
  581    H    ASP  69           H        ASP  69 -18.046   0.571   9.379
  582    HA   ASP  69           HA       ASP  69 -17.956   3.359   9.925
  583    HB2  ASP  69           HB2      ASP  69 -20.098   2.328   9.636
  584    HB3  ASP  69           HB3      ASP  69 -19.772   1.139  10.888
  585    H    TYR  70           H        TYR  70 -16.606   0.678  11.511
  586    HA   TYR  70           HA       TYR  70 -16.339   1.586  14.119
  587    HB2  TYR  70           HB2      TYR  70 -15.512  -0.558  13.700
  588    HB3  TYR  70           HB3      TYR  70 -14.614  -0.059  12.277
  589    HD1  TYR  70           HD1      TYR  70 -14.684   0.080  15.959
  590    HD2  TYR  70           HD2      TYR  70 -12.335   0.550  12.453
  591    HE1  TYR  70           HE1      TYR  70 -12.667   0.227  17.345
  592    HE2  TYR  70           HE2      TYR  70 -10.303   0.705  13.827
  593    HH   TYR  70           HH       TYR  70 -10.348   0.036  17.257
  594    H    TYR  71           H        TYR  71 -14.508   2.409  11.205
  595    HA   TYR  71           HA       TYR  71 -13.196   4.645  12.480
  596    HB2  TYR  71           HB2      TYR  71 -13.255   3.527   9.702
  597    HB3  TYR  71           HB3      TYR  71 -12.657   5.162   9.976
  598    HD1  TYR  71           HD1      TYR  71 -10.658   5.526  11.405
  599    HD2  TYR  71           HD2      TYR  71 -11.993   1.629  10.329
  600    HE1  TYR  71           HE1      TYR  71  -8.457   4.595  12.022
  601    HE2  TYR  71           HE2      TYR  71  -9.808   0.694  10.944
  602    HH   TYR  71           HH       TYR  71  -7.418   2.523  12.625
  603    H    MET  72           H        MET  72 -13.471   6.546  10.373
  604    HA   MET  72           HA       MET  72 -16.193   7.464  10.973
  605    HB2  MET  72           HB2      MET  72 -13.704   8.932  10.144
  606    HB3  MET  72           HB3      MET  72 -15.289   9.695  10.190
  607    HG2  MET  72           HG2      MET  72 -13.855   8.446  12.521
  608    HG3  MET  72           HG3      MET  72 -14.028  10.168  12.201
  609    HE1  MET  72           HE1      MET  72 -16.338  11.483  12.320
  610    HE2  MET  72           HE2      MET  72 -17.016  10.362  11.140
  611    HE3  MET  72           HE3      MET  72 -17.886  10.701  12.636
  612    H    LEU  73           H        LEU  73 -16.814   5.823   9.228
  613    HA   LEU  73           HA       LEU  73 -16.777   7.219   6.627
  614    HB2  LEU  73           HB2      LEU  73 -17.225   4.316   6.537
  615    HB3  LEU  73           HB3      LEU  73 -16.352   5.350   5.435
  616    HG   LEU  73           HG       LEU  73 -15.268   4.285   8.044
  617   HD11  LEU  73          HD11      LEU  73 -14.743   3.524   5.181
  618   HD12  LEU  73          HD12      LEU  73 -13.832   2.934   6.574
  619   HD13  LEU  73          HD13      LEU  73 -15.543   2.537   6.405
  620   HD21  LEU  73          HD21      LEU  73 -13.920   5.841   5.843
  621   HD22  LEU  73          HD22      LEU  73 -14.297   6.443   7.458
  622   HD23  LEU  73          HD23      LEU  73 -13.127   5.140   7.254
  623    H    ARG  74           H        ARG  74 -18.571   7.151   5.417
  624    HA   ARG  74           HA       ARG  74 -20.913   5.733   6.095
  625    HB2  ARG  74           HB2      ARG  74 -22.284   7.828   6.633
  626    HB3  ARG  74           HB3      ARG  74 -21.287   7.152   7.907
  627    HG2  ARG  74           HG2      ARG  74 -21.033   9.483   8.056
  628    HG3  ARG  74           HG3      ARG  74 -19.555   8.898   7.297
  629    HD2  ARG  74           HD2      ARG  74 -21.573   9.554   5.328
  630    HD3  ARG  74           HD3      ARG  74 -21.229  10.926   6.381
  631    HE   ARG  74           HE       ARG  74 -18.869   9.607   5.378
  632   HH11  ARG  74          HH11      ARG  74 -21.305  12.033   4.643
  633   HH12  ARG  74          HH12      ARG  74 -20.251  12.945   3.604
  634   HH21  ARG  74          HH21      ARG  74 -17.498  10.825   4.029
  635   HH22  ARG  74          HH22      ARG  74 -18.100  12.259   3.253
  636    H    ASN  75           H        ASN  75 -22.786   7.490   5.068
  637    HA   ASN  75           HA       ASN  75 -22.484   6.979   2.319
  638    HB2  ASN  75           HB2      ASN  75 -24.459   8.567   3.932
  639    HB3  ASN  75           HB3      ASN  75 -24.530   8.570   2.172
  640   HD21  ASN  75          HD21      ASN  75 -24.701   6.546   5.031
  641   HD22  ASN  75          HD22      ASN  75 -25.547   5.235   4.266
  642    H    GLY  76           H        GLY  76 -20.801   7.922   1.311
  643    HA2  GLY  76           HA2      GLY  76 -20.741  10.099  -0.065
  644    HA3  GLY  76           HA3      GLY  76 -20.560  10.849   1.514
  645    H    ASP  77           H        ASP  77 -18.926   8.394   2.352
  646    HA   ASP  77           HA       ASP  77 -16.417   9.625   1.758
  647    HB2  ASP  77           HB2      ASP  77 -17.120   7.077   3.211
  648    HB3  ASP  77           HB3      ASP  77 -15.462   7.629   2.996
  649    H    THR  78           H        THR  78 -14.882   9.090   0.343
  650    HA   THR  78           HA       THR  78 -15.466   7.045  -1.630
  651    HB   THR  78           HB       THR  78 -13.065   8.881  -1.435
  652    HG1  THR  78           HG1      THR  78 -14.868  10.171  -1.675
  653   HG21  THR  78          HG21      THR  78 -12.837   8.427  -3.842
  654   HG22  THR  78          HG22      THR  78 -14.195   7.305  -3.753
  655   HG23  THR  78          HG23      THR  78 -12.700   6.950  -2.887
  656    H    MET  79           H        MET  79 -14.522   5.077  -1.684
  657    HA   MET  79           HA       MET  79 -12.239   4.611   0.098
  658    HB2  MET  79           HB2      MET  79 -14.480   3.691   0.956
  659    HB3  MET  79           HB3      MET  79 -14.382   2.547  -0.375
  660    HG2  MET  79           HG2      MET  79 -12.252   1.723   0.482
  661    HG3  MET  79           HG3      MET  79 -12.344   2.870   1.815
  662    HE1  MET  79           HE1      MET  79 -15.043  -0.808   1.241
  663    HE2  MET  79           HE2      MET  79 -15.130   0.580   0.156
  664    HE3  MET  79           HE3      MET  79 -13.655  -0.388   0.229
  665    H    GLU  80           H        GLU  80 -10.611   4.175  -1.140
  666    HA   GLU  80           HA       GLU  80 -10.950   3.363  -3.876
  667    HB2  GLU  80           HB2      GLU  80  -9.206   4.986  -2.932
  668    HB3  GLU  80           HB3      GLU  80  -8.374   3.569  -2.314
  669    HG2  GLU  80           HG2      GLU  80  -7.894   2.771  -4.460
  670    HG3  GLU  80           HG3      GLU  80  -9.057   3.856  -5.214
  671    H    TYR  81           H        TYR  81 -11.055   1.245  -4.553
  672    HA   TYR  81           HA       TYR  81  -9.974  -0.793  -2.766
  673    HB2  TYR  81           HB2      TYR  81 -12.287  -1.109  -3.684
  674    HB3  TYR  81           HB3      TYR  81 -11.598  -1.141  -5.304
  675    HD1  TYR  81           HD1      TYR  81 -11.804  -2.939  -2.098
  676    HD2  TYR  81           HD2      TYR  81 -10.493  -3.108  -6.139
  677    HE1  TYR  81           HE1      TYR  81 -11.410  -5.352  -1.862
  678    HE2  TYR  81           HE2      TYR  81 -10.100  -5.524  -5.914
  679    HH   TYR  81           HH       TYR  81  -9.618  -7.144  -4.038
  680    H    ARG  82           H        ARG  82  -7.884  -1.006  -3.079
  681    HA   ARG  82           HA       ARG  82  -6.886  -0.989  -5.829
  682    HB2  ARG  82           HB2      ARG  82  -5.014   0.508  -5.187
  683    HB3  ARG  82           HB3      ARG  82  -6.587   1.290  -5.142
  684    HG2  ARG  82           HG2      ARG  82  -6.644   1.008  -2.709
  685    HG3  ARG  82           HG3      ARG  82  -5.046   0.262  -2.772
  686    HD2  ARG  82           HD2      ARG  82  -5.699   3.055  -3.698
  687    HD3  ARG  82           HD3      ARG  82  -4.986   2.649  -2.140
  688    HE   ARG  82           HE       ARG  82  -3.267   1.534  -3.909
  689   HH11  ARG  82          HH11      ARG  82  -4.703   4.723  -3.698
  690   HH12  ARG  82          HH12      ARG  82  -3.284   5.544  -4.302
  691   HH21  ARG  82          HH21      ARG  82  -1.393   2.620  -4.722
  692   HH22  ARG  82          HH22      ARG  82  -1.401   4.353  -4.848
  693    H    LYS  83           H        LYS  83  -4.609  -1.620  -5.958
  694    HA   LYS  83           HA       LYS  83  -4.129  -4.007  -4.465
  695    HB2  LYS  83           HB2      LYS  83  -3.530  -3.713  -6.843
  696    HB3  LYS  83           HB3      LYS  83  -2.385  -2.463  -6.399
  697    HG2  LYS  83           HG2      LYS  83  -0.898  -3.992  -5.458
  698    HG3  LYS  83           HG3      LYS  83  -2.129  -5.262  -5.353
  699    HD2  LYS  83           HD2      LYS  83  -0.500  -5.607  -7.202
  700    HD3  LYS  83           HD3      LYS  83  -2.171  -5.466  -7.760
  701    HE2  LYS  83           HE2      LYS  83  -1.766  -3.085  -8.266
  702    HE3  LYS  83           HE3      LYS  83  -0.085  -3.291  -7.780
  703    HZ1  LYS  83           HZ1      LYS  83   0.067  -5.027  -9.556
  704    HZ2  LYS  83           HZ2      LYS  83  -0.172  -3.445 -10.124
  705    HZ3  LYS  83           HZ3      LYS  83  -1.470  -4.539 -10.090
  706    H    LYS  84           H        LYS  84  -3.027  -4.196  -2.606
  707    HA   LYS  84           HA       LYS  84  -2.374  -1.902  -1.109
  708    HB2  LYS  84           HB2      LYS  84  -1.551  -4.769  -0.641
  709    HB3  LYS  84           HB3      LYS  84  -1.378  -3.468   0.526
  710    HG2  LYS  84           HG2      LYS  84  -3.875  -3.188   0.415
  711    HG3  LYS  84           HG3      LYS  84  -3.914  -4.688  -0.517
  712    HD2  LYS  84           HD2      LYS  84  -2.673  -5.789   1.352
  713    HD3  LYS  84           HD3      LYS  84  -2.870  -4.301   2.284
  714    HE2  LYS  84           HE2      LYS  84  -5.204  -4.548   2.383
  715    HE3  LYS  84           HE3      LYS  84  -5.214  -5.765   1.106
  716    HZ1  LYS  84           HZ1      LYS  84  -4.072  -6.119   3.832
  717    HZ2  LYS  84           HZ2      LYS  84  -4.063  -7.282   2.596
  718    HZ3  LYS  84           HZ3      LYS  84  -5.536  -6.777   3.268
  719    H    GLN  85           H        GLN  85  -0.538  -3.817  -3.333
  720    HA   GLN  85           HA       GLN  85   1.946  -2.614  -2.419
  721    HB2  GLN  85           HB2      GLN  85   2.507  -4.318  -4.550
  722    HB3  GLN  85           HB3      GLN  85   2.762  -4.653  -2.846
  723    HG2  GLN  85           HG2      GLN  85   0.439  -5.567  -2.778
  724    HG3  GLN  85           HG3      GLN  85   0.396  -5.412  -4.533
  725   HE21  GLN  85          HE21      GLN  85   1.889  -7.023  -1.835
  726   HE22  GLN  85          HE22      GLN  85   2.550  -8.346  -2.732
  727    H    ARG  86           H        ARG  86   3.213  -1.445  -3.848
  728    HA   ARG  86           HA       ARG  86   1.960  -0.707  -6.381
  729    HB2  ARG  86           HB2      ARG  86   2.943   1.678  -5.811
  730    HB3  ARG  86           HB3      ARG  86   1.334   1.198  -5.305
  731    HG2  ARG  86           HG2      ARG  86   2.315   2.279  -3.469
  732    HG3  ARG  86           HG3      ARG  86   2.339   0.558  -3.094
  733    HD2  ARG  86           HD2      ARG  86   4.622   0.424  -3.236
  734    HD3  ARG  86           HD3      ARG  86   4.733   1.743  -4.406
  735    HE   ARG  86           HE       ARG  86   4.837   3.241  -2.681
  736   HH11  ARG  86          HH11      ARG  86   4.134   0.078  -1.376
  737   HH12  ARG  86          HH12      ARG  86   3.978   0.647   0.254
  738   HH21  ARG  86          HH21      ARG  86   4.584   4.017  -0.556
  739   HH22  ARG  86          HH22      ARG  86   4.187   2.903   0.729
  740    HA   PRO  87           HA       PRO  87   5.784  -1.352  -8.267
  741    HB2  PRO  87           HB2      PRO  87   6.050   0.755  -9.993
  742    HB3  PRO  87           HB3      PRO  87   4.961  -0.610 -10.263
  743    HG2  PRO  87           HG2      PRO  87   4.357   2.116  -9.188
  744    HG3  PRO  87           HG3      PRO  87   3.430   1.132 -10.337
  745    HD2  PRO  87           HD2      PRO  87   2.744   1.329  -7.739
  746    HD3  PRO  87           HD3      PRO  87   2.497  -0.162  -8.669
  747    H    LEU  88           H        LEU  88   7.434  -1.225  -6.903
  748    HA   LEU  88           HA       LEU  88   8.511   1.425  -6.257
  749    HB2  LEU  88           HB2      LEU  88   8.576  -1.170  -4.780
  750    HB3  LEU  88           HB3      LEU  88   9.860   0.002  -4.527
  751    HG   LEU  88           HG       LEU  88   6.911   0.478  -4.082
  752   HD11  LEU  88          HD11      LEU  88   9.208   0.253  -2.145
  753   HD12  LEU  88          HD12      LEU  88   7.554   0.703  -1.731
  754   HD13  LEU  88          HD13      LEU  88   7.898  -0.909  -2.357
  755   HD21  LEU  88          HD21      LEU  88   9.293   2.292  -3.764
  756   HD22  LEU  88          HD22      LEU  88   7.964   2.478  -4.907
  757   HD23  LEU  88          HD23      LEU  88   7.666   2.651  -3.176
  758    H    LYS  89           H        LYS  89  10.363   2.033  -7.123
  759    HA   LYS  89           HA       LYS  89  11.849   0.086  -8.705
  760    HB2  LYS  89           HB2      LYS  89  11.899   3.091  -8.585
  761    HB3  LYS  89           HB3      LYS  89  13.195   2.188  -9.355
  762    HG2  LYS  89           HG2      LYS  89  11.755   2.774 -11.094
  763    HG3  LYS  89           HG3      LYS  89  11.379   1.085 -10.754
  764    HD2  LYS  89           HD2      LYS  89   9.315   2.221 -11.024
  765    HD3  LYS  89           HD3      LYS  89   9.502   1.899  -9.301
  766    HE2  LYS  89           HE2      LYS  89   8.674   4.177  -9.748
  767    HE3  LYS  89           HE3      LYS  89  10.227   4.172  -8.915
  768    HZ1  LYS  89           HZ1      LYS  89   9.894   4.527 -11.846
  769    HZ2  LYS  89           HZ2      LYS  89  11.340   4.659 -10.967
  770    HZ3  LYS  89           HZ3      LYS  89  10.107   5.796 -10.744
  771    H    ILE  90           H        ILE  90  13.496  -0.881  -7.906
  772    HA   ILE  90           HA       ILE  90  14.903   0.307  -5.604
  773    HB   ILE  90           HB       ILE  90  14.368  -2.648  -5.995
  774   HG12  ILE  90          HG12      ILE  90  12.293  -1.426  -5.441
  775   HG13  ILE  90          HG13      ILE  90  12.800  -2.488  -4.132
  776   HG21  ILE  90          HG21      ILE  90  15.233  -2.867  -3.712
  777   HG22  ILE  90          HG22      ILE  90  16.436  -2.184  -4.806
  778   HG23  ILE  90          HG23      ILE  90  15.572  -1.137  -3.678
  779   HD11  ILE  90          HD11      ILE  90  13.198   0.493  -4.251
  780   HD12  ILE  90          HD12      ILE  90  12.001  -0.365  -3.280
  781   HD13  ILE  90          HD13      ILE  90  13.720  -0.564  -2.939
  782    H    ARG  91           H        ARG  91  17.112   0.343  -5.796
  783    HA   ARG  91           HA       ARG  91  18.274  -1.068  -8.087
  784    HB2  ARG  91           HB2      ARG  91  18.521   1.408  -8.032
  785    HB3  ARG  91           HB3      ARG  91  19.365   1.263  -6.499
  786    HG2  ARG  91           HG2      ARG  91  21.166   0.052  -7.559
  787    HG3  ARG  91           HG3      ARG  91  20.308   0.084  -9.101
  788    HD2  ARG  91           HD2      ARG  91  21.179   2.541  -7.584
  789    HD3  ARG  91           HD3      ARG  91  22.103   1.804  -8.892
  790    HE   ARG  91           HE       ARG  91  19.883   2.211 -10.191
  791   HH11  ARG  91          HH11      ARG  91  21.370   4.321  -7.825
  792   HH12  ARG  91          HH12      ARG  91  20.738   5.775  -8.538
  793   HH21  ARG  91          HH21      ARG  91  19.027   4.122 -11.127
  794   HH22  ARG  91          HH22      ARG  91  19.383   5.666 -10.395
  795    H    MET  92           H        MET  92  19.541  -2.781  -7.681
  796    HA   MET  92           HA       MET  92  20.237  -3.495  -4.981
  797    HB2  MET  92           HB2      MET  92  20.872  -4.797  -7.634
  798    HB3  MET  92           HB3      MET  92  21.360  -5.456  -6.083
  799    HG2  MET  92           HG2      MET  92  19.484  -6.669  -6.506
  800    HG3  MET  92           HG3      MET  92  18.815  -5.341  -5.563
  801    HE1  MET  92           HE1      MET  92  16.491  -4.854  -6.194
  802    HE2  MET  92           HE2      MET  92  17.410  -3.387  -6.530
  803    HE3  MET  92           HE3      MET  92  16.173  -3.931  -7.663
  804    H    LEU  93           H        LEU  93  22.548  -4.502  -4.804
  805    HA   LEU  93           HA       LEU  93  24.256  -2.291  -4.521
  806    HB2  LEU  93           HB2      LEU  93  24.990  -5.222  -4.438
  807    HB3  LEU  93           HB3      LEU  93  25.941  -3.905  -3.789
  808    HG   LEU  93           HG       LEU  93  24.976  -4.843  -1.903
  809   HD11  LEU  93          HD11      LEU  93  23.300  -3.267  -1.075
  810   HD12  LEU  93          HD12      LEU  93  24.634  -2.452  -1.893
  811   HD13  LEU  93          HD13      LEU  93  23.084  -2.648  -2.712
  812   HD21  LEU  93          HD21      LEU  93  22.754  -5.674  -1.681
  813   HD22  LEU  93          HD22      LEU  93  22.275  -4.989  -3.232
  814   HD23  LEU  93          HD23      LEU  93  23.420  -6.327  -3.177
  815    H    ASP  94           H        ASP  94  23.960  -4.760  -6.972
  816    HA   ASP  94           HA       ASP  94  26.395  -4.277  -8.343
  817    HB2  ASP  94           HB2      ASP  94  25.023  -6.304  -8.672
  818    HB3  ASP  94           HB3      ASP  94  23.759  -5.326  -9.408
  819    H    GLY  95           H        GLY  95  23.511  -2.490  -8.082
  820    HA2  GLY  95           HA2      GLY  95  23.239  -0.305  -8.987
  821    HA3  GLY  95           HA3      GLY  95  24.326  -0.745 -10.302
  822    H    THR  96           H        THR  96  22.145  -3.177  -9.519
  823    HA   THR  96           HA       THR  96  20.753  -2.884 -12.028
  824    HB   THR  96           HB       THR  96  20.322  -4.927  -9.840
  825    HG1  THR  96           HG1      THR  96  22.149  -4.934 -12.035
  826   HG21  THR  96          HG21      THR  96  19.729  -4.994 -12.800
  827   HG22  THR  96          HG22      THR  96  18.544  -4.878 -11.497
  828   HG23  THR  96          HG23      THR  96  19.511  -6.341 -11.683
  829    H    VAL  97           H        VAL  97  18.651  -2.156 -12.276
  830    HA   VAL  97           HA       VAL  97  17.192  -1.607  -9.798
  831    HB   VAL  97           HB       VAL  97  15.747  -0.240 -11.525
  832   HG11  VAL  97          HG11      VAL  97  17.039   1.761 -10.937
  833   HG12  VAL  97          HG12      VAL  97  16.822   0.690  -9.552
  834   HG13  VAL  97          HG13      VAL  97  18.367   0.729 -10.402
  835   HG21  VAL  97          HG21      VAL  97  17.147   0.860 -13.195
  836   HG22  VAL  97          HG22      VAL  97  18.474  -0.221 -12.771
  837   HG23  VAL  97          HG23      VAL  97  17.000  -0.874 -13.486
  838    H    LYS  98           H        LYS  98  15.276  -2.422  -9.460
  839    HA   LYS  98           HA       LYS  98  13.863  -3.783 -11.620
  840    HB2  LYS  98           HB2      LYS  98  13.555  -5.834 -10.554
  841    HB3  LYS  98           HB3      LYS  98  15.245  -5.477 -10.241
  842    HG2  LYS  98           HG2      LYS  98  14.873  -5.043  -7.999
  843    HG3  LYS  98           HG3      LYS  98  13.151  -4.738  -8.240
  844    HD2  LYS  98           HD2      LYS  98  14.431  -7.441  -8.637
  845    HD3  LYS  98           HD3      LYS  98  13.719  -6.934  -7.105
  846    HE2  LYS  98           HE2      LYS  98  12.028  -8.154  -8.157
  847    HE3  LYS  98           HE3      LYS  98  11.593  -6.469  -8.452
  848    HZ1  LYS  98           HZ1      LYS  98  13.007  -8.220 -10.403
  849    HZ2  LYS  98           HZ2      LYS  98  12.466  -6.638 -10.678
  850    HZ3  LYS  98           HZ3      LYS  98  11.346  -7.880 -10.428
  851    H    THR  99           H        THR  99  11.594  -3.979 -11.246
  852    HA   THR  99           HA       THR  99  10.660  -2.187  -9.112
  853    HB   THR  99           HB       THR  99   9.292  -2.850 -11.732
  854    HG1  THR  99           HG1      THR  99   9.811  -0.432 -11.948
  855   HG21  THR  99          HG21      THR  99   7.744  -2.312  -9.914
  856   HG22  THR  99          HG22      THR  99   7.773  -1.029 -11.125
  857   HG23  THR  99          HG23      THR  99   8.630  -0.822  -9.597
  858    H    ILE 100           H        ILE 100   9.791  -3.296  -7.471
  859    HA   ILE 100           HA       ILE 100   8.408  -5.819  -8.082
  860    HB   ILE 100           HB       ILE 100  10.605  -6.046  -6.849
  861   HG12  ILE 100          HG12      ILE 100   8.476  -7.588  -6.690
  862   HG13  ILE 100          HG13      ILE 100   9.870  -7.874  -5.662
  863   HG21  ILE 100          HG21      ILE 100  10.619  -5.517  -4.442
  864   HG22  ILE 100          HG22      ILE 100  10.527  -4.081  -5.465
  865   HG23  ILE 100          HG23      ILE 100   9.082  -4.677  -4.642
  866   HD11  ILE 100          HD11      ILE 100   7.791  -8.087  -4.433
  867   HD12  ILE 100          HD12      ILE 100   8.749  -6.738  -3.823
  868   HD13  ILE 100          HD13      ILE 100   7.354  -6.433  -4.860
  869    H    MET 101           H        MET 101   6.449  -6.156  -7.003
  870    HA   MET 101           HA       MET 101   5.190  -3.719  -6.065
  871    HB2  MET 101           HB2      MET 101   4.036  -6.499  -6.325
  872    HB3  MET 101           HB3      MET 101   3.133  -5.001  -6.150
  873    HG2  MET 101           HG2      MET 101   4.865  -5.740  -8.495
  874    HG3  MET 101           HG3      MET 101   3.105  -5.834  -8.442
  875    HE1  MET 101           HE1      MET 101   2.534  -3.144  -6.692
  876    HE2  MET 101           HE2      MET 101   2.145  -2.055  -8.023
  877    HE3  MET 101           HE3      MET 101   1.560  -3.719  -8.046
  878    H    VAL 102           H        VAL 102   5.476  -3.157  -4.057
  879    HA   VAL 102           HA       VAL 102   5.321  -5.228  -1.963
  880    HB   VAL 102           HB       VAL 102   6.523  -2.881  -0.908
  881   HG11  VAL 102          HG11      VAL 102   6.802  -5.061   0.024
  882   HG12  VAL 102          HG12      VAL 102   7.531  -5.660  -1.470
  883   HG13  VAL 102          HG13      VAL 102   8.384  -4.470  -0.487
  884   HG21  VAL 102          HG21      VAL 102   7.787  -3.879  -3.454
  885   HG22  VAL 102          HG22      VAL 102   7.209  -2.243  -3.111
  886   HG23  VAL 102          HG23      VAL 102   8.615  -2.883  -2.255
  887    H    ASP 103           H        ASP 103   3.889  -5.057  -0.441
  888    HA   ASP 103           HA       ASP 103   1.716  -3.298  -0.686
  889    HB2  ASP 103           HB2      ASP 103   2.494  -4.958   1.722
  890    HB3  ASP 103           HB3      ASP 103   0.901  -4.282   1.396
  891    H    ASP 104           H        ASP 104   1.231  -1.407   0.212
  892    HA   ASP 104           HA       ASP 104   3.217  -0.037   1.814
  893    HB2  ASP 104           HB2      ASP 104   1.990   1.185   0.065
  894    HB3  ASP 104           HB3      ASP 104   0.472   0.860   0.898
  895    H    SER 105           H        SER 105   0.612  -2.071   2.367
  896    HA   SER 105           HA       SER 105  -0.257  -0.947   4.858
  897    HB2  SER 105           HB2      SER 105  -1.447  -3.209   5.012
  898    HB3  SER 105           HB3      SER 105  -1.881  -2.172   3.652
  899    HG   SER 105           HG       SER 105  -0.638  -4.622   3.675
  900    H    LYS 106           H        LYS 106   2.644  -2.106   4.216
  901    HA   LYS 106           HA       LYS 106   2.939  -3.171   6.915
  902    HB2  LYS 106           HB2      LYS 106   4.530  -4.918   6.006
  903    HB3  LYS 106           HB3      LYS 106   2.821  -5.195   5.722
  904    HG2  LYS 106           HG2      LYS 106   3.696  -5.723   3.684
  905    HG3  LYS 106           HG3      LYS 106   3.315  -4.021   3.442
  906    HD2  LYS 106           HD2      LYS 106   5.581  -3.391   3.697
  907    HD3  LYS 106           HD3      LYS 106   6.025  -4.983   4.324
  908    HE2  LYS 106           HE2      LYS 106   5.089  -4.357   1.526
  909    HE3  LYS 106           HE3      LYS 106   6.738  -4.754   2.012
  910    HZ1  LYS 106           HZ1      LYS 106   6.014  -6.946   2.669
  911    HZ2  LYS 106           HZ2      LYS 106   5.543  -6.665   1.058
  912    HZ3  LYS 106           HZ3      LYS 106   4.403  -6.570   2.306
  913    H    THR 107           H        THR 107   5.334  -3.382   7.475
  914    HA   THR 107           HA       THR 107   6.433  -0.762   7.000
  915    HB   THR 107           HB       THR 107   8.208  -1.947   8.670
  916    HG1  THR 107           HG1      THR 107   7.351  -3.850   9.131
  917   HG21  THR 107          HG21      THR 107   5.526  -0.774   9.425
  918   HG22  THR 107          HG22      THR 107   7.000   0.137   9.090
  919   HG23  THR 107          HG23      THR 107   6.919  -0.927  10.496
  920    H    VAL 108           H        VAL 108   9.063  -0.893   7.162
  921    HA   VAL 108           HA       VAL 108   9.630  -1.524   4.431
  922    HB   VAL 108           HB       VAL 108  11.651  -0.547   6.404
  923   HG11  VAL 108          HG11      VAL 108  12.472  -1.138   4.202
  924   HG12  VAL 108          HG12      VAL 108  11.290  -0.059   3.458
  925   HG13  VAL 108          HG13      VAL 108  12.581   0.603   4.464
  926   HG21  VAL 108          HG21      VAL 108  10.942   1.749   5.908
  927   HG22  VAL 108          HG22      VAL 108   9.573   1.117   4.993
  928   HG23  VAL 108          HG23      VAL 108   9.679   0.833   6.730
  929    H    THR 109           H        THR 109  10.882  -2.705   7.559
  930    HA   THR 109           HA       THR 109  12.807  -4.440   6.676
  931    HB   THR 109           HB       THR 109  10.822  -5.041   8.876
  932    HG1  THR 109           HG1      THR 109  13.256  -4.126   9.666
  933   HG21  THR 109          HG21      THR 109  13.635  -6.045   8.407
  934   HG22  THR 109          HG22      THR 109  12.156  -6.991   8.235
  935   HG23  THR 109          HG23      THR 109  12.640  -6.394   9.822
  936    H    ASP 110           H        ASP 110   9.324  -5.203   6.989
  937    HA   ASP 110           HA       ASP 110   9.442  -7.769   5.867
  938    HB2  ASP 110           HB2      ASP 110   7.469  -6.880   7.060
  939    HB3  ASP 110           HB3      ASP 110   7.172  -5.768   5.727
  940    H    MET 111           H        MET 111   8.853  -4.615   4.382
  941    HA   MET 111           HA       MET 111   8.520  -5.288   1.729
  942    HB2  MET 111           HB2      MET 111   8.326  -3.006   2.494
  943    HB3  MET 111           HB3      MET 111  10.020  -2.972   2.958
  944    HG2  MET 111           HG2      MET 111  10.487  -3.410   0.464
  945    HG3  MET 111           HG3      MET 111   8.816  -2.898   0.224
  946    HE1  MET 111           HE1      MET 111   9.098   0.605   2.175
  947    HE2  MET 111           HE2      MET 111   7.950  -0.551   1.495
  948    HE3  MET 111           HE3      MET 111   8.899  -0.981   2.917
  949    H    LEU 112           H        LEU 112  11.538  -4.783   3.500
  950    HA   LEU 112           HA       LEU 112  13.248  -5.056   1.289
  951    HB2  LEU 112           HB2      LEU 112  13.628  -4.207   3.776
  952    HB3  LEU 112           HB3      LEU 112  14.191  -5.856   3.993
  953    HG   LEU 112           HG       LEU 112  15.801  -5.511   2.129
  954   HD11  LEU 112          HD11      LEU 112  16.230  -3.201   1.397
  955   HD12  LEU 112          HD12      LEU 112  14.621  -3.763   0.938
  956   HD13  LEU 112          HD13      LEU 112  14.814  -2.666   2.306
  957   HD21  LEU 112          HD21      LEU 112  17.332  -4.076   3.397
  958   HD22  LEU 112          HD22      LEU 112  15.993  -3.566   4.424
  959   HD23  LEU 112          HD23      LEU 112  16.521  -5.249   4.433
  960    H    MET 113           H        MET 113  12.096  -7.411   3.680
  961    HA   MET 113           HA       MET 113  13.616  -9.584   2.681
  962    HB2  MET 113           HB2      MET 113  12.853 -10.018   4.787
  963    HB3  MET 113           HB3      MET 113  11.281  -9.309   4.519
  964    HG2  MET 113           HG2      MET 113  12.051 -11.861   3.157
  965    HG3  MET 113           HG3      MET 113  11.550 -11.876   4.845
  966    HE1  MET 113           HE1      MET 113   9.162 -11.244   5.694
  967    HE2  MET 113           HE2      MET 113   9.371  -9.637   4.996
  968    HE3  MET 113           HE3      MET 113   7.901 -10.555   4.671
  969    H    THR 114           H        THR 114  10.690  -8.079   1.666
  970    HA   THR 114           HA       THR 114   9.857 -10.193  -0.049
  971    HB   THR 114           HB       THR 114   9.182  -7.243  -0.179
  972    HG1  THR 114           HG1      THR 114   8.628  -8.431   1.821
  973   HG21  THR 114          HG21      THR 114   7.826  -9.650  -1.399
  974   HG22  THR 114          HG22      THR 114   8.647  -8.347  -2.265
  975   HG23  THR 114          HG23      THR 114   7.159  -8.017  -1.378
  976    H    ILE 115           H        ILE 115  11.855  -7.285  -0.402
  977    HA   ILE 115           HA       ILE 115  12.052  -7.494  -3.253
  978    HB   ILE 115           HB       ILE 115  13.729  -5.860  -1.339
  979   HG12  ILE 115          HG12      ILE 115  11.282  -5.042  -2.924
  980   HG13  ILE 115          HG13      ILE 115  11.283  -5.398  -1.199
  981   HG21  ILE 115          HG21      ILE 115  14.212  -4.476  -3.304
  982   HG22  ILE 115          HG22      ILE 115  14.776  -6.133  -3.518
  983   HG23  ILE 115          HG23      ILE 115  13.295  -5.597  -4.313
  984   HD11  ILE 115          HD11      ILE 115  12.815  -3.185  -2.545
  985   HD12  ILE 115          HD12      ILE 115  11.328  -3.008  -1.611
  986   HD13  ILE 115          HD13      ILE 115  12.811  -3.537  -0.817
  987    H    CYS 116           H        CYS 116  14.252  -8.157  -0.526
  988    HA   CYS 116           HA       CYS 116  16.507  -8.824  -2.059
  989    HB2  CYS 116           HB2      CYS 116  17.303  -9.988  -0.021
  990    HB3  CYS 116           HB3      CYS 116  16.690  -8.373   0.330
  991    HG   CYS 116           HG       CYS 116  15.916 -11.128   1.800
  992    H    ALA 117           H        ALA 117  13.749 -10.705  -1.022
  993    HA   ALA 117           HA       ALA 117  14.803 -13.241  -1.728
  994    HB1  ALA 117           HB1      ALA 117  12.528 -14.057  -1.431
  995    HB2  ALA 117           HB2      ALA 117  13.025 -13.013  -0.100
  996    HB3  ALA 117           HB3      ALA 117  11.940 -12.395  -1.347
  997    H    ARG 118           H        ARG 118  13.245 -10.707  -3.539
  998    HA   ARG 118           HA       ARG 118  12.491 -12.306  -5.778
  999    HB2  ARG 118           HB2      ARG 118  13.287  -9.390  -5.973
 1000    HB3  ARG 118           HB3      ARG 118  12.173 -10.289  -6.995
 1001    HG2  ARG 118           HG2      ARG 118  11.703  -9.529  -4.124
 1002    HG3  ARG 118           HG3      ARG 118  11.006  -8.746  -5.537
 1003    HD2  ARG 118           HD2      ARG 118  10.590 -11.663  -4.977
 1004    HD3  ARG 118           HD3      ARG 118   9.569 -10.415  -4.271
 1005    HE   ARG 118           HE       ARG 118   9.869 -10.547  -7.186
 1006   HH11  ARG 118          HH11      ARG 118   7.893 -10.965  -4.322
 1007   HH12  ARG 118          HH12      ARG 118   6.388 -10.873  -5.187
 1008   HH21  ARG 118          HH21      ARG 118   7.892 -10.432  -8.334
 1009   HH22  ARG 118          HH22      ARG 118   6.381 -10.577  -7.472
 1010    H    ILE 119           H        ILE 119  15.402 -10.539  -4.840
 1011    HA   ILE 119           HA       ILE 119  16.804 -11.056  -7.284
 1012    HB   ILE 119           HB       ILE 119  18.249 -10.432  -4.743
 1013   HG12  ILE 119          HG12      ILE 119  16.187  -9.024  -4.704
 1014   HG13  ILE 119          HG13      ILE 119  17.673  -8.091  -4.826
 1015   HG21  ILE 119          HG21      ILE 119  19.564  -9.004  -6.243
 1016   HG22  ILE 119          HG22      ILE 119  19.495 -10.673  -6.810
 1017   HG23  ILE 119          HG23      ILE 119  18.495  -9.438  -7.577
 1018   HD11  ILE 119          HD11      ILE 119  17.297  -7.791  -7.206
 1019   HD12  ILE 119          HD12      ILE 119  15.817  -8.746  -7.100
 1020   HD13  ILE 119          HD13      ILE 119  15.933  -7.198  -6.260
 1021    H    GLY 120           H        GLY 120  16.859 -12.341  -3.990
 1022    HA2  GLY 120           HA2      GLY 120  17.229 -14.788  -3.798
 1023    HA3  GLY 120           HA3      GLY 120  18.523 -14.576  -4.970
 1024    H    ILE 121           H        ILE 121  18.067 -12.140  -2.572
 1025    HA   ILE 121           HA       ILE 121  20.649 -12.764  -1.394
 1026    HB   ILE 121           HB       ILE 121  18.743 -10.502  -0.768
 1027   HG12  ILE 121          HG12      ILE 121  21.239 -10.454  -2.473
 1028   HG13  ILE 121          HG13      ILE 121  19.598 -10.485  -3.113
 1029   HG21  ILE 121          HG21      ILE 121  20.254 -10.952   1.070
 1030   HG22  ILE 121          HG22      ILE 121  21.635 -10.897  -0.026
 1031   HG23  ILE 121          HG23      ILE 121  20.692  -9.438   0.279
 1032   HD11  ILE 121          HD11      ILE 121  20.513  -8.236  -3.149
 1033   HD12  ILE 121          HD12      ILE 121  19.144  -8.335  -2.043
 1034   HD13  ILE 121          HD13      ILE 121  20.790  -8.303  -1.409
 1035    H    THR 122           H        THR 122  20.943 -13.644   0.603
 1036    HA   THR 122           HA       THR 122  18.651 -14.955   1.753
 1037    HB   THR 122           HB       THR 122  21.361 -15.013   3.034
 1038    HG1  THR 122           HG1      THR 122  20.797 -16.722   0.852
 1039   HG21  THR 122          HG21      THR 122  20.764 -17.366   3.393
 1040   HG22  THR 122          HG22      THR 122  19.259 -17.118   2.507
 1041   HG23  THR 122          HG23      THR 122  19.529 -16.284   4.037
 1042    H    ASN 123           H        ASN 123  21.138 -12.732   3.078
 1043    HA   ASN 123           HA       ASN 123  19.411 -12.275   5.400
 1044    HB2  ASN 123           HB2      ASN 123  21.868 -12.798   5.689
 1045    HB3  ASN 123           HB3      ASN 123  22.220 -11.246   4.941
 1046   HD21  ASN 123          HD21      ASN 123  23.220 -10.433   6.752
 1047   HD22  ASN 123          HD22      ASN 123  22.357 -10.023   8.204
 1048    H    HIS 124           H        HIS 124  18.281 -10.422   5.664
 1049    HA   HIS 124           HA       HIS 124  18.857  -8.246   3.755
 1050    HB2  HIS 124           HB2      HIS 124  16.535  -7.868   3.384
 1051    HB3  HIS 124           HB3      HIS 124  16.816  -9.590   3.159
 1052    HD1  HIS 124           HD1      HIS 124  14.779  -7.209   5.035
 1053    HD2  HIS 124           HD2      HIS 124  15.866 -11.197   5.393
 1054    HE1  HIS 124           HE1      HIS 124  13.080  -8.238   6.576
 1055    HE2  HIS 124           HE2      HIS 124  13.942 -10.570   7.000
 1056    H    ASP 125           H        ASP 125  18.659  -9.080   6.967
 1057    HA   ASP 125           HA       ASP 125  17.335  -6.680   7.892
 1058    HB2  ASP 125           HB2      ASP 125  17.304  -9.065   8.956
 1059    HB3  ASP 125           HB3      ASP 125  18.841  -8.573   9.664
 1060    H    GLU 126           H        GLU 126  20.266  -7.247   6.654
 1061    HA   GLU 126           HA       GLU 126  21.732  -5.508   8.496
 1062    HB2  GLU 126           HB2      GLU 126  23.723  -6.198   7.153
 1063    HB3  GLU 126           HB3      GLU 126  22.906  -7.531   7.958
 1064    HG2  GLU 126           HG2      GLU 126  21.914  -8.260   5.934
 1065    HG3  GLU 126           HG3      GLU 126  22.416  -6.803   5.090
 1066    H    TYR 127           H        TYR 127  19.768  -5.121   5.945
 1067    HA   TYR 127           HA       TYR 127  21.436  -3.083   4.642
 1068    HB2  TYR 127           HB2      TYR 127  18.988  -4.527   3.624
 1069    HB3  TYR 127           HB3      TYR 127  19.826  -3.245   2.758
 1070    HD1  TYR 127           HD1      TYR 127  22.386  -3.666   2.383
 1071    HD2  TYR 127           HD2      TYR 127  19.540  -6.712   3.183
 1072    HE1  TYR 127           HE1      TYR 127  23.892  -5.318   1.386
 1073    HE2  TYR 127           HE2      TYR 127  21.036  -8.385   2.200
 1074    HH   TYR 127           HH       TYR 127  22.915  -8.408   0.515
 1075    H    SER 128           H        SER 128  20.797  -1.009   4.510
 1076    HA   SER 128           HA       SER 128  18.293  -0.276   5.821
 1077    HB2  SER 128           HB2      SER 128  19.293   2.063   5.615
 1078    HB3  SER 128           HB3      SER 128  20.129   0.961   6.710
 1079    HG   SER 128           HG       SER 128  21.487   2.178   5.195
 1080    H    LEU 129           H        LEU 129  16.874   1.221   4.709
 1081    HA   LEU 129           HA       LEU 129  17.096   0.917   1.794
 1082    HB2  LEU 129           HB2      LEU 129  15.008   0.180   3.238
 1083    HB3  LEU 129           HB3      LEU 129  14.613   1.884   3.167
 1084    HG   LEU 129           HG       LEU 129  13.437   0.509   1.463
 1085   HD11  LEU 129          HD11      LEU 129  13.809   2.895   1.075
 1086   HD12  LEU 129          HD12      LEU 129  15.346   2.523   0.293
 1087   HD13  LEU 129          HD13      LEU 129  13.832   1.973  -0.428
 1088   HD21  LEU 129          HD21      LEU 129  15.212  -1.115   1.047
 1089   HD22  LEU 129          HD22      LEU 129  14.668  -0.353  -0.448
 1090   HD23  LEU 129          HD23      LEU 129  16.190   0.143   0.292
 1091    H    VAL 130           H        VAL 130  17.202   2.759   0.520
 1092    HA   VAL 130           HA       VAL 130  17.001   5.304   1.955
 1093    HB   VAL 130           HB       VAL 130  19.388   4.678   1.843
 1094   HG11  VAL 130          HG11      VAL 130  20.566   4.710  -0.283
 1095   HG12  VAL 130          HG12      VAL 130  19.396   3.394  -0.190
 1096   HG13  VAL 130          HG13      VAL 130  19.022   4.841  -1.127
 1097   HG21  VAL 130          HG21      VAL 130  20.230   6.759   0.889
 1098   HG22  VAL 130          HG22      VAL 130  18.659   7.043   0.142
 1099   HG23  VAL 130          HG23      VAL 130  18.807   7.014   1.899
 1100    H    ARG 131           H        ARG 131  15.558   6.524   0.997
 1101    HA   ARG 131           HA       ARG 131  14.852   5.886  -1.784
 1102    HB2  ARG 131           HB2      ARG 131  13.278   7.548   0.171
 1103    HB3  ARG 131           HB3      ARG 131  12.720   6.860  -1.348
 1104    HG2  ARG 131           HG2      ARG 131  12.975   4.610  -0.377
 1105    HG3  ARG 131           HG3      ARG 131  13.421   5.358   1.162
 1106    HD2  ARG 131           HD2      ARG 131  11.083   4.857   1.244
 1107    HD3  ARG 131           HD3      ARG 131  11.282   6.614   1.092
 1108    HE   ARG 131           HE       ARG 131  10.760   6.343  -1.293
 1109   HH11  ARG 131          HH11      ARG 131   9.786   3.802   0.904
 1110   HH12  ARG 131          HH12      ARG 131   8.514   3.226  -0.121
 1111   HH21  ARG 131          HH21      ARG 131   9.072   5.612  -2.645
 1112   HH22  ARG 131          HH22      ARG 131   8.104   4.266  -2.149
 1113    H    GLU 132           H        GLU 132  16.223   7.160  -2.982
 1114    HA   GLU 132           HA       GLU 132  16.371   9.964  -2.462
 1115    HB2  GLU 132           HB2      GLU 132  17.157   8.333  -4.889
 1116    HB3  GLU 132           HB3      GLU 132  17.437  10.063  -4.738
 1117    HG2  GLU 132           HG2      GLU 132  18.631   9.363  -2.512
 1118    HG3  GLU 132           HG3      GLU 132  18.742   7.798  -3.321
 1119    H    LEU 133           H        LEU 133  14.560  11.086  -2.562
 1120    HA   LEU 133           HA       LEU 133  12.469  10.172  -4.375
 1121    HB2  LEU 133           HB2      LEU 133  12.281  12.238  -2.189
 1122    HB3  LEU 133           HB3      LEU 133  10.947  11.535  -3.073
 1123    HG   LEU 133           HG       LEU 133  12.747  10.080  -1.137
 1124   HD11  LEU 133          HD11      LEU 133   9.845  10.883  -0.961
 1125   HD12  LEU 133          HD12      LEU 133  10.719   9.909   0.229
 1126   HD13  LEU 133          HD13      LEU 133  11.178  11.593  -0.050
 1127   HD21  LEU 133          HD21      LEU 133  11.223   8.193  -1.458
 1128   HD22  LEU 133          HD22      LEU 133  10.371   9.096  -2.712
 1129   HD23  LEU 133          HD23      LEU 133  12.051   8.618  -2.956
 1130    H    MET 134           H        MET 134  10.947  12.223  -4.753
 1131    HA   MET 134           HA       MET 134  12.484  14.116  -6.402
 1132    HB2  MET 134           HB2      MET 134  10.203  14.464  -7.490
 1133    HB3  MET 134           HB3      MET 134  10.945  12.890  -7.752
 1134    HG2  MET 134           HG2      MET 134   8.674  12.477  -7.280
 1135    HG3  MET 134           HG3      MET 134   9.571  12.033  -5.834
 1136    HE1  MET 134           HE1      MET 134   6.562  12.228  -5.499
 1137    HE2  MET 134           HE2      MET 134   7.651  12.068  -4.121
 1138    HE3  MET 134           HE3      MET 134   6.375  13.286  -4.101
 1139    H    GLU 135           H        GLU 135  11.617  13.953  -3.482
 1140    HA   GLU 135           HA       GLU 135   9.461  15.393  -2.758
 1141    HB2  GLU 135           HB2      GLU 135  11.826  14.427  -1.516
 1142    HB3  GLU 135           HB3      GLU 135  11.501  16.052  -0.924
 1143    HG2  GLU 135           HG2      GLU 135   9.436  13.884  -0.983
 1144    HG3  GLU 135           HG3      GLU 135  10.478  14.207   0.406
 1145    H    GLU 136           H        GLU 136   8.773  17.336  -2.936
 1146    HA   GLU 136           HA       GLU 136  10.459  19.495  -3.815
 1147    HB2  GLU 136           HB2      GLU 136   8.333  20.727  -3.928
 1148    HB3  GLU 136           HB3      GLU 136   8.231  19.167  -4.737
 1149    HG2  GLU 136           HG2      GLU 136   7.153  18.236  -2.715
 1150    HG3  GLU 136           HG3      GLU 136   7.139  19.860  -2.025
 1151    H    LYS 137           H        LYS 137   9.449  18.215  -0.846
 1152    HA   LYS 137           HA       LYS 137   9.741  20.784   0.535
 1153    HB2  LYS 137           HB2      LYS 137   8.738  18.158   1.649
 1154    HB3  LYS 137           HB3      LYS 137   8.646  19.736   2.423
 1155    HG2  LYS 137           HG2      LYS 137   7.059  20.515   0.833
 1156    HG3  LYS 137           HG3      LYS 137   7.290  19.091  -0.181
 1157    HD2  LYS 137           HD2      LYS 137   6.399  17.697   1.679
 1158    HD3  LYS 137           HD3      LYS 137   6.044  19.183   2.565
 1159    HE2  LYS 137           HE2      LYS 137   4.568  19.916   0.773
 1160    HE3  LYS 137           HE3      LYS 137   4.952  18.467  -0.154
 1161    HZ1  LYS 137           HZ1      LYS 137   2.840  18.246   0.967
 1162    HZ2  LYS 137           HZ2      LYS 137   3.562  18.537   2.475
 1163    HZ3  LYS 137           HZ3      LYS 137   3.948  17.131   1.604
 1164    H    LYS 138           H        LYS 138  10.556  17.399   1.289
 1165    HA   LYS 138           HA       LYS 138  12.770  18.167   2.947
 1166    HB2  LYS 138           HB2      LYS 138  11.928  15.471   1.865
 1167    HB3  LYS 138           HB3      LYS 138  13.180  15.708   3.077
 1168    HG2  LYS 138           HG2      LYS 138  11.518  16.701   4.576
 1169    HG3  LYS 138           HG3      LYS 138  10.288  16.441   3.339
 1170    HD2  LYS 138           HD2      LYS 138  11.931  14.182   4.425
 1171    HD3  LYS 138           HD3      LYS 138  10.455  14.721   5.229
 1172    HE2  LYS 138           HE2      LYS 138  10.698  13.728   2.392
 1173    HE3  LYS 138           HE3      LYS 138   9.988  12.853   3.749
 1174    HZ1  LYS 138           HZ1      LYS 138   8.189  13.760   2.592
 1175    HZ2  LYS 138           HZ2      LYS 138   8.947  15.258   2.368
 1176    HZ3  LYS 138           HZ3      LYS 138   8.393  14.809   3.908
 1177    H    ASP 169           H        ASP 169  12.728  15.970   0.228
 1178    HA   ASP 169           HA       ASP 169  14.157  15.445  -1.386
 1179    HB2  ASP 169           HB2      ASP 169  13.798  17.683  -2.228
 1180    HB3  ASP 169           HB3      ASP 169  15.002  18.334  -1.121
 1181    H    GLU 170           H        GLU 170  15.084  14.014   0.048
 1182    HA   GLU 170           HA       GLU 170  17.926  14.459   0.220
 1183    HB2  GLU 170           HB2      GLU 170  18.096  13.738   2.507
 1184    HB3  GLU 170           HB3      GLU 170  16.969  15.082   2.414
 1185    HG2  GLU 170           HG2      GLU 170  15.135  13.774   2.868
 1186    HG3  GLU 170           HG3      GLU 170  15.941  12.288   2.363
 1187    H    LEU 171           H        LEU 171  18.628  12.152   1.470
 1188    HA   LEU 171           HA       LEU 171  18.112  10.221  -0.587
 1189    HB2  LEU 171           HB2      LEU 171  19.636   9.796   1.974
 1190    HB3  LEU 171           HB3      LEU 171  19.774   8.885   0.481
 1191    HG   LEU 171           HG       LEU 171  20.684  11.689   1.011
 1192   HD11  LEU 171          HD11      LEU 171  22.163   9.195   0.184
 1193   HD12  LEU 171          HD12      LEU 171  22.878  10.792   0.406
 1194   HD13  LEU 171          HD13      LEU 171  22.187   9.937   1.784
 1195   HD21  LEU 171          HD21      LEU 171  19.647  11.620  -1.185
 1196   HD22  LEU 171          HD22      LEU 171  21.404  11.739  -1.341
 1197   HD23  LEU 171          HD23      LEU 171  20.601  10.189  -1.604
 1198    H    ASN 172           H        ASN 172  16.853  10.924   2.526
 1199    HA   ASN 172           HA       ASN 172  15.429   9.867   3.932
 1200    HB2  ASN 172           HB2      ASN 172  14.413   8.735   1.323
 1201    HB3  ASN 172           HB3      ASN 172  13.561   8.625   2.850
 1202   HD21  ASN 172          HD21      ASN 172  14.200  10.456   0.129
 1203   HD22  ASN 172          HD22      ASN 172  13.339  11.889   0.569
 1204    H    TRP 173           H        TRP 173  17.061   8.593   4.978
 1205    HA   TRP 173           HA       TRP 173  17.506   5.897   4.002
 1206    HB2  TRP 173           HB2      TRP 173  18.561   7.414   6.398
 1207    HB3  TRP 173           HB3      TRP 173  18.950   5.733   6.061
 1208    HD1  TRP 173           HD1      TRP 173  19.565   9.271   4.675
 1209    HE1  TRP 173           HE1      TRP 173  21.694   9.214   3.251
 1210    HE3  TRP 173           HE3      TRP 173  20.425   4.235   4.730
 1211    HZ2  TRP 173           HZ2      TRP 173  23.506   7.278   2.262
 1212    HZ3  TRP 173           HZ3      TRP 173  22.376   3.359   3.519
 1213    HH2  TRP 173           HH2      TRP 173  23.886   4.851   2.309
 1214    H    LEU 174           H        LEU 174  15.748   4.659   4.341
 1215    HA   LEU 174           HA       LEU 174  13.915   5.092   6.456
 1216    HB2  LEU 174           HB2      LEU 174  14.268   2.637   4.744
 1217    HB3  LEU 174           HB3      LEU 174  12.898   2.980   5.777
 1218    HG   LEU 174           HG       LEU 174  13.618   4.186   3.144
 1219   HD11  LEU 174          HD11      LEU 174  12.145   2.324   3.104
 1220   HD12  LEU 174          HD12      LEU 174  11.166   2.989   4.415
 1221   HD13  LEU 174          HD13      LEU 174  11.165   3.767   2.828
 1222   HD21  LEU 174          HD21      LEU 174  11.944   5.468   5.295
 1223   HD22  LEU 174          HD22      LEU 174  13.315   6.162   4.434
 1224   HD23  LEU 174          HD23      LEU 174  11.792   5.881   3.583
 1225    H    ASP 175           H        ASP 175  13.962   4.479   8.442
 1226    HA   ASP 175           HA       ASP 175  16.078   2.879   9.530
 1227    HB2  ASP 175           HB2      ASP 175  15.128   3.399  11.671
 1228    HB3  ASP 175           HB3      ASP 175  15.019   4.853  10.688
 1229    H    HIS 176           H        HIS 176  13.228   2.192   8.032
 1230    HA   HIS 176           HA       HIS 176  12.087   0.282   7.632
 1231    HB2  HIS 176           HB2      HIS 176  14.156  -1.002   9.417
 1232    HB3  HIS 176           HB3      HIS 176  12.907  -1.893   8.561
 1233    HD1  HIS 176           HD1      HIS 176  13.193  -2.167   6.005
 1234    HD2  HIS 176           HD2      HIS 176  16.292  -0.146   7.869
 1235    HE1  HIS 176           HE1      HIS 176  15.033  -2.050   4.307
 1236    HE2  HIS 176           HE2      HIS 176  17.000  -1.162   5.608
 1237    H    GLY 177           H        GLY 177  11.781   2.065  10.069
 1238    HA2  GLY 177           HA2      GLY 177  10.402   0.121  11.819
 1239    HA3  GLY 177           HA3      GLY 177  11.170   1.592  12.394
 1240    H    ARG 178           H        ARG 178  10.025   3.025   9.979
 1241    HA   ARG 178           HA       ARG 178   7.362   3.373  11.182
 1242    HB2  ARG 178           HB2      ARG 178   7.421   5.671  10.535
 1243    HB3  ARG 178           HB3      ARG 178   8.919   5.301  11.376
 1244    HG2  ARG 178           HG2      ARG 178  10.066   5.114   9.211
 1245    HG3  ARG 178           HG3      ARG 178   8.560   5.555   8.395
 1246    HD2  ARG 178           HD2      ARG 178   9.964   7.510   8.629
 1247    HD3  ARG 178           HD3      ARG 178   8.539   7.674   9.655
 1248    HE   ARG 178           HE       ARG 178  10.946   6.606  10.889
 1249   HH11  ARG 178          HH11      ARG 178   8.726   9.281  10.500
 1250   HH12  ARG 178          HH12      ARG 178   9.422  10.213  11.794
 1251   HH21  ARG 178          HH21      ARG 178  11.847   7.807  12.617
 1252   HH22  ARG 178          HH22      ARG 178  11.178   9.367  13.002
 1253    H    THR 179           H        THR 179   5.821   4.484   9.616
 1254    HA   THR 179           HA       THR 179   5.442   2.745   7.373
 1255    HB   THR 179           HB       THR 179   3.488   3.431   8.575
 1256    HG1  THR 179           HG1      THR 179   3.248   3.288   6.262
 1257   HG21  THR 179          HG21      THR 179   4.217   6.286   7.901
 1258   HG22  THR 179          HG22      THR 179   4.378   5.539   9.490
 1259   HG23  THR 179          HG23      THR 179   2.778   5.758   8.777
 1260    H    LEU 180           H        LEU 180   5.073   3.480   5.221
 1261    HA   LEU 180           HA       LEU 180   7.028   5.422   4.327
 1262    HB2  LEU 180           HB2      LEU 180   5.029   3.956   2.627
 1263    HB3  LEU 180           HB3      LEU 180   6.625   4.536   2.180
 1264    HG   LEU 180           HG       LEU 180   6.230   2.348   4.203
 1265   HD11  LEU 180          HD11      LEU 180   6.612   2.076   1.231
 1266   HD12  LEU 180          HD12      LEU 180   6.699   0.761   2.403
 1267   HD13  LEU 180          HD13      LEU 180   5.180   1.621   2.157
 1268   HD21  LEU 180          HD21      LEU 180   8.545   1.813   3.613
 1269   HD22  LEU 180          HD22      LEU 180   8.574   3.186   2.504
 1270   HD23  LEU 180          HD23      LEU 180   8.389   3.457   4.239
 1271    H    ARG 181           H        ARG 181   3.770   5.261   5.149
 1272    HA   ARG 181           HA       ARG 181   2.755   7.210   3.279
 1273    HB2  ARG 181           HB2      ARG 181   1.645   5.136   4.555
 1274    HB3  ARG 181           HB3      ARG 181   1.241   6.416   5.694
 1275    HG2  ARG 181           HG2      ARG 181   0.087   7.637   3.945
 1276    HG3  ARG 181           HG3      ARG 181   0.533   6.397   2.765
 1277    HD2  ARG 181           HD2      ARG 181  -1.228   6.087   5.180
 1278    HD3  ARG 181           HD3      ARG 181  -1.707   5.957   3.484
 1279    HE   ARG 181           HE       ARG 181  -0.356   3.922   3.347
 1280   HH11  ARG 181          HH11      ARG 181  -1.270   5.051   6.551
 1281   HH12  ARG 181          HH12      ARG 181  -0.919   3.527   7.309
 1282   HH21  ARG 181          HH21      ARG 181   0.135   1.955   4.358
 1283   HH22  ARG 181          HH22      ARG 181  -0.129   1.760   6.070
 1284    H    GLU 182           H        GLU 182   4.806   7.746   5.578
 1285    HA   GLU 182           HA       GLU 182   3.465  10.229   6.396
 1286    HB2  GLU 182           HB2      GLU 182   4.481  10.128   8.545
 1287    HB3  GLU 182           HB3      GLU 182   3.782   8.550   8.265
 1288    HG2  GLU 182           HG2      GLU 182   5.906   7.586   7.834
 1289    HG3  GLU 182           HG3      GLU 182   6.682   9.168   7.777
 1290    H    GLN 183           H        GLN 183   5.720   8.916   4.503
 1291    HA   GLN 183           HA       GLN 183   7.866  10.840   5.005
 1292    HB2  GLN 183           HB2      GLN 183   7.813   8.601   2.987
 1293    HB3  GLN 183           HB3      GLN 183   9.220   9.437   3.628
 1294    HG2  GLN 183           HG2      GLN 183   9.045   8.382   5.705
 1295    HG3  GLN 183           HG3      GLN 183   7.396   7.845   5.386
 1296   HE21  GLN 183          HE21      GLN 183   9.666   6.310   6.193
 1297   HE22  GLN 183          HE22      GLN 183   9.887   5.089   4.995
 1298    H    GLY 184           H        GLY 184   5.208  10.294   2.927
 1299    HA2  GLY 184           HA2      GLY 184   4.403  11.634   1.210
 1300    HA3  GLY 184           HA3      GLY 184   5.859  12.612   1.333
 1301    H    VAL 185           H        VAL 185   6.448   9.280   1.125
 1302    HA   VAL 185           HA       VAL 185   7.670   9.520  -1.439
 1303    HB   VAL 185           HB       VAL 185   8.242   7.179  -1.199
 1304   HG11  VAL 185          HG11      VAL 185   9.437   7.275   0.945
 1305   HG12  VAL 185          HG12      VAL 185   9.577   8.780   0.037
 1306   HG13  VAL 185          HG13      VAL 185   8.472   8.677   1.407
 1307   HG21  VAL 185          HG21      VAL 185   7.453   5.844   0.698
 1308   HG22  VAL 185          HG22      VAL 185   6.403   7.170   1.196
 1309   HG23  VAL 185          HG23      VAL 185   6.115   6.346  -0.337
 1310    H    GLU 186           H        GLU 186   7.084   8.615  -3.379
 1311    HA   GLU 186           HA       GLU 186   4.315   7.610  -3.558
 1312    HB2  GLU 186           HB2      GLU 186   5.850   9.253  -5.584
 1313    HB3  GLU 186           HB3      GLU 186   4.231   8.613  -5.812
 1314    HG2  GLU 186           HG2      GLU 186   5.043  10.625  -3.736
 1315    HG3  GLU 186           HG3      GLU 186   4.205  10.972  -5.246
 1316    H    GLU 187           H        GLU 187   4.698   7.064  -6.413
 1317    HA   GLU 187           HA       GLU 187   6.083   4.494  -6.073
 1318    HB2  GLU 187           HB2      GLU 187   3.965   5.279  -8.074
 1319    HB3  GLU 187           HB3      GLU 187   4.589   3.661  -7.790
 1320    HG2  GLU 187           HG2      GLU 187   3.468   3.443  -5.777
 1321    HG3  GLU 187           HG3      GLU 187   3.275   5.187  -5.585
 1322    H    HIS 188           H        HIS 188   7.002   7.340  -7.219
 1323    HA   HIS 188           HA       HIS 188   7.914   6.242  -9.793
 1324    HB2  HIS 188           HB2      HIS 188   7.969   8.641 -10.614
 1325    HB3  HIS 188           HB3      HIS 188   6.390   7.906 -10.397
 1326    HD1  HIS 188           HD1      HIS 188   4.767   9.085  -8.907
 1327    HD2  HIS 188           HD2      HIS 188   8.625  10.608  -8.584
 1328    HE1  HIS 188           HE1      HIS 188   4.550  11.218  -7.593
 1329    HE2  HIS 188           HE2      HIS 188   6.843  12.248  -7.665
 1330    H    GLU 189           H        GLU 189   8.966   7.611  -6.846
 1331    HA   GLU 189           HA       GLU 189  11.482   8.578  -7.861
 1332    HB2  GLU 189           HB2      GLU 189  10.895   7.881  -4.991
 1333    HB3  GLU 189           HB3      GLU 189  12.069   9.033  -5.610
 1334    HG2  GLU 189           HG2      GLU 189  10.445  10.450  -4.895
 1335    HG3  GLU 189           HG3      GLU 189   9.937  10.213  -6.567
 1336    H    THR 190           H        THR 190  13.522   7.628  -7.671
 1337    HA   THR 190           HA       THR 190  13.579   4.766  -7.645
 1338    HB   THR 190           HB       THR 190  15.975   6.606  -7.645
 1339    HG1  THR 190           HG1      THR 190  15.334   7.279  -9.537
 1340   HG21  THR 190          HG21      THR 190  15.498   3.863  -8.828
 1341   HG22  THR 190          HG22      THR 190  16.450   4.218  -7.387
 1342   HG23  THR 190          HG23      THR 190  16.989   4.796  -8.963
 1343    H    LEU 191           H        LEU 191  13.980   3.460  -5.982
 1344    HA   LEU 191           HA       LEU 191  15.034   4.658  -3.497
 1345    HB2  LEU 191           HB2      LEU 191  13.463   2.086  -3.660
 1346    HB3  LEU 191           HB3      LEU 191  13.855   3.009  -2.229
 1347    HG   LEU 191           HG       LEU 191  11.626   3.485  -2.463
 1348   HD11  LEU 191          HD11      LEU 191  12.891   5.611  -4.175
 1349   HD12  LEU 191          HD12      LEU 191  11.330   5.727  -3.363
 1350   HD13  LEU 191          HD13      LEU 191  12.810   5.598  -2.414
 1351   HD21  LEU 191          HD21      LEU 191  11.260   2.242  -4.501
 1352   HD22  LEU 191          HD22      LEU 191  10.463   3.814  -4.589
 1353   HD23  LEU 191          HD23      LEU 191  11.978   3.543  -5.451
 1354    H    LEU 192           H        LEU 192  16.843   3.655  -2.536
 1355    HA   LEU 192           HA       LEU 192  18.072   1.603  -4.256
 1356    HB2  LEU 192           HB2      LEU 192  19.689   3.394  -2.504
 1357    HB3  LEU 192           HB3      LEU 192  20.119   2.646  -4.030
 1358    HG   LEU 192           HG       LEU 192  18.196   4.961  -3.781
 1359   HD11  LEU 192          HD11      LEU 192  20.419   5.615  -3.035
 1360   HD12  LEU 192          HD12      LEU 192  21.113   4.973  -4.524
 1361   HD13  LEU 192          HD13      LEU 192  20.019   6.356  -4.584
 1362   HD21  LEU 192          HD21      LEU 192  19.619   3.806  -6.177
 1363   HD22  LEU 192          HD22      LEU 192  17.912   3.579  -5.791
 1364   HD23  LEU 192          HD23      LEU 192  18.524   5.190  -6.172
 1365    H    LEU 193           H        LEU 193  18.854  -0.220  -3.287
 1366    HA   LEU 193           HA       LEU 193  18.485  -0.543  -0.431
 1367    HB2  LEU 193           HB2      LEU 193  17.863  -2.307  -2.071
 1368    HB3  LEU 193           HB3      LEU 193  19.547  -2.459  -2.520
 1369    HG   LEU 193           HG       LEU 193  18.793  -2.911   0.338
 1370   HD11  LEU 193          HD11      LEU 193  17.143  -4.184  -0.960
 1371   HD12  LEU 193          HD12      LEU 193  18.454  -4.937  -1.870
 1372   HD13  LEU 193          HD13      LEU 193  18.292  -5.243  -0.141
 1373   HD21  LEU 193          HD21      LEU 193  20.618  -4.525   0.204
 1374   HD22  LEU 193          HD22      LEU 193  20.794  -4.199  -1.520
 1375   HD23  LEU 193          HD23      LEU 193  21.150  -2.934  -0.342
 1376    H    ARG 194           H        ARG 194  20.072  -0.308   1.049
 1377    HA   ARG 194           HA       ARG 194  22.858  -0.161   0.100
 1378    HB2  ARG 194           HB2      ARG 194  21.531   1.539   2.224
 1379    HB3  ARG 194           HB3      ARG 194  23.246   1.556   1.847
 1380    HG2  ARG 194           HG2      ARG 194  21.079   2.282  -0.104
 1381    HG3  ARG 194           HG3      ARG 194  21.959   3.443   0.889
 1382    HD2  ARG 194           HD2      ARG 194  23.088   1.629  -1.235
 1383    HD3  ARG 194           HD3      ARG 194  22.933   3.387  -1.301
 1384    HE   ARG 194           HE       ARG 194  24.600   2.231   0.817
 1385   HH11  ARG 194          HH11      ARG 194  24.370   4.001  -2.203
 1386   HH12  ARG 194          HH12      ARG 194  26.037   4.490  -2.180
 1387   HH21  ARG 194          HH21      ARG 194  26.777   2.892   0.842
 1388   HH22  ARG 194          HH22      ARG 194  27.397   3.865  -0.459
 1389    H    ARG 195           H        ARG 195  24.428  -0.992   1.501
 1390    HA   ARG 195           HA       ARG 195  23.418  -2.821   3.523
 1391    HB2  ARG 195           HB2      ARG 195  25.356  -3.282   1.873
 1392    HB3  ARG 195           HB3      ARG 195  26.325  -2.284   2.950
 1393    HG2  ARG 195           HG2      ARG 195  25.919  -3.789   4.784
 1394    HG3  ARG 195           HG3      ARG 195  24.814  -4.745   3.796
 1395    HD2  ARG 195           HD2      ARG 195  26.844  -5.009   2.214
 1396    HD3  ARG 195           HD3      ARG 195  27.792  -4.509   3.615
 1397    HE   ARG 195           HE       ARG 195  26.176  -6.502   4.566
 1398   HH11  ARG 195          HH11      ARG 195  28.557  -6.242   2.005
 1399   HH12  ARG 195          HH12      ARG 195  28.946  -7.935   2.020
 1400   HH21  ARG 195          HH21      ARG 195  26.623  -8.712   4.549
 1401   HH22  ARG 195          HH22      ARG 195  27.811  -9.358   3.450
 1402    H    LYS 196           H        LYS 196  23.210  -2.286   5.601
 1403    HA   LYS 196           HA       LYS 196  24.354   0.262   6.476
 1404    HB2  LYS 196           HB2      LYS 196  21.906  -0.127   6.738
 1405    HB3  LYS 196           HB3      LYS 196  22.269  -1.448   7.840
 1406    HG2  LYS 196           HG2      LYS 196  23.352   0.109   9.370
 1407    HG3  LYS 196           HG3      LYS 196  23.017   1.439   8.261
 1408    HD2  LYS 196           HD2      LYS 196  20.590   0.946   8.500
 1409    HD3  LYS 196           HD3      LYS 196  21.000  -0.264   9.718
 1410    HE2  LYS 196           HE2      LYS 196  20.353   1.795  10.802
 1411    HE3  LYS 196           HE3      LYS 196  22.068   1.494  11.070
 1412    HZ1  LYS 196           HZ1      LYS 196  20.958   3.352   9.030
 1413    HZ2  LYS 196           HZ2      LYS 196  22.600   3.089   9.344
 1414    HZ3  LYS 196           HZ3      LYS 196  21.616   3.814  10.520
 1415    H    PHE 197           H        PHE 197  24.057  -3.117   7.513
 1416    HA   PHE 197           HA       PHE 197  26.065  -2.666   9.579
 1417    HB2  PHE 197           HB2      PHE 197  24.611  -5.217   8.853
 1418    HB3  PHE 197           HB3      PHE 197  25.651  -4.976  10.253
 1419    HD1  PHE 197           HD1      PHE 197  24.655  -2.224  11.034
 1420    HD2  PHE 197           HD2      PHE 197  22.609  -5.774   9.902
 1421    HE1  PHE 197           HE1      PHE 197  22.688  -1.500  12.327
 1422    HE2  PHE 197           HE2      PHE 197  20.638  -5.065  11.179
 1423    HZ   PHE 197           HZ       PHE 197  20.678  -2.921  12.402
 1424    H    PHE 198           H        PHE 198  28.067  -3.610   9.589
 1425    HA   PHE 198           HA       PHE 198  28.837  -5.094   7.181
 1426    HB2  PHE 198           HB2      PHE 198  30.417  -2.823   8.410
 1427    HB3  PHE 198           HB3      PHE 198  31.004  -3.893   7.142
 1428    HD1  PHE 198           HD1      PHE 198  30.067  -3.776   4.882
 1429    HD2  PHE 198           HD2      PHE 198  28.891  -1.054   7.933
 1430    HE1  PHE 198           HE1      PHE 198  29.108  -2.285   3.176
 1431    HE2  PHE 198           HE2      PHE 198  27.927   0.441   6.233
 1432    HZ   PHE 198           HZ       PHE 198  28.064  -0.170   3.839
 1433    H    TYR 199           H        TYR 199  28.436  -6.826   8.740
 1434    HA   TYR 199           HA       TYR 199  30.213  -7.180  10.937
 1435    HB2  TYR 199           HB2      TYR 199  29.354  -9.561  10.881
 1436    HB3  TYR 199           HB3      TYR 199  28.142  -8.308  11.092
 1437    HD1  TYR 199           HD1      TYR 199  29.644 -10.579   8.529
 1438    HD2  TYR 199           HD2      TYR 199  26.304  -8.176   9.655
 1439    HE1  TYR 199           HE1      TYR 199  28.335 -11.522   6.678
 1440    HE2  TYR 199           HE2      TYR 199  25.000  -9.114   7.799
 1441    HH   TYR 199           HH       TYR 199  25.263 -10.227   5.727
 1442    H    SER 200           H        SER 200  30.903  -7.093   7.811
 1443    HA   SER 200           HA       SER 200  32.669  -7.659   6.551
 1444    HB2  SER 200           HB2      SER 200  33.781  -7.098   8.863
 1445    HB3  SER 200           HB3      SER 200  34.104  -8.829   8.889
 1446    HG   SER 200           HG       SER 200  35.555  -8.598   7.369
 1447    H    ASP 201           H        ASP 201  30.995  -9.275   5.844
 1448    HA   ASP 201           HA       ASP 201  31.562 -12.040   6.421
 1449    HB2  ASP 201           HB2      ASP 201  29.321 -11.406   5.683
 1450    HB3  ASP 201           HB3      ASP 201  29.972 -10.753   4.183
 1451    H    GLN 202           H        GLN 202  32.511  -9.603   4.186
 1452    HA   GLN 202           HA       GLN 202  34.025 -11.357   2.467
 1453    HB2  GLN 202           HB2      GLN 202  32.929  -9.409   1.524
 1454    HB3  GLN 202           HB3      GLN 202  33.767  -8.350   2.647
 1455    HG2  GLN 202           HG2      GLN 202  35.868  -8.787   1.568
 1456    HG3  GLN 202           HG3      GLN 202  35.121  -9.998   0.524
 1457   HE21  GLN 202          HE21      GLN 202  32.706  -8.486   0.098
 1458   HE22  GLN 202          HE22      GLN 202  33.113  -7.179  -0.965
  Start of MODEL    6
    1    H1   GLY  -5           H1       GLY  -5 -28.815 -16.786   2.747
    2    H2   GLY  -5           H2       GLY  -5 -27.638 -16.639   1.540
    3    H3   GLY  -5           H3       GLY  -5 -28.391 -18.131   1.810
    4    HA2  GLY  -5           HA2      GLY  -5 -29.290 -17.107  -0.164
    5    HA3  GLY  -5           HA3      GLY  -5 -30.511 -17.232   1.095
    6    H    ILE  -4           H        ILE  -4 -31.688 -15.469   1.401
    7    HA   ILE  -4           HA       ILE  -4 -30.768 -12.974   0.243
    8    HB   ILE  -4           HB       ILE  -4 -33.032 -12.098   0.780
    9   HG12  ILE  -4          HG12      ILE  -4 -33.477 -13.721   2.686
   10   HG13  ILE  -4          HG13      ILE  -4 -34.807 -13.473   1.563
   11   HG21  ILE  -4          HG21      ILE  -4 -32.930 -14.614  -0.867
   12   HG22  ILE  -4          HG22      ILE  -4 -34.192 -13.386  -0.956
   13   HG23  ILE  -4          HG23      ILE  -4 -32.534 -12.982  -1.405
   14   HD11  ILE  -4          HD11      ILE  -4 -34.273 -15.595   0.475
   15   HD12  ILE  -4          HD12      ILE  -4 -32.942 -15.837   1.607
   16   HD13  ILE  -4          HD13      ILE  -4 -34.605 -15.804   2.195
   17    H    ASP  -3           H        ASP  -3 -29.277 -12.074   1.534
   18    HA   ASP  -3           HA       ASP  -3 -29.702 -11.924   4.397
   19    HB2  ASP  -3           HB2      ASP  -3 -27.475 -10.839   2.656
   20    HB3  ASP  -3           HB3      ASP  -3 -27.513 -10.724   4.412
   21    HA   PRO  -2           HA       PRO  -2 -31.990  -8.187   4.040
   22    HB2  PRO  -2           HB2      PRO  -2 -32.057  -7.532   6.674
   23    HB3  PRO  -2           HB3      PRO  -2 -33.039  -8.824   5.975
   24    HG2  PRO  -2           HG2      PRO  -2 -30.470  -9.007   7.493
   25    HG3  PRO  -2           HG3      PRO  -2 -31.915 -10.030   7.605
   26    HD2  PRO  -2           HD2      PRO  -2 -29.690 -10.762   6.232
   27    HD3  PRO  -2           HD3      PRO  -2 -31.321 -11.284   5.772
   28    H    PHE  -1           H        PHE  -1 -31.688  -6.011   3.988
   29    HA   PHE  -1           HA       PHE  -1 -29.220  -4.915   5.108
   30    HB2  PHE  -1           HB2      PHE  -1 -30.313  -4.552   2.321
   31    HB3  PHE  -1           HB3      PHE  -1 -29.193  -3.409   3.046
   32    HD1  PHE  -1           HD1      PHE  -1 -26.947  -4.316   3.858
   33    HD2  PHE  -1           HD2      PHE  -1 -29.548  -6.446   1.256
   34    HE1  PHE  -1           HE1      PHE  -1 -25.061  -5.722   3.135
   35    HE2  PHE  -1           HE2      PHE  -1 -27.667  -7.860   0.523
   36    HZ   PHE  -1           HZ       PHE  -1 -25.405  -7.491   1.487
   37    H    THR   0           H        THR   0 -30.386  -4.119   6.799
   38    HA   THR   0           HA       THR   0 -32.712  -2.493   6.424
   39    HB   THR   0           HB       THR   0 -32.414  -1.977   8.875
   40    HG1  THR   0           HG1      THR   0 -30.200  -3.755   8.519
   41   HG21  THR   0          HG21      THR   0 -32.409  -4.889   8.080
   42   HG22  THR   0          HG22      THR   0 -33.817  -3.827   8.116
   43   HG23  THR   0          HG23      THR   0 -32.987  -4.243   9.616
   44    H    MET   1           H        MET   1 -32.355  -0.319   8.100
   45    HA   MET   1           HA       MET   1 -30.932   1.413   6.304
   46    HB2  MET   1           HB2      MET   1 -33.122   1.986   7.400
   47    HB3  MET   1           HB3      MET   1 -32.254   2.150   8.917
   48    HG2  MET   1           HG2      MET   1 -32.634   4.318   7.959
   49    HG3  MET   1           HG3      MET   1 -30.912   3.959   7.937
   50    HE1  MET   1           HE1      MET   1 -29.968   3.787   4.268
   51    HE2  MET   1           HE2      MET   1 -29.455   4.239   5.893
   52    HE3  MET   1           HE3      MET   1 -29.955   2.582   5.554
   53    H    VAL   2           H        VAL   2 -29.146  -0.256   7.251
   54    HA   VAL   2           HA       VAL   2 -27.341   1.548   8.660
   55    HB   VAL   2           HB       VAL   2 -26.225  -0.486   9.683
   56   HG11  VAL   2          HG11      VAL   2 -27.570   1.035  11.026
   57   HG12  VAL   2          HG12      VAL   2 -29.031   0.143  10.599
   58   HG13  VAL   2          HG13      VAL   2 -27.779  -0.628  11.573
   59   HG21  VAL   2          HG21      VAL   2 -27.584  -2.501   9.986
   60   HG22  VAL   2          HG22      VAL   2 -28.845  -1.808   8.966
   61   HG23  VAL   2          HG23      VAL   2 -27.267  -2.193   8.277
   62    H    ALA   3           H        ALA   3 -26.965   2.003   6.371
   63    HA   ALA   3           HA       ALA   3 -24.949   0.187   5.299
   64    HB1  ALA   3           HB1      ALA   3 -27.039  -0.368   4.140
   65    HB2  ALA   3           HB2      ALA   3 -27.217   1.319   3.658
   66    HB3  ALA   3           HB3      ALA   3 -25.867   0.366   3.043
   67    H    LEU   4           H        LEU   4 -23.404   1.158   4.083
   68    HA   LEU   4           HA       LEU   4 -23.311   4.091   4.339
   69    HB2  LEU   4           HB2      LEU   4 -21.215   1.969   4.635
   70    HB3  LEU   4           HB3      LEU   4 -20.747   3.575   4.119
   71    HG   LEU   4           HG       LEU   4 -21.565   4.530   6.198
   72   HD11  LEU   4          HD11      LEU   4 -23.446   3.029   6.596
   73   HD12  LEU   4          HD12      LEU   4 -22.320   1.729   6.984
   74   HD13  LEU   4          HD13      LEU   4 -22.398   3.163   8.008
   75   HD21  LEU   4          HD21      LEU   4 -19.284   3.644   6.101
   76   HD22  LEU   4          HD22      LEU   4 -19.976   3.537   7.721
   77   HD23  LEU   4          HD23      LEU   4 -19.877   2.096   6.709
   78    H    SER   5           H        SER   5 -23.092   5.213   2.526
   79    HA   SER   5           HA       SER   5 -22.922   3.716   0.016
   80    HB2  SER   5           HB2      SER   5 -23.655   6.614   0.501
   81    HB3  SER   5           HB3      SER   5 -23.648   5.820  -1.064
   82    HG   SER   5           HG       SER   5 -25.334   5.348   1.152
   83    H    LEU   6           H        LEU   6 -20.905   3.354  -0.610
   84    HA   LEU   6           HA       LEU   6 -18.912   5.471  -0.132
   85    HB2  LEU   6           HB2      LEU   6 -18.426   2.493  -0.290
   86    HB3  LEU   6           HB3      LEU   6 -17.244   3.729   0.116
   87    HG   LEU   6           HG       LEU   6 -19.644   2.965   1.789
   88   HD11  LEU   6          HD11      LEU   6 -17.993   2.096   3.363
   89   HD12  LEU   6          HD12      LEU   6 -17.911   1.258   1.814
   90   HD13  LEU   6          HD13      LEU   6 -16.702   2.476   2.222
   91   HD21  LEU   6          HD21      LEU   6 -17.432   4.942   2.317
   92   HD22  LEU   6          HD22      LEU   6 -19.130   5.321   2.023
   93   HD23  LEU   6          HD23      LEU   6 -18.661   4.443   3.479
   94    H    LYS   7           H        LYS   7 -17.825   6.217  -1.837
   95    HA   LYS   7           HA       LYS   7 -18.388   5.162  -4.464
   96    HB2  LYS   7           HB2      LYS   7 -16.891   7.515  -3.403
   97    HB3  LYS   7           HB3      LYS   7 -16.505   6.943  -5.020
   98    HG2  LYS   7           HG2      LYS   7 -18.955   7.135  -5.552
   99    HG3  LYS   7           HG3      LYS   7 -19.140   7.966  -4.004
  100    HD2  LYS   7           HD2      LYS   7 -17.680   9.722  -4.682
  101    HD3  LYS   7           HD3      LYS   7 -17.185   8.833  -6.125
  102    HE2  LYS   7           HE2      LYS   7 -18.739  10.560  -6.750
  103    HE3  LYS   7           HE3      LYS   7 -19.497   8.983  -6.968
  104    HZ1  LYS   7           HZ1      LYS   7 -20.968  10.641  -5.913
  105    HZ2  LYS   7           HZ2      LYS   7 -19.902  10.733  -4.602
  106    HZ3  LYS   7           HZ3      LYS   7 -20.713   9.284  -4.931
  107    H    ILE   8           H        ILE   8 -17.384   3.391  -5.143
  108    HA   ILE   8           HA       ILE   8 -14.730   2.757  -4.116
  109    HB   ILE   8           HB       ILE   8 -16.523   1.137  -5.936
  110   HG12  ILE   8          HG12      ILE   8 -17.543   1.400  -3.734
  111   HG13  ILE   8          HG13      ILE   8 -16.957  -0.247  -3.935
  112   HG21  ILE   8          HG21      ILE   8 -15.021  -0.720  -5.384
  113   HG22  ILE   8          HG22      ILE   8 -14.176   0.591  -6.207
  114   HG23  ILE   8          HG23      ILE   8 -14.003   0.388  -4.463
  115   HD11  ILE   8          HD11      ILE   8 -16.493   0.590  -1.708
  116   HD12  ILE   8          HD12      ILE   8 -14.994   0.288  -2.589
  117   HD13  ILE   8          HD13      ILE   8 -15.584   1.939  -2.390
  118    H    SER   9           H        SER   9 -13.257   3.972  -5.173
  119    HA   SER   9           HA       SER   9 -13.457   4.127  -8.092
  120    HB2  SER   9           HB2      SER   9 -11.686   5.727  -6.239
  121    HB3  SER   9           HB3      SER   9 -11.910   6.004  -7.958
  122    HG   SER   9           HG       SER   9 -14.212   5.935  -6.428
  123    H    ILE  10           H        ILE  10 -12.015   3.139  -9.368
  124    HA   ILE  10           HA       ILE  10  -9.721   1.815  -8.083
  125    HB   ILE  10           HB       ILE  10 -11.456   0.580 -10.236
  126   HG12  ILE  10          HG12      ILE  10 -11.316  -0.174  -7.308
  127   HG13  ILE  10          HG13      ILE  10 -12.586   0.832  -7.993
  128   HG21  ILE  10          HG21      ILE  10  -9.147  -0.172 -10.294
  129   HG22  ILE  10          HG22      ILE  10  -9.211  -0.560  -8.575
  130   HG23  ILE  10          HG23      ILE  10 -10.199  -1.466  -9.721
  131   HD11  ILE  10          HD11      ILE  10 -13.270  -1.017  -9.433
  132   HD12  ILE  10          HD12      ILE  10 -11.997  -2.024  -8.743
  133   HD13  ILE  10          HD13      ILE  10 -13.327  -1.463  -7.726
  134    H    GLY  11           H        GLY  11  -8.307   3.384  -8.842
  135    HA2  GLY  11           HA2      GLY  11  -6.772   4.191 -10.378
  136    HA3  GLY  11           HA3      GLY  11  -7.510   3.162 -11.600
  137    H    ASN  12           H        ASN  12  -9.214   3.944 -12.839
  138    HA   ASN  12           HA       ASN  12  -9.732   6.833 -12.573
  139    HB2  ASN  12           HB2      ASN  12 -10.129   6.924 -14.970
  140    HB3  ASN  12           HB3      ASN  12  -8.542   6.230 -14.662
  141   HD21  ASN  12          HD21      ASN  12 -10.439   6.035 -16.946
  142   HD22  ASN  12          HD22      ASN  12 -10.643   4.338 -17.223
  143    H    VAL  13           H        VAL  13 -11.116   3.664 -12.927
  144    HA   VAL  13           HA       VAL  13 -13.788   4.545 -13.453
  145    HB   VAL  13           HB       VAL  13 -12.850   2.278 -14.070
  146   HG11  VAL  13          HG11      VAL  13 -12.967   0.513 -12.346
  147   HG12  VAL  13          HG12      VAL  13 -11.709   1.710 -12.038
  148   HG13  VAL  13          HG13      VAL  13 -13.219   1.761 -11.128
  149   HG21  VAL  13          HG21      VAL  13 -15.405   2.288 -12.471
  150   HG22  VAL  13          HG22      VAL  13 -15.237   2.705 -14.177
  151   HG23  VAL  13          HG23      VAL  13 -14.922   1.054 -13.638
  152    H    VAL  14           H        VAL  14 -15.558   4.489 -11.993
  153    HA   VAL  14           HA       VAL  14 -14.981   4.017  -9.189
  154    HB   VAL  14           HB       VAL  14 -14.528   6.323  -9.135
  155   HG11  VAL  14          HG11      VAL  14 -15.328   6.920 -11.337
  156   HG12  VAL  14          HG12      VAL  14 -16.999   6.783 -10.786
  157   HG13  VAL  14          HG13      VAL  14 -15.948   8.035 -10.121
  158   HG21  VAL  14          HG21      VAL  14 -17.410   5.911  -8.348
  159   HG22  VAL  14          HG22      VAL  14 -15.984   5.708  -7.330
  160   HG23  VAL  14          HG23      VAL  14 -16.447   7.317  -7.894
  161    H    LYS  15           H        LYS  15 -16.531   2.953  -8.273
  162    HA   LYS  15           HA       LYS  15 -19.160   2.863  -9.589
  163    HB2  LYS  15           HB2      LYS  15 -17.609   0.593  -8.333
  164    HB3  LYS  15           HB3      LYS  15 -19.289   0.479  -8.841
  165    HG2  LYS  15           HG2      LYS  15 -16.914   1.010 -10.616
  166    HG3  LYS  15           HG3      LYS  15 -17.839  -0.490 -10.510
  167    HD2  LYS  15           HD2      LYS  15 -19.834   0.689 -11.306
  168    HD3  LYS  15           HD3      LYS  15 -18.907   2.186 -11.415
  169    HE2  LYS  15           HE2      LYS  15 -17.401   1.072 -13.040
  170    HE3  LYS  15           HE3      LYS  15 -18.450  -0.343 -12.989
  171    HZ1  LYS  15           HZ1      LYS  15 -19.201   2.378 -13.913
  172    HZ2  LYS  15           HZ2      LYS  15 -20.282   1.079 -13.772
  173    HZ3  LYS  15           HZ3      LYS  15 -19.001   1.000 -14.879
  174    H    THR  16           H        THR  16 -20.943   2.565  -8.211
  175    HA   THR  16           HA       THR  16 -20.410   3.708  -5.556
  176    HB   THR  16           HB       THR  16 -23.080   3.532  -6.966
  177    HG1  THR  16           HG1      THR  16 -21.452   4.794  -8.136
  178   HG21  THR  16          HG21      THR  16 -23.184   3.901  -4.547
  179   HG22  THR  16          HG22      THR  16 -23.696   5.341  -5.427
  180   HG23  THR  16          HG23      THR  16 -22.089   5.275  -4.703
  181    H    MET  17           H        MET  17 -20.522   2.367  -3.846
  182    HA   MET  17           HA       MET  17 -22.289   0.048  -4.020
  183    HB2  MET  17           HB2      MET  17 -19.359   0.020  -3.374
  184    HB3  MET  17           HB3      MET  17 -20.435  -1.181  -2.679
  185    HG2  MET  17           HG2      MET  17 -21.155  -1.669  -5.074
  186    HG3  MET  17           HG3      MET  17 -19.734  -0.742  -5.556
  187    HE1  MET  17           HE1      MET  17 -19.488  -4.495  -2.890
  188    HE2  MET  17           HE2      MET  17 -20.047  -2.916  -2.334
  189    HE3  MET  17           HE3      MET  17 -21.011  -3.837  -3.490
  190    H    GLN  18           H        GLN  18 -23.122  -0.627  -2.060
  191    HA   GLN  18           HA       GLN  18 -22.491   1.112   0.223
  192    HB2  GLN  18           HB2      GLN  18 -25.089   0.008  -0.753
  193    HB3  GLN  18           HB3      GLN  18 -24.875   0.294   0.972
  194    HG2  GLN  18           HG2      GLN  18 -24.640   2.573   0.702
  195    HG3  GLN  18           HG3      GLN  18 -24.198   2.426  -0.997
  196   HE21  GLN  18          HE21      GLN  18 -25.749   2.308  -2.528
  197   HE22  GLN  18          HE22      GLN  18 -27.417   2.609  -2.208
  198    H    PHE  19           H        PHE  19 -22.160   0.202   2.212
  199    HA   PHE  19           HA       PHE  19 -22.078  -2.723   2.346
  200    HB2  PHE  19           HB2      PHE  19 -19.931  -0.864   3.409
  201    HB3  PHE  19           HB3      PHE  19 -19.939  -2.618   3.517
  202    HD1  PHE  19           HD1      PHE  19 -19.484  -3.982   1.540
  203    HD2  PHE  19           HD2      PHE  19 -19.258   0.262   1.421
  204    HE1  PHE  19           HE1      PHE  19 -18.245  -4.115  -0.579
  205    HE2  PHE  19           HE2      PHE  19 -18.019   0.139  -0.702
  206    HZ   PHE  19           HZ       PHE  19 -17.429  -2.048  -1.657
  207    H    GLU  20           H        GLU  20 -22.156  -3.451   4.618
  208    HA   GLU  20           HA       GLU  20 -23.750  -1.645   6.227
  209    HB2  GLU  20           HB2      GLU  20 -22.749  -4.437   6.828
  210    HB3  GLU  20           HB3      GLU  20 -23.836  -3.512   7.853
  211    HG2  GLU  20           HG2      GLU  20 -25.442  -3.452   5.928
  212    HG3  GLU  20           HG3      GLU  20 -24.381  -4.598   5.106
  213    HA   PRO  21           HA       PRO  21 -20.505   0.155   8.649
  214    HB2  PRO  21           HB2      PRO  21 -21.834  -0.066  11.124
  215    HB3  PRO  21           HB3      PRO  21 -21.891   1.310  10.022
  216    HG2  PRO  21           HG2      PRO  21 -23.849  -0.893  10.400
  217    HG3  PRO  21           HG3      PRO  21 -24.134   0.793   9.923
  218    HD2  PRO  21           HD2      PRO  21 -24.269  -1.232   8.170
  219    HD3  PRO  21           HD3      PRO  21 -23.682   0.379   7.714
  220    H    SER  22           H        SER  22 -21.998  -2.878   9.484
  221    HA   SER  22           HA       SER  22 -19.706  -3.656  11.128
  222    HB2  SER  22           HB2      SER  22 -21.318  -5.612  11.665
  223    HB3  SER  22           HB3      SER  22 -21.692  -4.015  12.318
  224    HG   SER  22           HG       SER  22 -23.088  -5.536  10.529
  225    H    THR  23           H        THR  23 -20.262  -3.724   7.977
  226    HA   THR  23           HA       THR  23 -20.139  -6.397   7.165
  227    HB   THR  23           HB       THR  23 -19.209  -3.850   5.863
  228    HG1  THR  23           HG1      THR  23 -21.449  -5.547   5.747
  229   HG21  THR  23          HG21      THR  23 -18.895  -5.087   3.782
  230   HG22  THR  23          HG22      THR  23 -19.183  -6.604   4.634
  231   HG23  THR  23          HG23      THR  23 -17.764  -5.630   5.022
  232    H    MET  24           H        MET  24 -17.502  -4.097   7.744
  233    HA   MET  24           HA       MET  24 -15.353  -4.404   8.436
  234    HB2  MET  24           HB2      MET  24 -16.453  -6.618   9.449
  235    HB3  MET  24           HB3      MET  24 -15.428  -7.372   8.241
  236    HG2  MET  24           HG2      MET  24 -13.479  -6.560   9.251
  237    HG3  MET  24           HG3      MET  24 -14.377  -5.403  10.236
  238    HE1  MET  24           HE1      MET  24 -13.272  -7.544  13.167
  239    HE2  MET  24           HE2      MET  24 -12.372  -6.815  11.835
  240    HE3  MET  24           HE3      MET  24 -13.691  -5.925  12.598
  241    H    VAL  25           H        VAL  25 -13.535  -4.332   7.329
  242    HA   VAL  25           HA       VAL  25 -13.421  -4.029   4.680
  243    HB   VAL  25           HB       VAL  25 -11.216  -4.971   6.489
  244   HG11  VAL  25          HG11      VAL  25 -10.960  -3.967   3.655
  245   HG12  VAL  25          HG12      VAL  25  -9.625  -4.247   4.775
  246   HG13  VAL  25          HG13      VAL  25 -10.604  -5.602   4.213
  247   HG21  VAL  25          HG21      VAL  25 -10.549  -2.616   6.369
  248   HG22  VAL  25          HG22      VAL  25 -11.932  -2.286   5.325
  249   HG23  VAL  25          HG23      VAL  25 -12.189  -2.802   6.991
  250    H    TYR  26           H        TYR  26 -12.415  -7.130   6.166
  251    HA   TYR  26           HA       TYR  26 -11.737  -8.357   3.757
  252    HB2  TYR  26           HB2      TYR  26 -11.798 -10.497   4.910
  253    HB3  TYR  26           HB3      TYR  26 -11.033  -9.274   5.911
  254    HD1  TYR  26           HD1      TYR  26 -14.093 -11.291   5.457
  255    HD2  TYR  26           HD2      TYR  26 -11.923  -8.698   8.035
  256    HE1  TYR  26           HE1      TYR  26 -15.590 -11.894   7.309
  257    HE2  TYR  26           HE2      TYR  26 -13.415  -9.293   9.893
  258    HH   TYR  26           HH       TYR  26 -15.709 -10.160  10.210
  259    H    ASP  27           H        ASP  27 -14.877  -8.021   5.244
  260    HA   ASP  27           HA       ASP  27 -16.143  -9.971   3.535
  261    HB2  ASP  27           HB2      ASP  27 -17.024  -9.462   5.794
  262    HB3  ASP  27           HB3      ASP  27 -17.408  -7.830   5.260
  263    H    ALA  28           H        ALA  28 -15.855  -6.448   3.653
  264    HA   ALA  28           HA       ALA  28 -17.449  -5.783   1.479
  265    HB1  ALA  28           HB1      ALA  28 -14.833  -4.500   2.272
  266    HB2  ALA  28           HB2      ALA  28 -16.095  -3.770   1.280
  267    HB3  ALA  28           HB3      ALA  28 -16.407  -4.136   2.977
  268    H    CYS  29           H        CYS  29 -14.061  -6.765   1.567
  269    HA   CYS  29           HA       CYS  29 -13.428  -6.524  -1.119
  270    HB2  CYS  29           HB2      CYS  29 -11.756  -6.940   0.600
  271    HB3  CYS  29           HB3      CYS  29 -12.411  -8.548   0.882
  272    HG   CYS  29           HG       CYS  29 -10.810  -7.493  -1.962
  273    H    ARG  30           H        ARG  30 -15.235  -9.112   0.465
  274    HA   ARG  30           HA       ARG  30 -14.904 -10.916  -1.757
  275    HB2  ARG  30           HB2      ARG  30 -16.303 -12.454  -0.604
  276    HB3  ARG  30           HB3      ARG  30 -15.294 -11.682   0.607
  277    HG2  ARG  30           HG2      ARG  30 -17.182 -10.221   1.229
  278    HG3  ARG  30           HG3      ARG  30 -18.177 -11.038   0.021
  279    HD2  ARG  30           HD2      ARG  30 -18.584 -11.898   2.284
  280    HD3  ARG  30           HD3      ARG  30 -17.966 -13.140   1.198
  281    HE   ARG  30           HE       ARG  30 -15.719 -12.310   2.381
  282   HH11  ARG  30          HH11      ARG  30 -18.837 -13.141   3.754
  283   HH12  ARG  30          HH12      ARG  30 -18.156 -13.695   5.255
  284   HH21  ARG  30          HH21      ARG  30 -14.831 -13.068   4.311
  285   HH22  ARG  30          HH22      ARG  30 -15.870 -13.689   5.566
  286    H    MET  31           H        MET  31 -17.367  -8.657  -0.683
  287    HA   MET  31           HA       MET  31 -19.306  -9.457  -2.609
  288    HB2  MET  31           HB2      MET  31 -19.101  -6.929  -0.979
  289    HB3  MET  31           HB3      MET  31 -20.516  -7.452  -1.882
  290    HG2  MET  31           HG2      MET  31 -20.700  -9.419  -0.481
  291    HG3  MET  31           HG3      MET  31 -19.259  -8.940   0.406
  292    HE1  MET  31           HE1      MET  31 -19.551  -5.837   0.646
  293    HE2  MET  31           HE2      MET  31 -20.304  -5.749   2.244
  294    HE3  MET  31           HE3      MET  31 -19.042  -6.948   1.924
  295    H    ILE  32           H        ILE  32 -16.986  -6.766  -2.419
  296    HA   ILE  32           HA       ILE  32 -17.897  -5.355  -4.658
  297    HB   ILE  32           HB       ILE  32 -16.359  -4.345  -3.086
  298   HG12  ILE  32          HG12      ILE  32 -15.195  -4.558  -5.872
  299   HG13  ILE  32          HG13      ILE  32 -16.460  -3.445  -5.357
  300   HG21  ILE  32          HG21      ILE  32 -13.985  -4.903  -3.033
  301   HG22  ILE  32          HG22      ILE  32 -14.980  -6.278  -2.550
  302   HG23  ILE  32          HG23      ILE  32 -14.267  -6.230  -4.163
  303   HD11  ILE  32          HD11      ILE  32 -14.905  -2.336  -3.871
  304   HD12  ILE  32          HD12      ILE  32 -13.638  -3.476  -4.332
  305   HD13  ILE  32          HD13      ILE  32 -14.292  -2.356  -5.525
  306    H    ARG  33           H        ARG  33 -15.343  -7.804  -4.457
  307    HA   ARG  33           HA       ARG  33 -14.704  -7.963  -7.155
  308    HB2  ARG  33           HB2      ARG  33 -14.567  -9.951  -4.919
  309    HB3  ARG  33           HB3      ARG  33 -14.122 -10.416  -6.556
  310    HG2  ARG  33           HG2      ARG  33 -12.428  -8.675  -6.608
  311    HG3  ARG  33           HG3      ARG  33 -12.892  -8.159  -4.987
  312    HD2  ARG  33           HD2      ARG  33 -11.929 -10.935  -5.640
  313    HD3  ARG  33           HD3      ARG  33 -10.862  -9.635  -5.110
  314    HE   ARG  33           HE       ARG  33 -12.408  -9.563  -3.090
  315   HH11  ARG  33          HH11      ARG  33 -11.776 -12.492  -4.898
  316   HH12  ARG  33          HH12      ARG  33 -11.934 -13.532  -3.510
  317   HH21  ARG  33          HH21      ARG  33 -12.651 -10.916  -1.283
  318   HH22  ARG  33          HH22      ARG  33 -12.477 -12.635  -1.449
  319    H    GLU  34           H        GLU  34 -17.516  -9.091  -5.531
  320    HA   GLU  34           HA       GLU  34 -18.218 -11.130  -7.404
  321    HB2  GLU  34           HB2      GLU  34 -19.113 -11.159  -5.133
  322    HB3  GLU  34           HB3      GLU  34 -19.952  -9.642  -5.424
  323    HG2  GLU  34           HG2      GLU  34 -21.394 -10.683  -7.032
  324    HG3  GLU  34           HG3      GLU  34 -20.480 -12.186  -6.940
  325    H    ARG  35           H        ARG  35 -19.511  -7.823  -6.897
  326    HA   ARG  35           HA       ARG  35 -20.935  -8.004  -9.403
  327    HB2  ARG  35           HB2      ARG  35 -21.699  -5.687  -8.910
  328    HB3  ARG  35           HB3      ARG  35 -22.093  -6.856  -7.662
  329    HG2  ARG  35           HG2      ARG  35 -19.577  -5.374  -7.302
  330    HG3  ARG  35           HG3      ARG  35 -21.065  -4.434  -7.164
  331    HD2  ARG  35           HD2      ARG  35 -20.344  -6.920  -5.617
  332    HD3  ARG  35           HD3      ARG  35 -20.376  -5.270  -4.994
  333    HE   ARG  35           HE       ARG  35 -22.828  -5.331  -5.461
  334   HH11  ARG  35          HH11      ARG  35 -20.997  -8.251  -4.901
  335   HH12  ARG  35          HH12      ARG  35 -22.368  -9.193  -4.401
  336   HH21  ARG  35          HH21      ARG  35 -24.658  -6.541  -4.758
  337   HH22  ARG  35          HH22      ARG  35 -24.446  -8.202  -4.273
  338    H    ILE  36           H        ILE  36 -18.090  -6.267  -8.196
  339    HA   ILE  36           HA       ILE  36 -17.818  -4.954 -10.814
  340    HB   ILE  36           HB       ILE  36 -16.218  -4.312  -8.338
  341   HG12  ILE  36          HG12      ILE  36 -18.802  -3.022  -9.248
  342   HG13  ILE  36          HG13      ILE  36 -18.634  -4.078  -7.849
  343   HG21  ILE  36          HG21      ILE  36 -15.953  -2.127  -9.458
  344   HG22  ILE  36          HG22      ILE  36 -15.298  -3.459 -10.414
  345   HG23  ILE  36          HG23      ILE  36 -16.857  -2.747 -10.839
  346   HD11  ILE  36          HD11      ILE  36 -17.126  -2.462  -6.815
  347   HD12  ILE  36          HD12      ILE  36 -17.303  -1.406  -8.217
  348   HD13  ILE  36          HD13      ILE  36 -18.694  -1.747  -7.190
  349    HA   PRO  37           HA       PRO  37 -14.640  -8.152 -11.329
  350    HB2  PRO  37           HB2      PRO  37 -14.783  -7.452 -14.154
  351    HB3  PRO  37           HB3      PRO  37 -15.208  -8.970 -13.363
  352    HG2  PRO  37           HG2      PRO  37 -17.060  -7.330 -14.458
  353    HG3  PRO  37           HG3      PRO  37 -17.396  -8.343 -13.041
  354    HD2  PRO  37           HD2      PRO  37 -16.723  -5.423 -13.166
  355    HD3  PRO  37           HD3      PRO  37 -17.960  -6.251 -12.194
  356    H    GLU  38           H        GLU  38 -14.668  -4.832 -12.281
  357    HA   GLU  38           HA       GLU  38 -12.033  -4.673 -13.313
  358    HB2  GLU  38           HB2      GLU  38 -13.817  -2.978 -13.707
  359    HB3  GLU  38           HB3      GLU  38 -13.679  -2.487 -12.026
  360    HG2  GLU  38           HG2      GLU  38 -12.483  -0.957 -13.455
  361    HG3  GLU  38           HG3      GLU  38 -11.358  -1.824 -12.411
  362    H    ALA  39           H        ALA  39 -13.385  -4.711 -10.136
  363    HA   ALA  39           HA       ALA  39 -11.279  -3.557  -8.675
  364    HB1  ALA  39           HB1      ALA  39 -13.224  -5.707  -7.830
  365    HB2  ALA  39           HB2      ALA  39 -12.249  -4.709  -6.750
  366    HB3  ALA  39           HB3      ALA  39 -13.505  -3.967  -7.741
  367    H    LEU  40           H        LEU  40 -11.861  -6.808  -9.826
  368    HA   LEU  40           HA       LEU  40  -9.425  -7.802  -8.531
  369    HB2  LEU  40           HB2      LEU  40 -10.340 -10.003  -9.053
  370    HB3  LEU  40           HB3      LEU  40 -11.482  -9.029  -8.139
  371    HG   LEU  40           HG       LEU  40 -12.040  -8.511 -10.833
  372   HD11  LEU  40          HD11      LEU  40 -11.598 -11.433 -10.325
  373   HD12  LEU  40          HD12      LEU  40 -12.492 -10.768 -11.695
  374   HD13  LEU  40          HD13      LEU  40 -10.774 -10.403 -11.502
  375   HD21  LEU  40          HD21      LEU  40 -14.148  -9.623 -10.321
  376   HD22  LEU  40          HD22      LEU  40 -13.441 -10.271  -8.840
  377   HD23  LEU  40          HD23      LEU  40 -13.638  -8.528  -9.034
  378    H    ALA  41           H        ALA  41  -9.320  -6.096 -10.886
  379    HA   ALA  41           HA       ALA  41  -9.058  -7.438 -13.295
  380    HB1  ALA  41           HB1      ALA  41  -9.080  -4.999 -13.091
  381    HB2  ALA  41           HB2      ALA  41  -7.466  -5.045 -12.380
  382    HB3  ALA  41           HB3      ALA  41  -7.708  -5.559 -14.050
  383    H    GLY  42           H        GLY  42  -6.975  -7.552 -10.568
  384    HA2  GLY  42           HA2      GLY  42  -5.117  -9.226 -12.133
  385    HA3  GLY  42           HA3      GLY  42  -4.528  -8.112 -10.904
  386    HA   PRO  43           HA       PRO  43  -5.108 -11.984  -8.530
  387    HB2  PRO  43           HB2      PRO  43  -2.968 -10.998  -6.854
  388    HB3  PRO  43           HB3      PRO  43  -2.988 -12.426  -7.885
  389    HG2  PRO  43           HG2      PRO  43  -1.448 -10.220  -8.374
  390    HG3  PRO  43           HG3      PRO  43  -2.003 -11.338  -9.632
  391    HD2  PRO  43           HD2      PRO  43  -3.071  -8.653  -8.870
  392    HD3  PRO  43           HD3      PRO  43  -2.902  -9.386 -10.480
  393    HA   PRO  44           HA       PRO  44  -7.688  -9.362  -5.868
  394    HB2  PRO  44           HB2      PRO  44  -8.973 -11.507  -4.691
  395    HB3  PRO  44           HB3      PRO  44  -9.481 -10.717  -6.186
  396    HG2  PRO  44           HG2      PRO  44  -7.915 -13.227  -5.804
  397    HG3  PRO  44           HG3      PRO  44  -9.176 -12.856  -6.994
  398    HD2  PRO  44           HD2      PRO  44  -6.568 -12.853  -7.648
  399    HD3  PRO  44           HD3      PRO  44  -7.711 -11.701  -8.371
  400    H    ASN  45           H        ASN  45  -5.535 -11.916  -4.970
  401    HA   ASN  45           HA       ASN  45  -5.703 -11.566  -2.138
  402    HB2  ASN  45           HB2      ASN  45  -3.502 -12.766  -3.840
  403    HB3  ASN  45           HB3      ASN  45  -3.611 -12.891  -2.088
  404   HD21  ASN  45          HD21      ASN  45  -3.639 -14.914  -4.258
  405   HD22  ASN  45          HD22      ASN  45  -5.062 -15.859  -3.967
  406    H    ASP  46           H        ASP  46  -4.304  -9.816  -4.670
  407    HA   ASP  46           HA       ASP  46  -2.363  -8.504  -2.901
  408    HB2  ASP  46           HB2      ASP  46  -2.591  -8.607  -5.917
  409    HB3  ASP  46           HB3      ASP  46  -1.449  -7.572  -5.065
  410    H    PHE  47           H        PHE  47  -5.457  -8.108  -3.548
  411    HA   PHE  47           HA       PHE  47  -5.278  -5.191  -3.922
  412    HB2  PHE  47           HB2      PHE  47  -7.414  -7.159  -4.710
  413    HB3  PHE  47           HB3      PHE  47  -7.770  -5.443  -4.546
  414    HD1  PHE  47           HD1      PHE  47  -6.582  -3.811  -6.001
  415    HD2  PHE  47           HD2      PHE  47  -6.326  -8.009  -6.620
  416    HE1  PHE  47           HE1      PHE  47  -5.792  -3.420  -8.294
  417    HE2  PHE  47           HE2      PHE  47  -5.531  -7.624  -8.913
  418    HZ   PHE  47           HZ       PHE  47  -5.265  -5.328  -9.757
  419    H    GLY  48           H        GLY  48  -6.190  -3.844  -2.461
  420    HA2  GLY  48           HA2      GLY  48  -7.866  -4.989  -0.337
  421    HA3  GLY  48           HA3      GLY  48  -6.383  -4.169   0.127
  422    H    LEU  49           H        LEU  49  -7.987  -2.856   1.359
  423    HA   LEU  49           HA       LEU  49  -9.462  -0.971  -0.352
  424    HB2  LEU  49           HB2      LEU  49  -9.880  -1.641   2.559
  425    HB3  LEU  49           HB3      LEU  49 -10.842  -0.511   1.628
  426    HG   LEU  49           HG       LEU  49 -10.669  -3.492   1.177
  427   HD11  LEU  49          HD11      LEU  49 -13.020  -3.475   1.855
  428   HD12  LEU  49          HD12      LEU  49 -11.967  -2.890   3.144
  429   HD13  LEU  49          HD13      LEU  49 -12.909  -1.747   2.187
  430   HD21  LEU  49          HD21      LEU  49 -10.924  -2.287  -0.930
  431   HD22  LEU  49          HD22      LEU  49 -12.403  -3.152  -0.506
  432   HD23  LEU  49          HD23      LEU  49 -12.299  -1.406  -0.266
  433    H    PHE  50           H        PHE  50  -8.420   0.824  -0.679
  434    HA   PHE  50           HA       PHE  50  -7.044   2.149   1.567
  435    HB2  PHE  50           HB2      PHE  50  -5.739   1.915  -0.511
  436    HB3  PHE  50           HB3      PHE  50  -6.973   2.810  -1.389
  437    HD1  PHE  50           HD1      PHE  50  -4.489   3.100   1.348
  438    HD2  PHE  50           HD2      PHE  50  -6.896   5.158  -1.504
  439    HE1  PHE  50           HE1      PHE  50  -3.328   5.200   1.884
  440    HE2  PHE  50           HE2      PHE  50  -5.737   7.258  -0.968
  441    HZ   PHE  50           HZ       PHE  50  -3.946   7.289   0.689
  442    H    LEU  51           H        LEU  51  -7.840   3.948   2.483
  443    HA   LEU  51           HA       LEU  51 -10.425   4.908   1.508
  444    HB2  LEU  51           HB2      LEU  51  -9.917   4.253   3.951
  445    HB3  LEU  51           HB3      LEU  51  -9.037   5.763   4.042
  446    HG   LEU  51           HG       LEU  51 -11.374   5.818   4.959
  447   HD11  LEU  51          HD11      LEU  51 -10.233   7.874   4.344
  448   HD12  LEU  51          HD12      LEU  51 -10.786   7.698   2.678
  449   HD13  LEU  51          HD13      LEU  51 -11.954   7.976   3.972
  450   HD21  LEU  51          HD21      LEU  51 -13.224   5.972   3.367
  451   HD22  LEU  51          HD22      LEU  51 -12.117   5.585   2.048
  452   HD23  LEU  51          HD23      LEU  51 -12.441   4.393   3.308
  453    H    SER  52           H        SER  52 -10.470   6.600   0.228
  454    HA   SER  52           HA       SER  52  -8.095   8.263  -0.059
  455    HB2  SER  52           HB2      SER  52 -10.603   8.285  -1.746
  456    HB3  SER  52           HB3      SER  52  -9.012   8.915  -2.177
  457    HG   SER  52           HG       SER  52  -8.805   7.002  -3.059
  458    H    ASP  53           H        ASP  53  -7.979  10.345   0.565
  459    HA   ASP  53           HA       ASP  53 -10.460  11.623   1.536
  460    HB2  ASP  53           HB2      ASP  53  -8.968  10.999   3.402
  461    HB3  ASP  53           HB3      ASP  53  -7.664  11.917   2.660
  462    H    ASP  54           H        ASP  54  -7.132  12.387   0.546
  463    HA   ASP  54           HA       ASP  54  -7.846  14.417  -1.296
  464    HB2  ASP  54           HB2      ASP  54  -8.511  15.662   0.704
  465    HB3  ASP  54           HB3      ASP  54  -6.945  15.347   1.445
  466    H    ASP  55           H        ASP  55  -5.412  13.906   1.208
  467    HA   ASP  55           HA       ASP  55  -3.331  13.826  -0.875
  468    HB2  ASP  55           HB2      ASP  55  -3.039  15.741   0.603
  469    HB3  ASP  55           HB3      ASP  55  -3.173  14.710   2.022
  470    HA   PRO  56           HA       PRO  56  -2.492   9.554  -0.058
  471    HB2  PRO  56           HB2      PRO  56   0.309   9.934   0.344
  472    HB3  PRO  56           HB3      PRO  56  -0.515   9.356  -1.105
  473    HG2  PRO  56           HG2      PRO  56   0.462  12.068  -0.444
  474    HG3  PRO  56           HG3      PRO  56   0.234  11.305  -2.027
  475    HD2  PRO  56           HD2      PRO  56  -1.420  13.222  -1.147
  476    HD3  PRO  56           HD3      PRO  56  -2.019  11.850  -2.104
  477    H    LYS  57           H        LYS  57  -1.021  11.954   2.143
  478    HA   LYS  57           HA       LYS  57  -0.531   9.969   4.178
  479    HB2  LYS  57           HB2      LYS  57  -0.597  12.952   4.611
  480    HB3  LYS  57           HB3      LYS  57   0.286  11.731   5.526
  481    HG2  LYS  57           HG2      LYS  57   0.886  12.205   2.635
  482    HG3  LYS  57           HG3      LYS  57   1.578  13.231   3.892
  483    HD2  LYS  57           HD2      LYS  57   1.806  10.230   3.855
  484    HD3  LYS  57           HD3      LYS  57   3.024  11.320   3.187
  485    HE2  LYS  57           HE2      LYS  57   2.083  11.219   6.049
  486    HE3  LYS  57           HE3      LYS  57   3.630  10.635   5.439
  487    HZ1  LYS  57           HZ1      LYS  57   4.129  12.714   6.296
  488    HZ2  LYS  57           HZ2      LYS  57   2.690  13.417   5.739
  489    HZ3  LYS  57           HZ3      LYS  57   3.927  13.046   4.644
  490    H    LYS  58           H        LYS  58  -3.040  12.298   3.437
  491    HA   LYS  58           HA       LYS  58  -4.436  12.075   5.918
  492    HB2  LYS  58           HB2      LYS  58  -5.485  12.949   3.219
  493    HB3  LYS  58           HB3      LYS  58  -6.230  13.265   4.779
  494    HG2  LYS  58           HG2      LYS  58  -4.453  14.737   5.406
  495    HG3  LYS  58           HG3      LYS  58  -3.524  14.303   3.967
  496    HD2  LYS  58           HD2      LYS  58  -5.331  15.226   2.565
  497    HD3  LYS  58           HD3      LYS  58  -6.180  15.731   4.026
  498    HE2  LYS  58           HE2      LYS  58  -4.332  17.192   4.617
  499    HE3  LYS  58           HE3      LYS  58  -3.423  16.643   3.211
  500    HZ1  LYS  58           HZ1      LYS  58  -5.123  17.587   1.777
  501    HZ2  LYS  58           HZ2      LYS  58  -4.497  18.777   2.813
  502    HZ3  LYS  58           HZ3      LYS  58  -6.016  18.094   3.128
  503    H    GLY  59           H        GLY  59  -4.369  10.381   2.898
  504    HA2  GLY  59           HA2      GLY  59  -6.729   8.811   3.381
  505    HA3  GLY  59           HA3      GLY  59  -5.514   8.523   2.139
  506    H    ILE  60           H        ILE  60  -6.641   6.452   3.672
  507    HA   ILE  60           HA       ILE  60  -4.320   5.615   5.258
  508    HB   ILE  60           HB       ILE  60  -5.898   4.626   6.958
  509   HG12  ILE  60          HG12      ILE  60  -7.859   6.531   5.657
  510   HG13  ILE  60          HG13      ILE  60  -7.939   4.774   5.578
  511   HG21  ILE  60          HG21      ILE  60  -4.583   6.597   7.457
  512   HG22  ILE  60          HG22      ILE  60  -5.807   7.629   6.717
  513   HG23  ILE  60          HG23      ILE  60  -6.182   6.732   8.188
  514   HD11  ILE  60          HD11      ILE  60  -8.171   6.438   8.073
  515   HD12  ILE  60          HD12      ILE  60  -9.501   5.670   7.204
  516   HD13  ILE  60          HD13      ILE  60  -8.271   4.679   7.985
  517    H    TRP  61           H        TRP  61  -3.998   3.396   5.385
  518    HA   TRP  61           HA       TRP  61  -5.403   1.799   3.420
  519    HB2  TRP  61           HB2      TRP  61  -2.988   1.376   5.139
  520    HB3  TRP  61           HB3      TRP  61  -3.809  -0.014   4.439
  521    HD1  TRP  61           HD1      TRP  61  -1.194   2.465   3.656
  522    HE1  TRP  61           HE1      TRP  61  -0.548   2.331   1.155
  523    HE3  TRP  61           HE3      TRP  61  -5.085  -0.373   1.963
  524    HZ2  TRP  61           HZ2      TRP  61  -1.563   1.189  -1.194
  525    HZ3  TRP  61           HZ3      TRP  61  -5.181  -0.940  -0.428
  526    HH2  TRP  61           HH2      TRP  61  -3.455  -0.174  -1.973
  527    H    LEU  62           H        LEU  62  -6.869   0.255   3.853
  528    HA   LEU  62           HA       LEU  62  -7.850   0.205   6.604
  529    HB2  LEU  62           HB2      LEU  62  -9.158  -0.761   4.060
  530    HB3  LEU  62           HB3      LEU  62  -9.910  -0.702   5.641
  531    HG   LEU  62           HG       LEU  62  -9.019   1.680   4.011
  532   HD11  LEU  62          HD11      LEU  62 -11.410   2.169   3.882
  533   HD12  LEU  62          HD12      LEU  62 -11.017   0.622   3.130
  534   HD13  LEU  62          HD13      LEU  62 -11.760   0.662   4.728
  535   HD21  LEU  62          HD21      LEU  62 -10.418   1.573   6.676
  536   HD22  LEU  62          HD22      LEU  62  -8.749   2.078   6.404
  537   HD23  LEU  62          HD23      LEU  62 -10.077   3.030   5.736
  538    H    GLU  63           H        GLU  63  -6.977  -1.398   7.813
  539    HA   GLU  63           HA       GLU  63  -6.194  -3.912   6.704
  540    HB2  GLU  63           HB2      GLU  63  -5.659  -4.541   8.960
  541    HB3  GLU  63           HB3      GLU  63  -5.166  -2.869   8.742
  542    HG2  GLU  63           HG2      GLU  63  -7.123  -2.095   9.939
  543    HG3  GLU  63           HG3      GLU  63  -7.718  -3.748  10.069
  544    H    ALA  64           H        ALA  64  -7.119  -5.989   7.388
  545    HA   ALA  64           HA       ALA  64 -10.007  -5.907   7.153
  546    HB1  ALA  64           HB1      ALA  64  -8.732  -7.496   5.819
  547    HB2  ALA  64           HB2      ALA  64  -8.118  -8.253   7.288
  548    HB3  ALA  64           HB3      ALA  64  -9.837  -8.335   6.908
  549    H    GLY  65           H        GLY  65  -7.903  -5.772   9.697
  550    HA2  GLY  65           HA2      GLY  65  -9.287  -7.580  11.483
  551    HA3  GLY  65           HA3      GLY  65  -7.917  -6.560  11.883
  552    H    LYS  66           H        LYS  66 -10.600  -5.020  10.354
  553    HA   LYS  66           HA       LYS  66 -12.108  -4.523  12.714
  554    HB2  LYS  66           HB2      LYS  66 -11.435  -2.444  13.353
  555    HB3  LYS  66           HB3      LYS  66  -9.913  -2.943  12.627
  556    HG2  LYS  66           HG2      LYS  66 -12.039  -1.410  11.160
  557    HG3  LYS  66           HG3      LYS  66 -10.682  -0.665  12.003
  558    HD2  LYS  66           HD2      LYS  66  -9.133  -1.483  10.504
  559    HD3  LYS  66           HD3      LYS  66 -10.190  -2.797   9.975
  560    HE2  LYS  66           HE2      LYS  66 -11.557  -1.314   8.733
  561    HE3  LYS  66           HE3      LYS  66 -10.794   0.102   9.455
  562    HZ1  LYS  66           HZ1      LYS  66  -9.437  -1.859   7.698
  563    HZ2  LYS  66           HZ2      LYS  66  -8.747  -0.449   8.347
  564    HZ3  LYS  66           HZ3      LYS  66 -10.001  -0.337   7.211
  565    H    ALA  67           H        ALA  67 -13.898  -2.900  12.211
  566    HA   ALA  67           HA       ALA  67 -14.867  -3.581   9.565
  567    HB1  ALA  67           HB1      ALA  67 -16.284  -3.839  11.559
  568    HB2  ALA  67           HB2      ALA  67 -16.262  -2.087  11.775
  569    HB3  ALA  67           HB3      ALA  67 -17.007  -2.787  10.337
  570    H    LEU  68           H        LEU  68 -16.329  -1.706   8.589
  571    HA   LEU  68           HA       LEU  68 -14.430   0.234   7.665
  572    HB2  LEU  68           HB2      LEU  68 -17.363  -0.119   7.076
  573    HB3  LEU  68           HB3      LEU  68 -16.305   0.993   6.232
  574    HG   LEU  68           HG       LEU  68 -16.003  -2.014   6.256
  575   HD11  LEU  68          HD11      LEU  68 -17.979  -1.322   5.019
  576   HD12  LEU  68          HD12      LEU  68 -17.017  -0.161   4.104
  577   HD13  LEU  68          HD13      LEU  68 -16.721  -1.890   3.920
  578   HD21  LEU  68          HD21      LEU  68 -14.339  -1.639   4.512
  579   HD22  LEU  68          HD22      LEU  68 -14.543   0.104   4.680
  580   HD23  LEU  68          HD23      LEU  68 -13.875  -0.838   6.012
  581    H    ASP  69           H        ASP  69 -17.492   0.390   9.442
  582    HA   ASP  69           HA       ASP  69 -17.462   3.241   9.666
  583    HB2  ASP  69           HB2      ASP  69 -19.588   2.077   9.576
  584    HB3  ASP  69           HB3      ASP  69 -19.173   1.121  10.991
  585    H    TYR  70           H        TYR  70 -15.865   0.780  11.264
  586    HA   TYR  70           HA       TYR  70 -15.600   1.702  13.864
  587    HB2  TYR  70           HB2      TYR  70 -14.696  -0.447  13.096
  588    HB3  TYR  70           HB3      TYR  70 -13.535   0.396  12.073
  589    HD1  TYR  70           HD1      TYR  70 -14.625   0.370  15.626
  590    HD2  TYR  70           HD2      TYR  70 -11.408   0.591  12.875
  591    HE1  TYR  70           HE1      TYR  70 -13.043   0.445  17.501
  592    HE2  TYR  70           HE2      TYR  70  -9.806   0.676  14.734
  593    HH   TYR  70           HH       TYR  70 -10.740   0.041  17.998
  594    H    TYR  71           H        TYR  71 -13.910   2.594  10.904
  595    HA   TYR  71           HA       TYR  71 -12.456   4.731  12.172
  596    HB2  TYR  71           HB2      TYR  71 -12.749   3.742   9.355
  597    HB3  TYR  71           HB3      TYR  71 -12.055   5.331   9.656
  598    HD1  TYR  71           HD1      TYR  71 -11.646   1.719  10.364
  599    HD2  TYR  71           HD2      TYR  71  -9.817   5.557  10.372
  600    HE1  TYR  71           HE1      TYR  71  -9.465   0.671  10.810
  601    HE2  TYR  71           HE2      TYR  71  -7.635   4.517  10.808
  602    HH   TYR  71           HH       TYR  71  -7.033   1.239  10.486
  603    H    MET  72           H        MET  72 -12.962   6.523   9.834
  604    HA   MET  72           HA       MET  72 -15.339   7.785  10.987
  605    HB2  MET  72           HB2      MET  72 -13.091   8.909   9.309
  606    HB3  MET  72           HB3      MET  72 -14.462   9.843   9.892
  607    HG2  MET  72           HG2      MET  72 -13.799   9.531  12.163
  608    HG3  MET  72           HG3      MET  72 -12.546   8.385  11.692
  609    HE1  MET  72           HE1      MET  72 -12.382  12.882  10.647
  610    HE2  MET  72           HE2      MET  72 -13.459  11.742   9.842
  611    HE3  MET  72           HE3      MET  72 -13.712  12.146  11.541
  612    H    LEU  73           H        LEU  73 -15.359   5.608   8.883
  613    HA   LEU  73           HA       LEU  73 -16.204   7.058   6.501
  614    HB2  LEU  73           HB2      LEU  73 -16.688   4.184   6.469
  615    HB3  LEU  73           HB3      LEU  73 -15.888   5.201   5.299
  616    HG   LEU  73           HG       LEU  73 -14.633   3.966   7.747
  617   HD11  LEU  73          HD11      LEU  73 -14.279   3.480   4.795
  618   HD12  LEU  73          HD12      LEU  73 -13.322   2.731   6.074
  619   HD13  LEU  73          HD13      LEU  73 -15.049   2.396   5.951
  620   HD21  LEU  73          HD21      LEU  73 -13.669   6.161   7.323
  621   HD22  LEU  73          HD22      LEU  73 -12.531   4.879   6.910
  622   HD23  LEU  73          HD23      LEU  73 -13.401   5.730   5.633
  623    H    ARG  74           H        ARG  74 -18.118   7.052   5.627
  624    HA   ARG  74           HA       ARG  74 -20.353   5.606   6.546
  625    HB2  ARG  74           HB2      ARG  74 -21.626   7.756   7.247
  626    HB3  ARG  74           HB3      ARG  74 -20.579   6.966   8.413
  627    HG2  ARG  74           HG2      ARG  74 -20.192   9.271   8.642
  628    HG3  ARG  74           HG3      ARG  74 -18.802   8.640   7.766
  629    HD2  ARG  74           HD2      ARG  74 -20.793   9.417   5.881
  630    HD3  ARG  74           HD3      ARG  74 -20.554  10.735   7.028
  631    HE   ARG  74           HE       ARG  74 -18.210   9.498   5.755
  632   HH11  ARG  74          HH11      ARG  74 -20.342  12.269   6.112
  633   HH12  ARG  74          HH12      ARG  74 -19.240  13.374   5.343
  634   HH21  ARG  74          HH21      ARG  74 -16.764  10.935   4.758
  635   HH22  ARG  74          HH22      ARG  74 -17.204  12.613   4.561
  636    H    ASN  75           H        ASN  75 -22.323   7.400   5.724
  637    HA   ASN  75           HA       ASN  75 -22.220   6.981   2.943
  638    HB2  ASN  75           HB2      ASN  75 -24.086   8.435   4.771
  639    HB3  ASN  75           HB3      ASN  75 -24.252   8.642   3.030
  640   HD21  ASN  75          HD21      ASN  75 -24.323   6.315   5.655
  641   HD22  ASN  75          HD22      ASN  75 -25.221   5.108   4.789
  642    H    GLY  76           H        GLY  76 -20.743   7.967   1.721
  643    HA2  GLY  76           HA2      GLY  76 -20.797  10.204   0.477
  644    HA3  GLY  76           HA3      GLY  76 -20.410  10.875   2.052
  645    H    ASP  77           H        ASP  77 -18.696   8.335   2.506
  646    HA   ASP  77           HA       ASP  77 -16.285   9.654   1.681
  647    HB2  ASP  77           HB2      ASP  77 -16.709   6.998   3.060
  648    HB3  ASP  77           HB3      ASP  77 -15.135   7.737   2.779
  649    H    THR  78           H        THR  78 -14.705   8.958   0.288
  650    HA   THR  78           HA       THR  78 -15.518   7.001  -1.732
  651    HB   THR  78           HB       THR  78 -13.168   8.914  -1.665
  652    HG1  THR  78           HG1      THR  78 -15.628   9.510  -2.011
  653   HG21  THR  78          HG21      THR  78 -12.676   6.968  -3.049
  654   HG22  THR  78          HG22      THR  78 -12.946   8.386  -4.065
  655   HG23  THR  78          HG23      THR  78 -14.209   7.166  -3.901
  656    H    MET  79           H        MET  79 -14.507   5.043  -1.936
  657    HA   MET  79           HA       MET  79 -12.127   4.591  -0.287
  658    HB2  MET  79           HB2      MET  79 -14.287   3.637   0.729
  659    HB3  MET  79           HB3      MET  79 -14.279   2.505  -0.618
  660    HG2  MET  79           HG2      MET  79 -12.080   1.696   0.073
  661    HG3  MET  79           HG3      MET  79 -12.091   2.828   1.424
  662    HE1  MET  79           HE1      MET  79 -14.766  -0.888   0.998
  663    HE2  MET  79           HE2      MET  79 -14.946   0.504  -0.072
  664    HE3  MET  79           HE3      MET  79 -13.452  -0.439  -0.096
  665    H    GLU  80           H        GLU  80 -10.583   4.187  -1.622
  666    HA   GLU  80           HA       GLU  80 -11.079   3.275  -4.318
  667    HB2  GLU  80           HB2      GLU  80  -8.947   4.583  -2.844
  668    HB3  GLU  80           HB3      GLU  80  -8.322   3.295  -3.866
  669    HG2  GLU  80           HG2      GLU  80  -9.268   4.308  -5.816
  670    HG3  GLU  80           HG3      GLU  80 -10.110   5.513  -4.841
  671    H    TYR  81           H        TYR  81 -11.071   1.150  -4.936
  672    HA   TYR  81           HA       TYR  81  -9.839  -0.786  -3.142
  673    HB2  TYR  81           HB2      TYR  81 -12.149  -1.197  -4.092
  674    HB3  TYR  81           HB3      TYR  81 -11.413  -1.282  -5.687
  675    HD1  TYR  81           HD1      TYR  81 -11.677  -2.948  -2.413
  676    HD2  TYR  81           HD2      TYR  81 -10.241  -3.268  -6.403
  677    HE1  TYR  81           HE1      TYR  81 -11.269  -5.344  -2.067
  678    HE2  TYR  81           HE2      TYR  81  -9.838  -5.676  -6.070
  679    HH   TYR  81           HH       TYR  81  -9.414  -7.218  -4.155
  680    H    ARG  82           H        ARG  82  -7.737  -0.975  -3.471
  681    HA   ARG  82           HA       ARG  82  -6.775  -0.972  -6.233
  682    HB2  ARG  82           HB2      ARG  82  -4.825   0.438  -5.603
  683    HB3  ARG  82           HB3      ARG  82  -6.360   1.293  -5.574
  684    HG2  ARG  82           HG2      ARG  82  -6.388   1.393  -3.245
  685    HG3  ARG  82           HG3      ARG  82  -5.168   0.126  -3.087
  686    HD2  ARG  82           HD2      ARG  82  -4.596   2.765  -4.409
  687    HD3  ARG  82           HD3      ARG  82  -4.403   2.517  -2.675
  688    HE   ARG  82           HE       ARG  82  -2.897   0.556  -3.511
  689   HH11  ARG  82          HH11      ARG  82  -3.191   3.673  -5.082
  690   HH12  ARG  82          HH12      ARG  82  -1.510   3.745  -5.521
  691   HH21  ARG  82          HH21      ARG  82  -0.679   0.663  -4.076
  692   HH22  ARG  82          HH22      ARG  82  -0.087   2.037  -4.968
  693    H    LYS  83           H        LYS  83  -4.429  -1.565  -6.305
  694    HA   LYS  83           HA       LYS  83  -4.109  -4.068  -5.015
  695    HB2  LYS  83           HB2      LYS  83  -3.242  -3.365  -7.296
  696    HB3  LYS  83           HB3      LYS  83  -2.006  -2.445  -6.457
  697    HG2  LYS  83           HG2      LYS  83  -0.973  -4.387  -5.630
  698    HG3  LYS  83           HG3      LYS  83  -2.371  -5.393  -6.044
  699    HD2  LYS  83           HD2      LYS  83  -1.947  -5.061  -8.402
  700    HD3  LYS  83           HD3      LYS  83  -0.621  -3.956  -8.038
  701    HE2  LYS  83           HE2      LYS  83   0.641  -5.742  -7.018
  702    HE3  LYS  83           HE3      LYS  83  -0.707  -6.861  -7.237
  703    HZ1  LYS  83           HZ1      LYS  83   0.719  -5.514  -9.467
  704    HZ2  LYS  83           HZ2      LYS  83  -0.463  -6.720  -9.600
  705    HZ3  LYS  83           HZ3      LYS  83   1.055  -7.089  -8.939
  706    H    LYS  84           H        LYS  84  -3.229  -4.500  -3.108
  707    HA   LYS  84           HA       LYS  84  -2.498  -2.530  -1.246
  708    HB2  LYS  84           HB2      LYS  84  -1.999  -5.501  -1.371
  709    HB3  LYS  84           HB3      LYS  84  -1.439  -4.521  -0.022
  710    HG2  LYS  84           HG2      LYS  84  -4.306  -4.805  -0.897
  711    HG3  LYS  84           HG3      LYS  84  -3.552  -5.647   0.459
  712    HD2  LYS  84           HD2      LYS  84  -3.016  -2.862   0.706
  713    HD3  LYS  84           HD3      LYS  84  -4.743  -3.078   0.427
  714    HE2  LYS  84           HE2      LYS  84  -4.178  -3.092   2.816
  715    HE3  LYS  84           HE3      LYS  84  -4.882  -4.620   2.291
  716    HZ1  LYS  84           HZ1      LYS  84  -2.806  -5.673   2.366
  717    HZ2  LYS  84           HZ2      LYS  84  -2.868  -4.749   3.782
  718    HZ3  LYS  84           HZ3      LYS  84  -1.948  -4.211   2.459
  719    H    GLN  85           H        GLN  85  -0.755  -4.164  -3.703
  720    HA   GLN  85           HA       GLN  85   1.859  -3.416  -2.766
  721    HB2  GLN  85           HB2      GLN  85   1.328  -4.409  -5.530
  722    HB3  GLN  85           HB3      GLN  85   2.654  -4.792  -4.446
  723    HG2  GLN  85           HG2      GLN  85  -0.081  -5.769  -3.796
  724    HG3  GLN  85           HG3      GLN  85   0.852  -6.576  -5.053
  725   HE21  GLN  85          HE21      GLN  85   0.665  -5.822  -1.672
  726   HE22  GLN  85          HE22      GLN  85   1.811  -6.997  -1.146
  727    H    ARG  86           H        ARG  86   2.962  -1.649  -3.530
  728    HA   ARG  86           HA       ARG  86   1.792  -0.226  -5.828
  729    HB2  ARG  86           HB2      ARG  86   3.043   1.757  -5.061
  730    HB3  ARG  86           HB3      ARG  86   1.913   1.178  -3.849
  731    HG2  ARG  86           HG2      ARG  86   3.792   1.704  -2.616
  732    HG3  ARG  86           HG3      ARG  86   3.942  -0.038  -2.841
  733    HD2  ARG  86           HD2      ARG  86   5.842   0.175  -3.987
  734    HD3  ARG  86           HD3      ARG  86   5.206   1.485  -4.973
  735    HE   ARG  86           HE       ARG  86   6.039   2.049  -2.230
  736   HH11  ARG  86          HH11      ARG  86   6.692   2.332  -5.669
  737   HH12  ARG  86          HH12      ARG  86   7.734   3.706  -5.477
  738   HH21  ARG  86          HH21      ARG  86   7.413   3.860  -1.994
  739   HH22  ARG  86          HH22      ARG  86   8.138   4.578  -3.395
  740    HA   PRO  87           HA       PRO  87   5.317  -1.312  -8.270
  741    HB2  PRO  87           HB2      PRO  87   5.508   1.419  -9.332
  742    HB3  PRO  87           HB3      PRO  87   5.126  -0.083 -10.174
  743    HG2  PRO  87           HG2      PRO  87   3.267   1.823  -9.711
  744    HG3  PRO  87           HG3      PRO  87   2.873   0.095  -9.762
  745    HD2  PRO  87           HD2      PRO  87   3.213   1.895  -7.400
  746    HD3  PRO  87           HD3      PRO  87   2.054   0.574  -7.654
  747    H    LEU  88           H        LEU  88   7.003  -1.614  -6.932
  748    HA   LEU  88           HA       LEU  88   8.257   0.709  -5.663
  749    HB2  LEU  88           HB2      LEU  88   7.477  -1.245  -4.311
  750    HB3  LEU  88           HB3      LEU  88   8.665  -2.232  -5.135
  751    HG   LEU  88           HG       LEU  88  10.417  -0.619  -4.217
  752   HD11  LEU  88          HD11      LEU  88   8.103   0.118  -2.427
  753   HD12  LEU  88          HD12      LEU  88   9.788   0.581  -2.183
  754   HD13  LEU  88          HD13      LEU  88   8.901   1.185  -3.583
  755   HD21  LEU  88          HD21      LEU  88  10.434  -1.780  -2.053
  756   HD22  LEU  88          HD22      LEU  88   8.793  -2.351  -2.370
  757   HD23  LEU  88          HD23      LEU  88  10.123  -2.872  -3.403
  758    H    LYS  89           H        LYS  89   9.963   1.540  -6.706
  759    HA   LYS  89           HA       LYS  89  11.591  -0.204  -8.389
  760    HB2  LYS  89           HB2      LYS  89  11.280   2.771  -8.202
  761    HB3  LYS  89           HB3      LYS  89  12.748   2.094  -8.893
  762    HG2  LYS  89           HG2      LYS  89  11.387   2.479 -10.732
  763    HG3  LYS  89           HG3      LYS  89  11.194   0.755 -10.419
  764    HD2  LYS  89           HD2      LYS  89   9.017   1.492 -10.789
  765    HD3  LYS  89           HD3      LYS  89   9.143   1.453  -9.030
  766    HE2  LYS  89           HE2      LYS  89   8.047   3.497  -9.816
  767    HE3  LYS  89           HE3      LYS  89   9.565   3.848  -8.989
  768    HZ1  LYS  89           HZ1      LYS  89   9.076   5.033 -11.191
  769    HZ2  LYS  89           HZ2      LYS  89   9.478   3.560 -11.926
  770    HZ3  LYS  89           HZ3      LYS  89  10.622   4.369 -10.969
  771    H    ILE  90           H        ILE  90  13.415  -0.993  -7.719
  772    HA   ILE  90           HA       ILE  90  14.766   0.256  -5.414
  773    HB   ILE  90           HB       ILE  90  14.553  -2.727  -5.902
  774   HG12  ILE  90          HG12      ILE  90  12.410  -1.774  -5.136
  775   HG13  ILE  90          HG13      ILE  90  13.140  -2.792  -3.898
  776   HG21  ILE  90          HG21      ILE  90  16.644  -2.116  -4.853
  777   HG22  ILE  90          HG22      ILE  90  15.793  -1.160  -3.639
  778   HG23  ILE  90          HG23      ILE  90  15.600  -2.913  -3.675
  779   HD11  ILE  90          HD11      ILE  90  12.184  -0.787  -2.927
  780   HD12  ILE  90          HD12      ILE  90  13.937  -0.795  -2.733
  781   HD13  ILE  90          HD13      ILE  90  13.191   0.219  -3.969
  782    H    ARG  91           H        ARG  91  16.917   0.597  -5.719
  783    HA   ARG  91           HA       ARG  91  18.182  -0.792  -7.968
  784    HB2  ARG  91           HB2      ARG  91  18.065   1.745  -8.065
  785    HB3  ARG  91           HB3      ARG  91  19.126   1.762  -6.663
  786    HG2  ARG  91           HG2      ARG  91  20.873   0.681  -7.899
  787    HG3  ARG  91           HG3      ARG  91  19.809   0.477  -9.292
  788    HD2  ARG  91           HD2      ARG  91  20.695   3.116  -8.127
  789    HD3  ARG  91           HD3      ARG  91  21.359   2.363  -9.577
  790    HE   ARG  91           HE       ARG  91  18.717   3.595  -9.297
  791   HH11  ARG  91          HH11      ARG  91  21.036   1.912 -11.303
  792   HH12  ARG  91          HH12      ARG  91  20.299   2.404 -12.796
  793   HH21  ARG  91          HH21      ARG  91  17.730   4.250 -11.275
  794   HH22  ARG  91          HH22      ARG  91  18.431   3.721 -12.783
  795    H    MET  92           H        MET  92  19.429  -2.384  -7.329
  796    HA   MET  92           HA       MET  92  20.194  -2.556  -4.533
  797    HB2  MET  92           HB2      MET  92  20.909  -4.907  -5.191
  798    HB3  MET  92           HB3      MET  92  19.193  -4.545  -5.280
  799    HG2  MET  92           HG2      MET  92  20.405  -3.989  -7.810
  800    HG3  MET  92           HG3      MET  92  20.864  -5.598  -7.272
  801    HE1  MET  92           HE1      MET  92  17.546  -4.017  -6.050
  802    HE2  MET  92           HE2      MET  92  17.665  -3.237  -7.625
  803    HE3  MET  92           HE3      MET  92  16.400  -4.430  -7.324
  804    H    LEU  93           H        LEU  93  22.416  -4.111  -4.560
  805    HA   LEU  93           HA       LEU  93  24.261  -2.059  -4.282
  806    HB2  LEU  93           HB2      LEU  93  24.839  -5.012  -4.482
  807    HB3  LEU  93           HB3      LEU  93  25.931  -3.803  -3.848
  808    HG   LEU  93           HG       LEU  93  25.104  -4.735  -1.922
  809   HD11  LEU  93          HD11      LEU  93  24.758  -2.334  -1.830
  810   HD12  LEU  93          HD12      LEU  93  23.131  -2.533  -2.484
  811   HD13  LEU  93          HD13      LEU  93  23.530  -3.188  -0.896
  812   HD21  LEU  93          HD21      LEU  93  22.322  -4.853  -3.070
  813   HD22  LEU  93          HD22      LEU  93  23.469  -6.195  -3.076
  814   HD23  LEU  93          HD23      LEU  93  22.882  -5.540  -1.548
  815    H    ASP  94           H        ASP  94  23.950  -4.421  -6.899
  816    HA   ASP  94           HA       ASP  94  26.349  -3.784  -8.232
  817    HB2  ASP  94           HB2      ASP  94  25.059  -5.804  -8.741
  818    HB3  ASP  94           HB3      ASP  94  23.746  -4.819  -9.378
  819    H    GLY  95           H        GLY  95  23.461  -2.019  -7.903
  820    HA2  GLY  95           HA2      GLY  95  23.157   0.190  -8.750
  821    HA3  GLY  95           HA3      GLY  95  24.222  -0.213 -10.095
  822    H    THR  96           H        THR  96  22.176  -2.732  -9.380
  823    HA   THR  96           HA       THR  96  20.759  -2.412 -11.868
  824    HB   THR  96           HB       THR  96  20.446  -4.597  -9.798
  825    HG1  THR  96           HG1      THR  96  22.378  -4.191 -11.833
  826   HG21  THR  96          HG21      THR  96  19.718  -5.947 -11.709
  827   HG22  THR  96          HG22      THR  96  19.911  -4.553 -12.771
  828   HG23  THR  96          HG23      THR  96  18.689  -4.531 -11.499
  829    H    VAL  97           H        VAL  97  18.665  -1.806 -12.098
  830    HA   VAL  97           HA       VAL  97  17.171  -1.364  -9.604
  831    HB   VAL  97           HB       VAL  97  17.641   0.727 -10.777
  832   HG11  VAL  97          HG11      VAL  97  16.626   1.207 -12.950
  833   HG12  VAL  97          HG12      VAL  97  17.821  -0.086 -13.042
  834   HG13  VAL  97          HG13      VAL  97  16.101  -0.472 -13.064
  835   HG21  VAL  97          HG21      VAL  97  15.593   0.578  -9.489
  836   HG22  VAL  97          HG22      VAL  97  15.348   1.592 -10.912
  837   HG23  VAL  97          HG23      VAL  97  14.733  -0.060 -10.891
  838    H    LYS  98           H        LYS  98  15.175  -2.115  -9.392
  839    HA   LYS  98           HA       LYS  98  13.906  -3.531 -11.623
  840    HB2  LYS  98           HB2      LYS  98  13.521  -5.554 -10.444
  841    HB3  LYS  98           HB3      LYS  98  15.227  -5.198 -10.224
  842    HG2  LYS  98           HG2      LYS  98  14.922  -4.575  -7.983
  843    HG3  LYS  98           HG3      LYS  98  13.176  -4.424  -8.175
  844    HD2  LYS  98           HD2      LYS  98  14.720  -7.013  -8.362
  845    HD3  LYS  98           HD3      LYS  98  13.846  -6.479  -6.926
  846    HE2  LYS  98           HE2      LYS  98  12.253  -7.811  -7.861
  847    HE3  LYS  98           HE3      LYS  98  11.849  -6.290  -8.660
  848    HZ1  LYS  98           HZ1      LYS  98  12.975  -6.988 -10.621
  849    HZ2  LYS  98           HZ2      LYS  98  11.965  -8.264 -10.152
  850    HZ3  LYS  98           HZ3      LYS  98  13.632  -8.350  -9.851
  851    H    THR  99           H        THR  99  11.596  -3.800 -11.351
  852    HA   THR  99           HA       THR  99  10.514  -2.185  -9.148
  853    HB   THR  99           HB       THR  99   9.168  -2.729 -11.800
  854    HG1  THR  99           HG1      THR  99  11.195  -1.288 -11.686
  855   HG21  THR  99          HG21      THR  99   7.685  -2.259  -9.906
  856   HG22  THR  99          HG22      THR  99   7.654  -0.957 -11.096
  857   HG23  THR  99          HG23      THR  99   8.561  -0.761  -9.596
  858    H    ILE 100           H        ILE 100   9.518  -3.366  -7.673
  859    HA   ILE 100           HA       ILE 100   8.274  -5.894  -8.508
  860    HB   ILE 100           HB       ILE 100  10.418  -6.279  -7.324
  861   HG12  ILE 100          HG12      ILE 100   8.197  -7.704  -7.071
  862   HG13  ILE 100          HG13      ILE 100   9.662  -8.113  -6.192
  863   HG21  ILE 100          HG21      ILE 100  10.494  -4.340  -5.906
  864   HG22  ILE 100          HG22      ILE 100   9.080  -4.896  -5.010
  865   HG23  ILE 100          HG23      ILE 100  10.593  -5.798  -4.920
  866   HD11  ILE 100          HD11      ILE 100   8.779  -6.982  -4.213
  867   HD12  ILE 100          HD12      ILE 100   7.306  -6.592  -5.101
  868   HD13  ILE 100          HD13      ILE 100   7.716  -8.275  -4.767
  869    H    MET 101           H        MET 101   6.320  -6.411  -7.450
  870    HA   MET 101           HA       MET 101   4.987  -4.068  -6.379
  871    HB2  MET 101           HB2      MET 101   3.913  -6.818  -7.035
  872    HB3  MET 101           HB3      MET 101   2.941  -5.421  -6.597
  873    HG2  MET 101           HG2      MET 101   4.646  -5.722  -9.056
  874    HG3  MET 101           HG3      MET 101   2.885  -5.760  -8.978
  875    HE1  MET 101           HE1      MET 101   2.784  -3.341  -6.596
  876    HE2  MET 101           HE2      MET 101   2.242  -2.051  -7.671
  877    HE3  MET 101           HE3      MET 101   1.549  -3.669  -7.818
  878    H    VAL 102           H        VAL 102   5.071  -3.674  -4.338
  879    HA   VAL 102           HA       VAL 102   4.871  -5.896  -2.398
  880    HB   VAL 102           HB       VAL 102   6.289  -3.469  -1.508
  881   HG11  VAL 102          HG11      VAL 102   5.992  -5.351  -0.028
  882   HG12  VAL 102          HG12      VAL 102   6.787  -6.421  -1.182
  883   HG13  VAL 102          HG13      VAL 102   7.703  -5.141  -0.390
  884   HG21  VAL 102          HG21      VAL 102   8.426  -4.218  -2.500
  885   HG22  VAL 102          HG22      VAL 102   7.518  -5.363  -3.489
  886   HG23  VAL 102          HG23      VAL 102   7.257  -3.628  -3.684
  887    H    ASP 103           H        ASP 103   3.551  -5.619  -0.708
  888    HA   ASP 103           HA       ASP 103   1.485  -3.746  -0.743
  889    HB2  ASP 103           HB2      ASP 103   1.283  -5.842   0.457
  890    HB3  ASP 103           HB3      ASP 103   2.603  -5.400   1.535
  891    H    ASP 104           H        ASP 104   1.496  -1.629  -0.325
  892    HA   ASP 104           HA       ASP 104   3.748  -0.551   1.202
  893    HB2  ASP 104           HB2      ASP 104   3.140   1.632   0.335
  894    HB3  ASP 104           HB3      ASP 104   3.257   0.484  -0.987
  895    H    SER 105           H        SER 105   0.827  -1.747   1.888
  896    HA   SER 105           HA       SER 105  -0.186   0.229   3.683
  897    HB2  SER 105           HB2      SER 105  -0.653  -2.745   3.850
  898    HB3  SER 105           HB3      SER 105  -1.718  -1.450   4.393
  899    HG   SER 105           HG       SER 105  -1.277  -1.012   1.847
  900    H    LYS 106           H        LYS 106   2.130  -2.398   3.972
  901    HA   LYS 106           HA       LYS 106   2.176  -2.145   6.867
  902    HB2  LYS 106           HB2      LYS 106   3.834  -4.053   6.704
  903    HB3  LYS 106           HB3      LYS 106   2.192  -4.384   6.213
  904    HG2  LYS 106           HG2      LYS 106   3.771  -5.456   4.735
  905    HG3  LYS 106           HG3      LYS 106   2.861  -4.221   3.870
  906    HD2  LYS 106           HD2      LYS 106   4.705  -2.814   3.712
  907    HD3  LYS 106           HD3      LYS 106   5.536  -3.600   5.056
  908    HE2  LYS 106           HE2      LYS 106   6.413  -4.066   2.712
  909    HE3  LYS 106           HE3      LYS 106   6.130  -5.453   3.760
  910    HZ1  LYS 106           HZ1      LYS 106   4.298  -4.481   1.638
  911    HZ2  LYS 106           HZ2      LYS 106   4.014  -5.813   2.651
  912    HZ3  LYS 106           HZ3      LYS 106   5.293  -5.853   1.542
  913    H    THR 107           H        THR 107   4.713  -2.717   7.576
  914    HA   THR 107           HA       THR 107   5.950  -0.134   7.220
  915    HB   THR 107           HB       THR 107   7.498  -0.951   9.014
  916    HG1  THR 107           HG1      THR 107   6.311  -2.964  10.039
  917   HG21  THR 107          HG21      THR 107   4.541  -1.172   9.592
  918   HG22  THR 107          HG22      THR 107   5.487   0.317   9.576
  919   HG23  THR 107          HG23      THR 107   5.804  -0.917  10.796
  920    H    VAL 108           H        VAL 108   8.584  -0.564   7.576
  921    HA   VAL 108           HA       VAL 108   9.404  -1.030   4.909
  922    HB   VAL 108           HB       VAL 108  11.141  -0.707   7.352
  923   HG11  VAL 108          HG11      VAL 108  11.681  -0.136   4.442
  924   HG12  VAL 108          HG12      VAL 108  12.784   0.183   5.780
  925   HG13  VAL 108          HG13      VAL 108  12.342  -1.477   5.377
  926   HG21  VAL 108          HG21      VAL 108   9.505   1.088   7.242
  927   HG22  VAL 108          HG22      VAL 108  11.113   1.693   6.844
  928   HG23  VAL 108          HG23      VAL 108   9.938   1.401   5.562
  929    H    THR 109           H        THR 109  10.301  -2.680   7.911
  930    HA   THR 109           HA       THR 109  12.200  -4.391   7.032
  931    HB   THR 109           HB       THR 109  10.136  -5.110   9.108
  932    HG1  THR 109           HG1      THR 109  11.289  -3.830  10.482
  933   HG21  THR 109          HG21      THR 109  11.652  -6.947   8.521
  934   HG22  THR 109          HG22      THR 109  11.999  -6.338  10.140
  935   HG23  THR 109          HG23      THR 109  13.041  -5.893   8.788
  936    H    ASP 110           H        ASP 110   8.732  -5.306   7.210
  937    HA   ASP 110           HA       ASP 110   8.942  -7.865   6.174
  938    HB2  ASP 110           HB2      ASP 110   6.857  -7.002   7.097
  939    HB3  ASP 110           HB3      ASP 110   6.716  -5.849   5.774
  940    H    MET 111           H        MET 111   8.597  -4.815   4.446
  941    HA   MET 111           HA       MET 111   8.482  -5.896   1.840
  942    HB2  MET 111           HB2      MET 111   7.692  -3.693   2.147
  943    HB3  MET 111           HB3      MET 111   9.172  -3.187   2.945
  944    HG2  MET 111           HG2      MET 111  10.367  -3.430   0.795
  945    HG3  MET 111           HG3      MET 111   8.833  -3.820   0.036
  946    HE1  MET 111           HE1      MET 111   8.705  -1.508   2.958
  947    HE2  MET 111           HE2      MET 111  10.373  -1.201   2.475
  948    HE3  MET 111           HE3      MET 111   9.164   0.080   2.335
  949    H    LEU 112           H        LEU 112  11.158  -4.704   3.826
  950    HA   LEU 112           HA       LEU 112  13.200  -4.861   1.917
  951    HB2  LEU 112           HB2      LEU 112  13.244  -3.881   4.291
  952    HB3  LEU 112           HB3      LEU 112  13.574  -5.515   4.831
  953    HG   LEU 112           HG       LEU 112  15.621  -5.510   3.363
  954   HD11  LEU 112          HD11      LEU 112  14.924  -3.752   1.822
  955   HD12  LEU 112          HD12      LEU 112  14.936  -2.578   3.140
  956   HD13  LEU 112          HD13      LEU 112  16.443  -3.327   2.612
  957   HD21  LEU 112          HD21      LEU 112  15.437  -3.382   5.496
  958   HD22  LEU 112          HD22      LEU 112  15.743  -5.099   5.764
  959   HD23  LEU 112          HD23      LEU 112  16.923  -4.119   4.893
  960    H    MET 113           H        MET 113  11.831  -7.268   4.073
  961    HA   MET 113           HA       MET 113  13.560  -9.420   3.516
  962    HB2  MET 113           HB2      MET 113  11.939  -9.368   5.385
  963    HB3  MET 113           HB3      MET 113  10.617  -9.450   4.229
  964    HG2  MET 113           HG2      MET 113  11.575 -11.649   3.462
  965    HG3  MET 113           HG3      MET 113  12.648 -11.568   4.858
  966    HE1  MET 113           HE1      MET 113  11.722 -11.432   7.400
  967    HE2  MET 113           HE2      MET 113  10.646 -10.106   6.956
  968    HE3  MET 113           HE3      MET 113  10.008 -11.513   7.807
  969    H    THR 114           H        THR 114  10.686  -8.206   1.981
  970    HA   THR 114           HA       THR 114  10.359 -10.340   0.131
  971    HB   THR 114           HB       THR 114   9.196  -7.563   0.284
  972    HG1  THR 114           HG1      THR 114   8.258 -10.197   0.835
  973   HG21  THR 114          HG21      THR 114   9.256  -8.211  -2.080
  974   HG22  THR 114          HG22      THR 114   7.605  -8.247  -1.462
  975   HG23  THR 114          HG23      THR 114   8.494  -9.753  -1.685
  976    H    ILE 115           H        ILE 115  12.036  -7.200  -0.028
  977    HA   ILE 115           HA       ILE 115  12.304  -7.192  -2.862
  978    HB   ILE 115           HB       ILE 115  13.970  -5.727  -0.810
  979   HG12  ILE 115          HG12      ILE 115  11.571  -4.723  -2.354
  980   HG13  ILE 115          HG13      ILE 115  11.505  -5.276  -0.683
  981   HG21  ILE 115          HG21      ILE 115  15.049  -5.811  -2.975
  982   HG22  ILE 115          HG22      ILE 115  13.573  -5.251  -3.761
  983   HG23  ILE 115          HG23      ILE 115  14.451  -4.181  -2.666
  984   HD11  ILE 115          HD11      ILE 115  13.059  -3.510  -0.038
  985   HD12  ILE 115          HD12      ILE 115  13.121  -2.955  -1.712
  986   HD13  ILE 115          HD13      ILE 115  11.611  -2.857  -0.805
  987    H    CYS 116           H        CYS 116  14.517  -8.000  -0.202
  988    HA   CYS 116           HA       CYS 116  16.734  -8.611  -1.827
  989    HB2  CYS 116           HB2      CYS 116  16.112  -9.735   0.913
  990    HB3  CYS 116           HB3      CYS 116  17.699  -9.614   0.153
  991    HG   CYS 116           HG       CYS 116  15.775  -7.085   1.398
  992    H    ALA 117           H        ALA 117  13.925 -10.423  -0.902
  993    HA   ALA 117           HA       ALA 117  14.920 -12.994  -1.625
  994    HB1  ALA 117           HB1      ALA 117  13.046 -12.718  -0.078
  995    HB2  ALA 117           HB2      ALA 117  12.074 -12.032  -1.380
  996    HB3  ALA 117           HB3      ALA 117  12.599 -13.713  -1.463
  997    H    ARG 118           H        ARG 118  13.446 -10.333  -3.342
  998    HA   ARG 118           HA       ARG 118  12.641 -11.779  -5.643
  999    HB2  ARG 118           HB2      ARG 118  13.439  -8.849  -5.520
 1000    HB3  ARG 118           HB3      ARG 118  12.500  -9.635  -6.782
 1001    HG2  ARG 118           HG2      ARG 118  11.658  -9.222  -3.927
 1002    HG3  ARG 118           HG3      ARG 118  11.035  -8.391  -5.352
 1003    HD2  ARG 118           HD2      ARG 118  10.805 -11.344  -4.802
 1004    HD3  ARG 118           HD3      ARG 118   9.522 -10.157  -4.574
 1005    HE   ARG 118           HE       ARG 118  10.708 -10.539  -7.243
 1006   HH11  ARG 118          HH11      ARG 118   7.942 -10.736  -5.082
 1007   HH12  ARG 118          HH12      ARG 118   6.801 -10.999  -6.368
 1008   HH21  ARG 118          HH21      ARG 118   9.191 -10.876  -8.933
 1009   HH22  ARG 118          HH22      ARG 118   7.504 -11.050  -8.547
 1010    H    ILE 119           H        ILE 119  15.631 -10.147  -4.729
 1011    HA   ILE 119           HA       ILE 119  16.919 -10.647  -7.238
 1012    HB   ILE 119           HB       ILE 119  18.502 -10.211  -4.738
 1013   HG12  ILE 119          HG12      ILE 119  16.657  -8.655  -4.441
 1014   HG13  ILE 119          HG13      ILE 119  18.115  -7.769  -4.883
 1015   HG21  ILE 119          HG21      ILE 119  19.642 -10.457  -6.870
 1016   HG22  ILE 119          HG22      ILE 119  18.702  -9.125  -7.542
 1017   HG23  ILE 119          HG23      ILE 119  19.853  -8.822  -6.240
 1018   HD11  ILE 119          HD11      ILE 119  17.305  -7.581  -7.173
 1019   HD12  ILE 119          HD12      ILE 119  15.843  -8.464  -6.729
 1020   HD13  ILE 119          HD13      ILE 119  16.170  -6.883  -6.018
 1021    H    GLY 120           H        GLY 120  16.848 -12.144  -4.056
 1022    HA2  GLY 120           HA2      GLY 120  17.077 -14.584  -3.955
 1023    HA3  GLY 120           HA3      GLY 120  18.339 -14.432  -5.168
 1024    H    ILE 121           H        ILE 121  18.082 -12.142  -2.588
 1025    HA   ILE 121           HA       ILE 121  20.735 -12.847  -1.662
 1026    HB   ILE 121           HB       ILE 121  18.869 -10.668  -0.701
 1027   HG12  ILE 121          HG12      ILE 121  21.201 -10.508  -2.628
 1028   HG13  ILE 121          HG13      ILE 121  19.504 -10.426  -3.086
 1029   HG21  ILE 121          HG21      ILE 121  20.538 -11.256   0.959
 1030   HG22  ILE 121          HG22      ILE 121  21.818 -11.082  -0.243
 1031   HG23  ILE 121          HG23      ILE 121  20.890  -9.672   0.266
 1032   HD11  ILE 121          HD11      ILE 121  20.508  -8.217  -3.030
 1033   HD12  ILE 121          HD12      ILE 121  19.257  -8.365  -1.796
 1034   HD13  ILE 121          HD13      ILE 121  20.959  -8.448  -1.341
 1035    H    THR 122           H        THR 122  17.420 -13.014  -0.569
 1036    HA   THR 122           HA       THR 122  16.397 -14.193   1.073
 1037    HB   THR 122           HB       THR 122  19.120 -15.349   1.699
 1038    HG1  THR 122           HG1      THR 122  18.745 -16.747   0.122
 1039   HG21  THR 122          HG21      THR 122  17.855 -17.178   2.730
 1040   HG22  THR 122          HG22      THR 122  16.346 -16.330   2.392
 1041   HG23  THR 122          HG23      THR 122  17.510 -15.642   3.525
 1042    H    ASN 123           H        ASN 123  19.601 -13.258   2.386
 1043    HA   ASN 123           HA       ASN 123  18.481 -12.503   4.910
 1044    HB2  ASN 123           HB2      ASN 123  20.914 -13.229   4.424
 1045    HB3  ASN 123           HB3      ASN 123  21.157 -11.574   3.871
 1046   HD21  ASN 123          HD21      ASN 123  22.559 -10.972   5.489
 1047   HD22  ASN 123          HD22      ASN 123  22.071 -10.842   7.152
 1048    H    HIS 124           H        HIS 124  18.028 -10.414   5.680
 1049    HA   HIS 124           HA       HIS 124  18.220  -8.262   3.699
 1050    HB2  HIS 124           HB2      HIS 124  15.901  -7.609   3.982
 1051    HB3  HIS 124           HB3      HIS 124  15.995  -9.272   3.419
 1052    HD1  HIS 124           HD1      HIS 124  14.556  -7.187   6.036
 1053    HD2  HIS 124           HD2      HIS 124  15.452 -11.210   5.540
 1054    HE1  HIS 124           HE1      HIS 124  13.159  -8.401   7.730
 1055    HE2  HIS 124           HE2      HIS 124  13.888 -10.808   7.564
 1056    H    ASP 125           H        ASP 125  18.514  -9.252   6.911
 1057    HA   ASP 125           HA       ASP 125  17.813  -6.762   8.137
 1058    HB2  ASP 125           HB2      ASP 125  19.315  -9.161   9.189
 1059    HB3  ASP 125           HB3      ASP 125  18.920  -7.749  10.165
 1060    H    GLU 126           H        GLU 126  20.472  -7.839   6.387
 1061    HA   GLU 126           HA       GLU 126  22.395  -6.134   7.724
 1062    HB2  GLU 126           HB2      GLU 126  23.954  -6.936   5.940
 1063    HB3  GLU 126           HB3      GLU 126  23.260  -8.219   6.920
 1064    HG2  GLU 126           HG2      GLU 126  21.734  -8.811   5.173
 1065    HG3  GLU 126           HG3      GLU 126  22.219  -7.415   4.216
 1066    H    TYR 127           H        TYR 127  19.927  -5.576   5.673
 1067    HA   TYR 127           HA       TYR 127  21.364  -3.430   4.254
 1068    HB2  TYR 127           HB2      TYR 127  18.811  -4.808   3.398
 1069    HB3  TYR 127           HB3      TYR 127  19.682  -3.565   2.500
 1070    HD1  TYR 127           HD1      TYR 127  22.195  -4.136   2.006
 1071    HD2  TYR 127           HD2      TYR 127  19.186  -6.996   2.882
 1072    HE1  TYR 127           HE1      TYR 127  23.509  -5.848   0.859
 1073    HE2  TYR 127           HE2      TYR 127  20.477  -8.726   1.743
 1074    HH   TYR 127           HH       TYR 127  22.260  -8.688  -0.192
 1075    H    SER 128           H        SER 128  20.452  -1.403   4.170
 1076    HA   SER 128           HA       SER 128  17.955  -1.047   5.692
 1077    HB2  SER 128           HB2      SER 128  20.276   0.890   5.435
 1078    HB3  SER 128           HB3      SER 128  18.772   1.195   6.307
 1079    HG   SER 128           HG       SER 128  19.341  -0.728   7.574
 1080    H    LEU 129           H        LEU 129  16.421   0.335   4.780
 1081    HA   LEU 129           HA       LEU 129  16.705   0.566   1.900
 1082    HB2  LEU 129           HB2      LEU 129  14.639  -0.293   3.321
 1083    HB3  LEU 129           HB3      LEU 129  14.237   1.415   3.359
 1084    HG   LEU 129           HG       LEU 129  14.729  -0.074   0.779
 1085   HD11  LEU 129          HD11      LEU 129  12.303  -0.275   0.567
 1086   HD12  LEU 129          HD12      LEU 129  12.915  -1.183   1.949
 1087   HD13  LEU 129          HD13      LEU 129  12.109   0.366   2.198
 1088   HD21  LEU 129          HD21      LEU 129  13.447   1.756  -0.198
 1089   HD22  LEU 129          HD22      LEU 129  13.269   2.492   1.396
 1090   HD23  LEU 129          HD23      LEU 129  14.866   2.361   0.658
 1091    H    VAL 130           H        VAL 130  16.858   2.443   0.811
 1092    HA   VAL 130           HA       VAL 130  16.687   4.948   2.330
 1093    HB   VAL 130           HB       VAL 130  19.030   4.491   2.358
 1094   HG11  VAL 130          HG11      VAL 130  19.115   2.772   0.671
 1095   HG12  VAL 130          HG12      VAL 130  18.831   3.970  -0.591
 1096   HG13  VAL 130          HG13      VAL 130  20.324   4.015   0.344
 1097   HG21  VAL 130          HG21      VAL 130  19.990   6.291   1.020
 1098   HG22  VAL 130          HG22      VAL 130  18.492   6.403   0.096
 1099   HG23  VAL 130          HG23      VAL 130  18.499   6.798   1.815
 1100    H    ARG 131           H        ARG 131  15.289   6.231   1.345
 1101    HA   ARG 131           HA       ARG 131  14.596   5.689  -1.454
 1102    HB2  ARG 131           HB2      ARG 131  13.256   7.465   0.593
 1103    HB3  ARG 131           HB3      ARG 131  12.642   7.112  -1.010
 1104    HG2  ARG 131           HG2      ARG 131  12.153   4.880  -0.435
 1105    HG3  ARG 131           HG3      ARG 131  13.078   4.991   1.067
 1106    HD2  ARG 131           HD2      ARG 131  10.527   5.159   1.233
 1107    HD3  ARG 131           HD3      ARG 131  11.486   6.367   2.085
 1108    HE   ARG 131           HE       ARG 131  10.525   7.056  -0.581
 1109   HH11  ARG 131          HH11      ARG 131  10.174   7.326   2.885
 1110   HH12  ARG 131          HH12      ARG 131   9.269   8.806   2.832
 1111   HH21  ARG 131          HH21      ARG 131   9.282   9.013  -0.680
 1112   HH22  ARG 131          HH22      ARG 131   8.729   9.747   0.786
 1113    H    GLU 132           H        GLU 132  16.155   6.778  -2.658
 1114    HA   GLU 132           HA       GLU 132  16.579   9.581  -2.181
 1115    HB2  GLU 132           HB2      GLU 132  17.368   7.826  -4.518
 1116    HB3  GLU 132           HB3      GLU 132  17.774   9.530  -4.398
 1117    HG2  GLU 132           HG2      GLU 132  18.898   8.912  -2.181
 1118    HG3  GLU 132           HG3      GLU 132  18.762   7.242  -2.745
 1119    H    LEU 133           H        LEU 133  15.109  11.067  -2.670
 1120    HA   LEU 133           HA       LEU 133  13.066  10.283  -4.612
 1121    HB2  LEU 133           HB2      LEU 133  12.791  12.483  -2.598
 1122    HB3  LEU 133           HB3      LEU 133  11.531  11.668  -3.495
 1123    HG   LEU 133           HG       LEU 133  13.147  10.521  -1.226
 1124   HD11  LEU 133          HD11      LEU 133  10.921  10.408  -0.167
 1125   HD12  LEU 133          HD12      LEU 133  11.442  12.057  -0.525
 1126   HD13  LEU 133          HD13      LEU 133  10.254  11.265  -1.561
 1127   HD21  LEU 133          HD21      LEU 133  11.747   8.532  -1.464
 1128   HD22  LEU 133          HD22      LEU 133  11.013   9.216  -2.913
 1129   HD23  LEU 133          HD23      LEU 133  12.726   8.799  -2.907
 1130    H    MET 134           H        MET 134  11.860  12.348  -5.294
 1131    HA   MET 134           HA       MET 134  13.777  14.274  -6.446
 1132    HB2  MET 134           HB2      MET 134  12.109  14.523  -8.251
 1133    HB3  MET 134           HB3      MET 134  12.619  12.841  -8.100
 1134    HG2  MET 134           HG2      MET 134  10.382  12.493  -8.177
 1135    HG3  MET 134           HG3      MET 134  10.553  12.768  -6.445
 1136    HE1  MET 134           HE1      MET 134   8.372  13.685  -5.644
 1137    HE2  MET 134           HE2      MET 134   7.298  14.699  -6.610
 1138    HE3  MET 134           HE3      MET 134   7.710  13.077  -7.162
 1139    H    GLU 135           H        GLU 135  11.755  13.863  -4.004
 1140    HA   GLU 135           HA       GLU 135   9.609  15.595  -4.328
 1141    HB2  GLU 135           HB2      GLU 135  10.947  14.387  -1.950
 1142    HB3  GLU 135           HB3      GLU 135   9.625  15.526  -1.743
 1143    HG2  GLU 135           HG2      GLU 135   8.337  13.962  -3.340
 1144    HG3  GLU 135           HG3      GLU 135   9.601  12.791  -2.938
 1145    H    GLU 136           H        GLU 136   9.541  17.718  -4.463
 1146    HA   GLU 136           HA       GLU 136  11.404  19.494  -3.240
 1147    HB2  GLU 136           HB2      GLU 136   9.738  21.218  -3.772
 1148    HB3  GLU 136           HB3      GLU 136   9.985  20.144  -5.143
 1149    HG2  GLU 136           HG2      GLU 136   7.940  18.956  -4.620
 1150    HG3  GLU 136           HG3      GLU 136   7.699  19.963  -3.194
 1151    H    LYS 137           H        LYS 137   8.810  17.600  -2.164
 1152    HA   LYS 137           HA       LYS 137   8.114  19.193   0.140
 1153    HB2  LYS 137           HB2      LYS 137   7.310  16.361  -0.557
 1154    HB3  LYS 137           HB3      LYS 137   6.542  17.408   0.630
 1155    HG2  LYS 137           HG2      LYS 137   5.734  18.869  -1.080
 1156    HG3  LYS 137           HG3      LYS 137   6.669  18.020  -2.313
 1157    HD2  LYS 137           HD2      LYS 137   5.332  15.993  -1.893
 1158    HD3  LYS 137           HD3      LYS 137   4.371  16.891  -0.715
 1159    HE2  LYS 137           HE2      LYS 137   3.664  18.439  -2.466
 1160    HE3  LYS 137           HE3      LYS 137   4.640  17.564  -3.644
 1161    HZ1  LYS 137           HZ1      LYS 137   3.256  15.648  -3.385
 1162    HZ2  LYS 137           HZ2      LYS 137   2.255  16.981  -3.689
 1163    HZ3  LYS 137           HZ3      LYS 137   2.392  16.367  -2.114
 1164    H    LYS 138           H        LYS 138   9.038  15.750  -0.068
 1165    HA   LYS 138           HA       LYS 138  10.132  15.586   2.495
 1166    HB2  LYS 138           HB2      LYS 138   9.515  13.778   0.671
 1167    HB3  LYS 138           HB3      LYS 138  11.219  13.921   0.268
 1168    HG2  LYS 138           HG2      LYS 138  11.081  12.128   1.749
 1169    HG3  LYS 138           HG3      LYS 138  11.680  13.478   2.719
 1170    HD2  LYS 138           HD2      LYS 138   9.977  12.314   3.955
 1171    HD3  LYS 138           HD3      LYS 138   9.375  13.903   3.480
 1172    HE2  LYS 138           HE2      LYS 138   8.832  11.617   1.668
 1173    HE3  LYS 138           HE3      LYS 138   7.919  11.682   3.176
 1174    HZ1  LYS 138           HZ1      LYS 138   7.415  14.084   2.440
 1175    HZ2  LYS 138           HZ2      LYS 138   6.603  12.820   1.658
 1176    HZ3  LYS 138           HZ3      LYS 138   7.914  13.575   0.895
 1177    H    ASP 169           H        ASP 169  11.976  15.372  -0.506
 1178    HA   ASP 169           HA       ASP 169  14.158  15.545  -0.954
 1179    HB2  ASP 169           HB2      ASP 169  13.635  17.965  -0.886
 1180    HB3  ASP 169           HB3      ASP 169  14.075  17.990   0.821
 1181    H    GLU 170           H        GLU 170  14.549  13.640   0.089
 1182    HA   GLU 170           HA       GLU 170  16.544  13.871   2.149
 1183    HB2  GLU 170           HB2      GLU 170  13.867  12.638   2.671
 1184    HB3  GLU 170           HB3      GLU 170  15.285  11.923   3.404
 1185    HG2  GLU 170           HG2      GLU 170  15.779  14.257   4.308
 1186    HG3  GLU 170           HG3      GLU 170  14.113  14.630   3.860
 1187    H    LEU 171           H        LEU 171  17.829  12.028   2.327
 1188    HA   LEU 171           HA       LEU 171  17.902  10.152   0.189
 1189    HB2  LEU 171           HB2      LEU 171  19.124   9.884   2.940
 1190    HB3  LEU 171           HB3      LEU 171  19.604   9.017   1.492
 1191    HG   LEU 171           HG       LEU 171  19.909  11.966   1.986
 1192   HD11  LEU 171          HD11      LEU 171  22.301  11.487   1.943
 1193   HD12  LEU 171          HD12      LEU 171  21.493  10.599   3.236
 1194   HD13  LEU 171          HD13      LEU 171  21.956   9.768   1.749
 1195   HD21  LEU 171          HD21      LEU 171  20.602  10.270  -0.405
 1196   HD22  LEU 171          HD22      LEU 171  19.414  11.577  -0.336
 1197   HD23  LEU 171          HD23      LEU 171  21.136  11.936  -0.168
 1198    H    ASN 172           H        ASN 172  16.331  10.407   3.178
 1199    HA   ASN 172           HA       ASN 172  14.813   9.166   4.306
 1200    HB2  ASN 172           HB2      ASN 172  14.326   8.404   1.454
 1201    HB3  ASN 172           HB3      ASN 172  13.390   7.657   2.733
 1202   HD21  ASN 172          HD21      ASN 172  13.790  10.342   0.735
 1203   HD22  ASN 172          HD22      ASN 172  12.552  11.340   1.414
 1204    H    TRP 173           H        TRP 173  16.648   8.008   5.373
 1205    HA   TRP 173           HA       TRP 173  17.071   5.288   4.455
 1206    HB2  TRP 173           HB2      TRP 173  18.185   6.982   6.686
 1207    HB3  TRP 173           HB3      TRP 173  18.374   5.233   6.713
 1208    HD1  TRP 173           HD1      TRP 173  19.243   8.207   4.365
 1209    HE1  TRP 173           HE1      TRP 173  21.448   7.648   3.177
 1210    HE3  TRP 173           HE3      TRP 173  19.985   3.498   6.212
 1211    HZ2  TRP 173           HZ2      TRP 173  23.273   5.501   3.045
 1212    HZ3  TRP 173           HZ3      TRP 173  21.992   2.260   5.507
 1213    HH2  TRP 173           HH2      TRP 173  23.600   3.244   3.956
 1214    H    LEU 174           H        LEU 174  15.327   4.055   4.806
 1215    HA   LEU 174           HA       LEU 174  13.171   4.889   6.331
 1216    HB2  LEU 174           HB2      LEU 174  13.845   2.174   5.248
 1217    HB3  LEU 174           HB3      LEU 174  12.338   2.523   6.074
 1218    HG   LEU 174           HG       LEU 174  13.287   3.516   3.412
 1219   HD11  LEU 174          HD11      LEU 174  10.746   2.256   4.438
 1220   HD12  LEU 174          HD12      LEU 174  11.003   2.804   2.776
 1221   HD13  LEU 174          HD13      LEU 174  11.979   1.491   3.437
 1222   HD21  LEU 174          HD21      LEU 174  11.149   4.752   5.141
 1223   HD22  LEU 174          HD22      LEU 174  12.635   5.522   4.590
 1224   HD23  LEU 174          HD23      LEU 174  11.378   5.094   3.425
 1225    H    ASP 175           H        ASP 175  12.438   4.611   8.224
 1226    HA   ASP 175           HA       ASP 175  14.230   4.054  10.348
 1227    HB2  ASP 175           HB2      ASP 175  12.090   4.476  11.729
 1228    HB3  ASP 175           HB3      ASP 175  12.711   5.795  10.742
 1229    H    HIS 176           H        HIS 176  11.885   2.147   8.697
 1230    HA   HIS 176           HA       HIS 176  11.220  -0.025   8.901
 1231    HB2  HIS 176           HB2      HIS 176  13.406  -0.080  10.977
 1232    HB3  HIS 176           HB3      HIS 176  12.379  -1.474  10.671
 1233    HD1  HIS 176           HD1      HIS 176  12.792  -2.808   8.554
 1234    HD2  HIS 176           HD2      HIS 176  15.277   0.496   8.958
 1235    HE1  HIS 176           HE1      HIS 176  14.545  -3.055   6.766
 1236    HE2  HIS 176           HE2      HIS 176  16.231  -1.261   7.324
 1237    H    GLY 177           H        GLY 177  10.138   2.267  10.486
 1238    HA2  GLY 177           HA2      GLY 177   8.817   0.652  12.590
 1239    HA3  GLY 177           HA3      GLY 177   9.254   2.338  12.828
 1240    H    ARG 178           H        ARG 178   8.485   3.305  10.291
 1241    HA   ARG 178           HA       ARG 178   5.592   3.334  10.700
 1242    HB2  ARG 178           HB2      ARG 178   7.485   5.082   9.162
 1243    HB3  ARG 178           HB3      ARG 178   5.746   5.184   8.928
 1244    HG2  ARG 178           HG2      ARG 178   5.423   5.814  11.216
 1245    HG3  ARG 178           HG3      ARG 178   7.137   5.559  11.567
 1246    HD2  ARG 178           HD2      ARG 178   6.001   7.582   9.640
 1247    HD3  ARG 178           HD3      ARG 178   6.647   7.926  11.244
 1248    HE   ARG 178           HE       ARG 178   8.588   6.549   9.760
 1249   HH11  ARG 178          HH11      ARG 178   6.980   9.667   9.721
 1250   HH12  ARG 178          HH12      ARG 178   8.373  10.516   9.115
 1251   HH21  ARG 178          HH21      ARG 178  10.407   7.640   8.976
 1252   HH22  ARG 178          HH22      ARG 178  10.335   9.364   8.696
 1253    H    THR 179           H        THR 179   4.179   3.396   8.858
 1254    HA   THR 179           HA       THR 179   4.837   1.429   6.836
 1255    HB   THR 179           HB       THR 179   2.630   1.182   7.520
 1256    HG1  THR 179           HG1      THR 179   1.904   1.173   5.552
 1257   HG21  THR 179          HG21      THR 179   1.032   3.001   7.820
 1258   HG22  THR 179          HG22      THR 179   2.255   4.166   7.306
 1259   HG23  THR 179          HG23      THR 179   2.475   3.261   8.804
 1260    H    LEU 180           H        LEU 180   4.443   1.924   4.544
 1261    HA   LEU 180           HA       LEU 180   6.182   4.025   3.784
 1262    HB2  LEU 180           HB2      LEU 180   4.351   2.526   1.929
 1263    HB3  LEU 180           HB3      LEU 180   5.941   3.187   1.589
 1264    HG   LEU 180           HG       LEU 180   5.341   0.810   3.350
 1265   HD11  LEU 180          HD11      LEU 180   6.593   1.034   0.627
 1266   HD12  LEU 180          HD12      LEU 180   6.620  -0.422   1.625
 1267   HD13  LEU 180          HD13      LEU 180   5.082   0.230   1.055
 1268   HD21  LEU 180          HD21      LEU 180   7.744   0.533   3.527
 1269   HD22  LEU 180          HD22      LEU 180   7.999   2.012   2.599
 1270   HD23  LEU 180          HD23      LEU 180   7.241   2.089   4.189
 1271    H    ARG 181           H        ARG 181   2.709   3.608   3.751
 1272    HA   ARG 181           HA       ARG 181   2.127   5.936   2.216
 1273    HB2  ARG 181           HB2      ARG 181   0.667   3.910   2.484
 1274    HB3  ARG 181           HB3      ARG 181   0.329   4.429   4.124
 1275    HG2  ARG 181           HG2      ARG 181  -0.230   6.302   1.876
 1276    HG3  ARG 181           HG3      ARG 181  -1.326   4.950   2.170
 1277    HD2  ARG 181           HD2      ARG 181  -0.582   7.168   4.064
 1278    HD3  ARG 181           HD3      ARG 181  -2.166   6.833   3.363
 1279    HE   ARG 181           HE       ARG 181  -1.654   4.566   4.702
 1280   HH11  ARG 181          HH11      ARG 181  -1.617   7.938   5.608
 1281   HH12  ARG 181          HH12      ARG 181  -1.805   7.629   7.306
 1282   HH21  ARG 181          HH21      ARG 181  -1.915   4.129   6.939
 1283   HH22  ARG 181          HH22      ARG 181  -1.965   5.456   8.071
 1284    H    GLU 182           H        GLU 182   2.771   5.321   5.558
 1285    HA   GLU 182           HA       GLU 182   1.761   7.867   6.517
 1286    HB2  GLU 182           HB2      GLU 182   1.754   5.869   7.956
 1287    HB3  GLU 182           HB3      GLU 182   3.500   5.757   7.831
 1288    HG2  GLU 182           HG2      GLU 182   3.034   6.681   9.936
 1289    HG3  GLU 182           HG3      GLU 182   3.617   8.009   8.934
 1290    H    GLN 183           H        GLN 183   4.731   6.553   5.287
 1291    HA   GLN 183           HA       GLN 183   6.470   8.623   6.180
 1292    HB2  GLN 183           HB2      GLN 183   6.639   6.812   3.773
 1293    HB3  GLN 183           HB3      GLN 183   7.927   7.885   4.309
 1294    HG2  GLN 183           HG2      GLN 183   8.246   6.631   6.297
 1295    HG3  GLN 183           HG3      GLN 183   6.773   5.696   6.018
 1296   HE21  GLN 183          HE21      GLN 183   7.873   3.741   6.045
 1297   HE22  GLN 183          HE22      GLN 183   8.891   3.250   4.730
 1298    H    GLY 184           H        GLY 184   4.567   8.051   3.288
 1299    HA2  GLY 184           HA2      GLY 184   3.707   9.783   1.896
 1300    HA3  GLY 184           HA3      GLY 184   5.009  10.830   2.453
 1301    H    VAL 185           H        VAL 185   5.310   7.483   1.380
 1302    HA   VAL 185           HA       VAL 185   7.307   8.160  -0.538
 1303    HB   VAL 185           HB       VAL 185   7.327   5.833  -1.162
 1304   HG11  VAL 185          HG11      VAL 185   7.652   4.741   1.024
 1305   HG12  VAL 185          HG12      VAL 185   8.436   6.320   0.924
 1306   HG13  VAL 185          HG13      VAL 185   6.917   6.140   1.806
 1307   HG21  VAL 185          HG21      VAL 185   4.788   5.535   0.437
 1308   HG22  VAL 185          HG22      VAL 185   4.936   5.430  -1.317
 1309   HG23  VAL 185          HG23      VAL 185   5.703   4.217  -0.293
 1310    H    GLU 186           H        GLU 186   7.145   8.303  -2.757
 1311    HA   GLU 186           HA       GLU 186   4.461   8.149  -3.900
 1312    HB2  GLU 186           HB2      GLU 186   6.981   9.442  -4.972
 1313    HB3  GLU 186           HB3      GLU 186   5.481   9.306  -5.871
 1314    HG2  GLU 186           HG2      GLU 186   5.816  10.781  -3.275
 1315    HG3  GLU 186           HG3      GLU 186   5.791  11.518  -4.876
 1316    H    GLU 187           H        GLU 187   4.190   6.955  -5.847
 1317    HA   GLU 187           HA       GLU 187   5.508   4.435  -5.623
 1318    HB2  GLU 187           HB2      GLU 187   3.472   5.495  -7.570
 1319    HB3  GLU 187           HB3      GLU 187   4.019   3.823  -7.540
 1320    HG2  GLU 187           HG2      GLU 187   3.122   3.505  -5.343
 1321    HG3  GLU 187           HG3      GLU 187   2.744   5.218  -5.199
 1322    H    HIS 188           H        HIS 188   6.111   7.252  -7.422
 1323    HA   HIS 188           HA       HIS 188   7.575   5.853  -9.516
 1324    HB2  HIS 188           HB2      HIS 188   7.912   8.116 -10.478
 1325    HB3  HIS 188           HB3      HIS 188   6.213   7.729 -10.224
 1326    HD1  HIS 188           HD1      HIS 188   4.883   9.384  -8.937
 1327    HD2  HIS 188           HD2      HIS 188   8.972   9.869  -8.372
 1328    HE1  HIS 188           HE1      HIS 188   5.141  11.422  -7.478
 1329    HE2  HIS 188           HE2      HIS 188   7.601  11.513  -6.952
 1330    H    GLU 189           H        GLU 189   8.285   6.862  -6.419
 1331    HA   GLU 189           HA       GLU 189  10.752   8.241  -6.891
 1332    HB2  GLU 189           HB2      GLU 189   9.684   6.966  -4.368
 1333    HB3  GLU 189           HB3      GLU 189  11.086   8.021  -4.455
 1334    HG2  GLU 189           HG2      GLU 189   8.250   8.785  -5.097
 1335    HG3  GLU 189           HG3      GLU 189   9.138   9.199  -3.633
 1336    H    THR 190           H        THR 190  12.762   7.428  -7.134
 1337    HA   THR 190           HA       THR 190  13.139   4.598  -7.240
 1338    HB   THR 190           HB       THR 190  15.191   6.815  -7.408
 1339    HG1  THR 190           HG1      THR 190  13.804   7.040  -9.129
 1340   HG21  THR 190          HG21      THR 190  15.348   3.907  -8.222
 1341   HG22  THR 190          HG22      THR 190  16.199   4.651  -6.867
 1342   HG23  THR 190          HG23      THR 190  16.587   5.127  -8.521
 1343    H    LEU 191           H        LEU 191  13.583   3.315  -5.610
 1344    HA   LEU 191           HA       LEU 191  14.689   4.520  -3.156
 1345    HB2  LEU 191           HB2      LEU 191  13.007   2.027  -3.187
 1346    HB3  LEU 191           HB3      LEU 191  13.344   3.103  -1.844
 1347    HG   LEU 191           HG       LEU 191  11.504   3.645  -4.176
 1348   HD11  LEU 191          HD11      LEU 191  10.955   3.389  -1.232
 1349   HD12  LEU 191          HD12      LEU 191   9.771   3.737  -2.494
 1350   HD13  LEU 191          HD13      LEU 191  10.591   2.174  -2.458
 1351   HD21  LEU 191          HD21      LEU 191  12.685   5.689  -3.581
 1352   HD22  LEU 191          HD22      LEU 191  10.988   5.770  -3.110
 1353   HD23  LEU 191          HD23      LEU 191  12.227   5.467  -1.893
 1354    H    LEU 192           H        LEU 192  16.386   3.376  -2.119
 1355    HA   LEU 192           HA       LEU 192  17.498   1.189  -3.756
 1356    HB2  LEU 192           HB2      LEU 192  19.323   2.932  -2.201
 1357    HB3  LEU 192           HB3      LEU 192  19.574   2.156  -3.750
 1358    HG   LEU 192           HG       LEU 192  17.836   4.597  -3.393
 1359   HD11  LEU 192          HD11      LEU 192  19.712   5.891  -4.240
 1360   HD12  LEU 192          HD12      LEU 192  20.125   5.105  -2.717
 1361   HD13  LEU 192          HD13      LEU 192  20.723   4.446  -4.239
 1362   HD21  LEU 192          HD21      LEU 192  18.134   4.835  -5.796
 1363   HD22  LEU 192          HD22      LEU 192  19.101   3.359  -5.833
 1364   HD23  LEU 192          HD23      LEU 192  17.392   3.284  -5.402
 1365    H    LEU 193           H        LEU 193  18.685  -0.420  -2.563
 1366    HA   LEU 193           HA       LEU 193  18.431  -0.180   0.350
 1367    HB2  LEU 193           HB2      LEU 193  18.729  -2.569   0.489
 1368    HB3  LEU 193           HB3      LEU 193  17.435  -2.204  -0.633
 1369    HG   LEU 193           HG       LEU 193  19.446  -2.433  -2.386
 1370   HD11  LEU 193          HD11      LEU 193  20.876  -4.319  -1.752
 1371   HD12  LEU 193          HD12      LEU 193  21.143  -2.913  -0.718
 1372   HD13  LEU 193          HD13      LEU 193  20.195  -4.279  -0.126
 1373   HD21  LEU 193          HD21      LEU 193  17.912  -4.723  -1.174
 1374   HD22  LEU 193          HD22      LEU 193  17.333  -3.642  -2.443
 1375   HD23  LEU 193          HD23      LEU 193  18.689  -4.725  -2.758
 1376    H    ARG 194           H        ARG 194  20.228  -0.523   1.659
 1377    HA   ARG 194           HA       ARG 194  22.828  -0.342   0.292
 1378    HB2  ARG 194           HB2      ARG 194  21.945   1.260   2.704
 1379    HB3  ARG 194           HB3      ARG 194  23.584   1.217   2.073
 1380    HG2  ARG 194           HG2      ARG 194  21.175   2.228   0.583
 1381    HG3  ARG 194           HG3      ARG 194  22.366   3.233   1.407
 1382    HD2  ARG 194           HD2      ARG 194  22.840   1.420  -0.957
 1383    HD3  ARG 194           HD3      ARG 194  22.838   3.187  -0.956
 1384    HE   ARG 194           HE       ARG 194  24.760   2.489   0.874
 1385   HH11  ARG 194          HH11      ARG 194  24.195   1.858  -2.538
 1386   HH12  ARG 194          HH12      ARG 194  25.884   1.672  -2.907
 1387   HH21  ARG 194          HH21      ARG 194  26.973   2.259   0.376
 1388   HH22  ARG 194          HH22      ARG 194  27.464   1.914  -1.259
 1389    H    ARG 195           H        ARG 195  24.321  -1.706   1.058
 1390    HA   ARG 195           HA       ARG 195  23.587  -3.538   3.142
 1391    HB2  ARG 195           HB2      ARG 195  24.975  -4.059   1.059
 1392    HB3  ARG 195           HB3      ARG 195  26.319  -3.284   1.891
 1393    HG2  ARG 195           HG2      ARG 195  26.124  -4.885   3.713
 1394    HG3  ARG 195           HG3      ARG 195  24.762  -5.652   2.900
 1395    HD2  ARG 195           HD2      ARG 195  26.420  -5.956   0.933
 1396    HD3  ARG 195           HD3      ARG 195  27.662  -5.665   2.156
 1397    HE   ARG 195           HE       ARG 195  25.762  -7.606   3.021
 1398   HH11  ARG 195          HH11      ARG 195  28.651  -7.221   1.054
 1399   HH12  ARG 195          HH12      ARG 195  29.037  -8.919   1.104
 1400   HH21  ARG 195          HH21      ARG 195  26.272  -9.779   3.083
 1401   HH22  ARG 195          HH22      ARG 195  27.675 -10.380   2.247
 1402    H    LYS 196           H        LYS 196  23.566  -2.768   5.158
 1403    HA   LYS 196           HA       LYS 196  25.452  -0.704   5.940
 1404    HB2  LYS 196           HB2      LYS 196  23.033  -0.570   6.541
 1405    HB3  LYS 196           HB3      LYS 196  23.248  -1.977   7.573
 1406    HG2  LYS 196           HG2      LYS 196  24.712  -0.790   9.023
 1407    HG3  LYS 196           HG3      LYS 196  24.795   0.577   7.913
 1408    HD2  LYS 196           HD2      LYS 196  23.326   1.087   9.779
 1409    HD3  LYS 196           HD3      LYS 196  22.407   1.005   8.276
 1410    HE2  LYS 196           HE2      LYS 196  21.624  -1.215   8.836
 1411    HE3  LYS 196           HE3      LYS 196  22.630  -1.232  10.286
 1412    HZ1  LYS 196           HZ1      LYS 196  21.334   0.528  11.224
 1413    HZ2  LYS 196           HZ2      LYS 196  20.275  -0.702  10.727
 1414    HZ3  LYS 196           HZ3      LYS 196  20.432   0.710   9.799
 1415    H    PHE 197           H        PHE 197  24.859  -4.102   6.498
 1416    HA   PHE 197           HA       PHE 197  27.320  -4.186   8.123
 1417    HB2  PHE 197           HB2      PHE 197  25.324  -6.439   7.869
 1418    HB3  PHE 197           HB3      PHE 197  26.633  -6.277   9.033
 1419    HD1  PHE 197           HD1      PHE 197  26.265  -3.628  10.147
 1420    HD2  PHE 197           HD2      PHE 197  23.359  -6.511   8.998
 1421    HE1  PHE 197           HE1      PHE 197  24.667  -2.653  11.746
 1422    HE2  PHE 197           HE2      PHE 197  21.752  -5.545  10.581
 1423    HZ   PHE 197           HZ       PHE 197  22.407  -3.611  11.968
 1424    H    PHE 198           H        PHE 198  28.968  -5.594   7.462
 1425    HA   PHE 198           HA       PHE 198  28.719  -6.324   4.627
 1426    HB2  PHE 198           HB2      PHE 198  31.160  -5.696   6.285
 1427    HB3  PHE 198           HB3      PHE 198  31.234  -6.315   4.637
 1428    HD1  PHE 198           HD1      PHE 198  29.578  -4.936   2.980
 1429    HD2  PHE 198           HD2      PHE 198  31.424  -3.447   6.515
 1430    HE1  PHE 198           HE1      PHE 198  29.382  -2.639   2.114
 1431    HE2  PHE 198           HE2      PHE 198  31.235  -1.153   5.657
 1432    HZ   PHE 198           HZ       PHE 198  30.147  -0.760   3.424
 1433    H    TYR 199           H        TYR 199  28.394  -7.699   7.472
 1434    HA   TYR 199           HA       TYR 199  28.113  -9.802   8.126
 1435    HB2  TYR 199           HB2      TYR 199  27.725  -9.910   5.369
 1436    HB3  TYR 199           HB3      TYR 199  28.777 -11.277   5.747
 1437    HD1  TYR 199           HD1      TYR 199  25.947  -9.592   7.455
 1438    HD2  TYR 199           HD2      TYR 199  27.593 -13.241   6.034
 1439    HE1  TYR 199           HE1      TYR 199  23.994 -10.807   8.341
 1440    HE2  TYR 199           HE2      TYR 199  25.655 -14.476   6.923
 1441    HH   TYR 199           HH       TYR 199  23.927 -14.155   8.706
 1442    H    SER 200           H        SER 200  29.701  -9.915   9.498
 1443    HA   SER 200           HA       SER 200  32.317 -10.911   8.774
 1444    HB2  SER 200           HB2      SER 200  31.719  -9.371  10.726
 1445    HB3  SER 200           HB3      SER 200  31.074 -10.804  11.520
 1446    HG   SER 200           HG       SER 200  33.074 -10.943  12.204
 1447    H    ASP 201           H        ASP 201  30.580 -12.579   7.669
 1448    HA   ASP 201           HA       ASP 201  29.978 -14.727   7.386
 1449    HB2  ASP 201           HB2      ASP 201  32.126 -15.373   8.327
 1450    HB3  ASP 201           HB3      ASP 201  31.480 -15.222   9.954
 1451    H    GLN 202           H        GLN 202  29.371 -13.220  10.459
 1452    HA   GLN 202           HA       GLN 202  26.682 -14.389  10.425
 1453    HB2  GLN 202           HB2      GLN 202  28.356 -15.358  12.201
 1454    HB3  GLN 202           HB3      GLN 202  28.069 -13.838  13.033
 1455    HG2  GLN 202           HG2      GLN 202  25.851 -15.682  12.197
 1456    HG3  GLN 202           HG3      GLN 202  26.670 -15.814  13.749
 1457   HE21  GLN 202          HE21      GLN 202  26.969 -12.925  14.049
 1458   HE22  GLN 202          HE22      GLN 202  25.398 -12.328  14.449
  Start of MODEL    7
    1    H1   GLY  -5           H1       GLY  -5 -35.585 -10.669  10.754
    2    H2   GLY  -5           H2       GLY  -5 -34.792  -9.615  11.814
    3    H3   GLY  -5           H3       GLY  -5 -36.257 -10.334  12.277
    4    HA2  GLY  -5           HA2      GLY  -5 -34.460 -11.449  13.388
    5    HA3  GLY  -5           HA3      GLY  -5 -35.207 -12.526  12.215
    6    H    ILE  -4           H        ILE  -4 -32.406 -10.677  13.053
    7    HA   ILE  -4           HA       ILE  -4 -30.297 -10.535  12.236
    8    HB   ILE  -4           HB       ILE  -4 -30.897 -13.147  10.828
    9   HG12  ILE  -4          HG12      ILE  -4 -31.313 -13.359  13.223
   10   HG13  ILE  -4          HG13      ILE  -4 -29.835 -14.213  12.794
   11   HG21  ILE  -4          HG21      ILE  -4 -28.908 -12.022   9.973
   12   HG22  ILE  -4          HG22      ILE  -4 -28.269 -11.888  11.610
   13   HG23  ILE  -4          HG23      ILE  -4 -28.473 -13.476  10.871
   14   HD11  ILE  -4          HD11      ILE  -4 -29.578 -13.011  14.883
   15   HD12  ILE  -4          HD12      ILE  -4 -28.514 -12.341  13.647
   16   HD13  ILE  -4          HD13      ILE  -4 -30.001 -11.498  14.083
   17    H    ASP  -3           H        ASP  -3 -30.755  -8.701  11.037
   18    HA   ASP  -3           HA       ASP  -3 -31.547  -9.128   8.239
   19    HB2  ASP  -3           HB2      ASP  -3 -31.933  -6.744  10.056
   20    HB3  ASP  -3           HB3      ASP  -3 -32.270  -6.715   8.328
   21    HA   PRO  -2           HA       PRO  -2 -27.403  -7.801   7.226
   22    HB2  PRO  -2           HB2      PRO  -2 -28.350  -7.975   4.469
   23    HB3  PRO  -2           HB3      PRO  -2 -27.117  -8.936   5.287
   24    HG2  PRO  -2           HG2      PRO  -2 -29.495  -9.972   4.558
   25    HG3  PRO  -2           HG3      PRO  -2 -28.634 -10.508   6.014
   26    HD2  PRO  -2           HD2      PRO  -2 -30.935  -8.602   5.767
   27    HD3  PRO  -2           HD3      PRO  -2 -30.673  -9.904   6.949
   28    H    PHE  -1           H        PHE  -1 -27.100  -6.551   4.749
   29    HA   PHE  -1           HA       PHE  -1 -27.480  -3.838   5.406
   30    HB2  PHE  -1           HB2      PHE  -1 -26.695  -3.528   2.948
   31    HB3  PHE  -1           HB3      PHE  -1 -25.579  -4.206   4.127
   32    HD1  PHE  -1           HD1      PHE  -1 -24.932  -6.530   4.033
   33    HD2  PHE  -1           HD2      PHE  -1 -27.606  -4.888   1.164
   34    HE1  PHE  -1           HE1      PHE  -1 -24.577  -8.491   2.589
   35    HE2  PHE  -1           HE2      PHE  -1 -27.263  -6.848  -0.285
   36    HZ   PHE  -1           HZ       PHE  -1 -25.746  -8.653   0.427
   37    H    THR   0           H        THR   0 -29.906  -4.422   5.682
   38    HA   THR   0           HA       THR   0 -31.592  -4.300   3.416
   39    HB   THR   0           HB       THR   0 -33.338  -3.571   5.101
   40    HG1  THR   0           HG1      THR   0 -32.515  -4.009   7.344
   41   HG21  THR   0          HG21      THR   0 -31.758  -6.081   5.682
   42   HG22  THR   0          HG22      THR   0 -33.038  -5.915   4.480
   43   HG23  THR   0          HG23      THR   0 -33.416  -5.770   6.196
   44    H    MET   1           H        MET   1 -31.911  -1.867   5.814
   45    HA   MET   1           HA       MET   1 -31.280   0.189   3.818
   46    HB2  MET   1           HB2      MET   1 -33.709   0.065   4.487
   47    HB3  MET   1           HB3      MET   1 -33.218   0.508   6.112
   48    HG2  MET   1           HG2      MET   1 -34.077   2.429   4.918
   49    HG3  MET   1           HG3      MET   1 -32.368   2.640   5.285
   50    HE1  MET   1           HE1      MET   1 -30.621   2.728   1.916
   51    HE2  MET   1           HE2      MET   1 -30.648   3.354   3.565
   52    HE3  MET   1           HE3      MET   1 -30.529   1.618   3.281
   53    H    VAL   2           H        VAL   2 -29.588  -1.159   5.581
   54    HA   VAL   2           HA       VAL   2 -28.370   1.151   6.852
   55    HB   VAL   2           HB       VAL   2 -27.441  -0.455   8.619
   56   HG11  VAL   2          HG11      VAL   2 -30.388   0.195   8.666
   57   HG12  VAL   2          HG12      VAL   2 -29.398  -0.194  10.073
   58   HG13  VAL   2          HG13      VAL   2 -29.076   1.272   9.146
   59   HG21  VAL   2          HG21      VAL   2 -28.840  -2.399   9.162
   60   HG22  VAL   2          HG22      VAL   2 -29.801  -2.107   7.711
   61   HG23  VAL   2          HG23      VAL   2 -28.100  -2.553   7.567
   62    H    ALA   3           H        ALA   3 -27.303   1.205   4.847
   63    HA   ALA   3           HA       ALA   3 -24.940  -0.452   4.785
   64    HB1  ALA   3           HB1      ALA   3 -26.526  -1.748   3.435
   65    HB2  ALA   3           HB2      ALA   3 -26.787  -0.338   2.406
   66    HB3  ALA   3           HB3      ALA   3 -25.201  -1.104   2.462
   67    H    LEU   4           H        LEU   4 -23.789   1.419   5.167
   68    HA   LEU   4           HA       LEU   4 -23.662   3.787   4.052
   69    HB2  LEU   4           HB2      LEU   4 -21.304   1.919   4.132
   70    HB3  LEU   4           HB3      LEU   4 -21.245   3.670   4.176
   71    HG   LEU   4           HG       LEU   4 -22.382   1.878   6.326
   72   HD11  LEU   4          HD11      LEU   4 -19.981   1.753   6.246
   73   HD12  LEU   4          HD12      LEU   4 -19.860   3.519   6.205
   74   HD13  LEU   4          HD13      LEU   4 -20.478   2.707   7.646
   75   HD21  LEU   4          HD21      LEU   4 -23.587   3.995   6.195
   76   HD22  LEU   4          HD22      LEU   4 -22.592   3.918   7.649
   77   HD23  LEU   4          HD23      LEU   4 -22.062   4.877   6.266
   78    H    SER   5           H        SER   5 -23.304   4.746   2.203
   79    HA   SER   5           HA       SER   5 -23.047   3.060  -0.192
   80    HB2  SER   5           HB2      SER   5 -24.175   5.862   0.060
   81    HB3  SER   5           HB3      SER   5 -24.098   4.913  -1.423
   82    HG   SER   5           HG       SER   5 -25.335   3.777   0.812
   83    H    LEU   6           H        LEU   6 -21.008   2.964  -0.808
   84    HA   LEU   6           HA       LEU   6 -19.284   5.284  -0.252
   85    HB2  LEU   6           HB2      LEU   6 -18.369   2.431  -0.568
   86    HB3  LEU   6           HB3      LEU   6 -17.477   3.783   0.110
   87    HG   LEU   6           HG       LEU   6 -19.847   2.403   1.377
   88   HD11  LEU   6          HD11      LEU   6 -17.810   1.072   1.441
   89   HD12  LEU   6          HD12      LEU   6 -16.930   2.433   2.135
   90   HD13  LEU   6          HD13      LEU   6 -18.232   1.665   3.047
   91   HD21  LEU   6          HD21      LEU   6 -19.866   4.754   1.924
   92   HD22  LEU   6          HD22      LEU   6 -19.351   3.815   3.325
   93   HD23  LEU   6          HD23      LEU   6 -18.158   4.694   2.368
   94    H    LYS   7           H        LYS   7 -17.977   6.051  -1.843
   95    HA   LYS   7           HA       LYS   7 -18.357   4.975  -4.520
   96    HB2  LYS   7           HB2      LYS   7 -17.283   7.507  -3.400
   97    HB3  LYS   7           HB3      LYS   7 -16.595   6.958  -4.922
   98    HG2  LYS   7           HG2      LYS   7 -18.936   6.800  -5.809
   99    HG3  LYS   7           HG3      LYS   7 -19.465   7.615  -4.334
  100    HD2  LYS   7           HD2      LYS   7 -18.267   9.571  -4.862
  101    HD3  LYS   7           HD3      LYS   7 -17.325   8.750  -6.108
  102    HE2  LYS   7           HE2      LYS   7 -18.955  10.124  -7.188
  103    HE3  LYS   7           HE3      LYS   7 -19.416   8.436  -7.403
  104    HZ1  LYS   7           HZ1      LYS   7 -20.575  10.310  -5.404
  105    HZ2  LYS   7           HZ2      LYS   7 -21.032   8.688  -5.614
  106    HZ3  LYS   7           HZ3      LYS   7 -21.315   9.820  -6.845
  107    H    ILE   8           H        ILE   8 -17.192   3.197  -4.897
  108    HA   ILE   8           HA       ILE   8 -14.520   2.966  -3.765
  109    HB   ILE   8           HB       ILE   8 -16.373   1.028  -5.114
  110   HG12  ILE   8          HG12      ILE   8 -15.756  -0.358  -3.126
  111   HG13  ILE   8          HG13      ILE   8 -14.766   0.975  -2.550
  112   HG21  ILE   8          HG21      ILE   8 -14.590  -0.642  -5.214
  113   HG22  ILE   8          HG22      ILE   8 -14.248   0.731  -6.266
  114   HG23  ILE   8          HG23      ILE   8 -13.419   0.578  -4.717
  115   HD11  ILE   8          HD11      ILE   8 -16.875   0.932  -1.397
  116   HD12  ILE   8          HD12      ILE   8 -16.776   2.374  -2.408
  117   HD13  ILE   8          HD13      ILE   8 -17.750   0.998  -2.928
  118    H    SER   9           H        SER   9 -12.903   3.833  -4.850
  119    HA   SER   9           HA       SER   9 -13.092   3.926  -7.780
  120    HB2  SER   9           HB2      SER   9 -11.244   5.520  -5.993
  121    HB3  SER   9           HB3      SER   9 -11.489   5.743  -7.721
  122    HG   SER   9           HG       SER   9 -13.704   5.876  -6.016
  123    H    ILE  10           H        ILE  10 -11.643   2.872  -8.997
  124    HA   ILE  10           HA       ILE  10  -9.528   1.379  -7.593
  125    HB   ILE  10           HB       ILE  10 -11.161   0.338  -9.923
  126   HG12  ILE  10          HG12      ILE  10 -11.299  -0.459  -7.004
  127   HG13  ILE  10          HG13      ILE  10 -12.485   0.551  -7.819
  128   HG21  ILE  10          HG21      ILE  10 -10.077  -1.802  -9.422
  129   HG22  ILE  10          HG22      ILE  10  -8.891  -0.559  -9.824
  130   HG23  ILE  10          HG23      ILE  10  -9.141  -1.029  -8.142
  131   HD11  ILE  10          HD11      ILE  10 -11.848  -2.307  -8.511
  132   HD12  ILE  10          HD12      ILE  10 -13.249  -1.751  -7.592
  133   HD13  ILE  10          HD13      ILE  10 -13.067  -1.295  -9.286
  134    H    GLY  11           H        GLY  11  -8.259   3.264  -8.232
  135    HA2  GLY  11           HA2      GLY  11  -6.523   4.067  -9.510
  136    HA3  GLY  11           HA3      GLY  11  -6.816   2.761 -10.646
  137    H    ASN  12           H        ASN  12  -8.417   3.049 -12.276
  138    HA   ASN  12           HA       ASN  12  -8.633   5.880 -13.057
  139    HB2  ASN  12           HB2      ASN  12  -8.671   5.068 -15.375
  140    HB3  ASN  12           HB3      ASN  12  -7.232   4.503 -14.535
  141   HD21  ASN  12          HD21      ASN  12  -8.661   3.440 -16.890
  142   HD22  ASN  12          HD22      ASN  12  -9.029   1.791 -16.500
  143    H    VAL  13           H        VAL  13 -10.508   3.570 -11.759
  144    HA   VAL  13           HA       VAL  13 -12.914   4.530 -13.153
  145    HB   VAL  13           HB       VAL  13 -12.315   2.245 -13.933
  146   HG11  VAL  13          HG11      VAL  13 -12.786   1.449 -11.068
  147   HG12  VAL  13          HG12      VAL  13 -12.572   0.337 -12.420
  148   HG13  VAL  13          HG13      VAL  13 -11.249   1.397 -11.931
  149   HG21  VAL  13          HG21      VAL  13 -14.855   2.405 -12.320
  150   HG22  VAL  13          HG22      VAL  13 -14.636   2.931 -13.990
  151   HG23  VAL  13          HG23      VAL  13 -14.518   1.219 -13.582
  152    H    VAL  14           H        VAL  14 -14.866   4.469 -11.834
  153    HA   VAL  14           HA       VAL  14 -14.494   3.903  -9.004
  154    HB   VAL  14           HB       VAL  14 -13.968   6.200  -8.911
  155   HG11  VAL  14          HG11      VAL  14 -16.360   6.756 -10.651
  156   HG12  VAL  14          HG12      VAL  14 -15.297   7.966  -9.931
  157   HG13  VAL  14          HG13      VAL  14 -14.667   6.847 -11.140
  158   HG21  VAL  14          HG21      VAL  14 -16.901   5.901  -8.259
  159   HG22  VAL  14          HG22      VAL  14 -15.540   5.555  -7.190
  160   HG23  VAL  14          HG23      VAL  14 -15.865   7.214  -7.697
  161    H    LYS  15           H        LYS  15 -16.150   2.904  -8.168
  162    HA   LYS  15           HA       LYS  15 -18.735   2.978  -9.572
  163    HB2  LYS  15           HB2      LYS  15 -17.291   0.570  -8.450
  164    HB3  LYS  15           HB3      LYS  15 -18.987   0.555  -8.909
  165    HG2  LYS  15           HG2      LYS  15 -16.643   1.062 -10.731
  166    HG3  LYS  15           HG3      LYS  15 -17.645  -0.391 -10.674
  167    HD2  LYS  15           HD2      LYS  15 -19.599   0.953 -11.319
  168    HD3  LYS  15           HD3      LYS  15 -18.573   2.384 -11.411
  169    HE2  LYS  15           HE2      LYS  15 -17.224   1.231 -13.152
  170    HE3  LYS  15           HE3      LYS  15 -18.385  -0.097 -13.114
  171    HZ1  LYS  15           HZ1      LYS  15 -18.926   2.721 -13.879
  172    HZ2  LYS  15           HZ2      LYS  15 -20.129   1.540 -13.694
  173    HZ3  LYS  15           HZ3      LYS  15 -18.952   1.368 -14.902
  174    H    THR  16           H        THR  16 -20.578   2.686  -8.253
  175    HA   THR  16           HA       THR  16 -20.080   3.595  -5.501
  176    HB   THR  16           HB       THR  16 -22.685   3.641  -7.041
  177    HG1  THR  16           HG1      THR  16 -20.657   5.010  -7.679
  178   HG21  THR  16          HG21      THR  16 -21.806   5.081  -4.534
  179   HG22  THR  16          HG22      THR  16 -22.942   3.734  -4.607
  180   HG23  THR  16          HG23      THR  16 -23.359   5.281  -5.346
  181    H    MET  17           H        MET  17 -20.271   2.150  -3.910
  182    HA   MET  17           HA       MET  17 -21.989  -0.197  -4.330
  183    HB2  MET  17           HB2      MET  17 -19.138  -0.194  -4.262
  184    HB3  MET  17           HB3      MET  17 -19.724  -0.985  -2.804
  185    HG2  MET  17           HG2      MET  17 -20.670  -1.695  -5.560
  186    HG3  MET  17           HG3      MET  17 -19.314  -2.476  -4.767
  187    HE1  MET  17           HE1      MET  17 -20.963  -4.331  -1.787
  188    HE2  MET  17           HE2      MET  17 -19.494  -4.088  -2.730
  189    HE3  MET  17           HE3      MET  17 -20.154  -2.764  -1.771
  190    H    GLN  18           H        GLN  18 -22.835  -1.094  -2.447
  191    HA   GLN  18           HA       GLN  18 -22.603   0.654  -0.095
  192    HB2  GLN  18           HB2      GLN  18 -24.903  -0.956  -1.166
  193    HB3  GLN  18           HB3      GLN  18 -24.873  -0.367   0.494
  194    HG2  GLN  18           HG2      GLN  18 -25.034   1.824  -0.125
  195    HG3  GLN  18           HG3      GLN  18 -24.342   1.538  -1.722
  196   HE21  GLN  18          HE21      GLN  18 -25.954   2.541  -2.829
  197   HE22  GLN  18          HE22      GLN  18 -27.551   1.899  -2.972
  198    H    PHE  19           H        PHE  19 -22.161  -0.183   1.872
  199    HA   PHE  19           HA       PHE  19 -21.804  -3.082   2.079
  200    HB2  PHE  19           HB2      PHE  19 -19.917  -0.916   3.061
  201    HB3  PHE  19           HB3      PHE  19 -19.785  -2.617   3.478
  202    HD1  PHE  19           HD1      PHE  19 -19.396  -0.131   0.832
  203    HD2  PHE  19           HD2      PHE  19 -18.898  -4.211   1.916
  204    HE1  PHE  19           HE1      PHE  19 -18.006  -0.489  -1.169
  205    HE2  PHE  19           HE2      PHE  19 -17.506  -4.580  -0.078
  206    HZ   PHE  19           HZ       PHE  19 -16.985  -2.725  -1.572
  207    H    GLU  20           H        GLU  20 -22.101  -3.821   4.274
  208    HA   GLU  20           HA       GLU  20 -24.014  -2.418   5.788
  209    HB2  GLU  20           HB2      GLU  20 -22.140  -4.650   6.577
  210    HB3  GLU  20           HB3      GLU  20 -23.405  -4.024   7.622
  211    HG2  GLU  20           HG2      GLU  20 -25.068  -4.659   5.904
  212    HG3  GLU  20           HG3      GLU  20 -23.762  -5.399   4.976
  213    HA   PRO  21           HA       PRO  21 -21.801   0.533   8.267
  214    HB2  PRO  21           HB2      PRO  21 -22.839  -0.513  10.726
  215    HB3  PRO  21           HB3      PRO  21 -23.361   0.927   9.857
  216    HG2  PRO  21           HG2      PRO  21 -24.569  -1.749   9.928
  217    HG3  PRO  21           HG3      PRO  21 -25.305  -0.206   9.452
  218    HD2  PRO  21           HD2      PRO  21 -24.688  -2.183   7.700
  219    HD3  PRO  21           HD3      PRO  21 -24.723  -0.462   7.270
  220    H    SER  22           H        SER  22 -21.921  -2.846   9.357
  221    HA   SER  22           HA       SER  22 -19.319  -2.630  10.589
  222    HB2  SER  22           HB2      SER  22 -20.821  -5.182  10.015
  223    HB3  SER  22           HB3      SER  22 -19.626  -4.882  11.275
  224    HG   SER  22           HG       SER  22 -22.175  -4.759  11.570
  225    H    THR  23           H        THR  23 -20.617  -4.764   8.056
  226    HA   THR  23           HA       THR  23 -19.638  -6.111   6.558
  227    HB   THR  23           HB       THR  23 -18.216  -3.534   5.928
  228    HG1  THR  23           HG1      THR  23 -20.612  -4.813   5.099
  229   HG21  THR  23          HG21      THR  23 -17.849  -4.504   3.715
  230   HG22  THR  23          HG22      THR  23 -18.537  -6.029   4.273
  231   HG23  THR  23          HG23      THR  23 -17.027  -5.439   4.964
  232    H    MET  24           H        MET  24 -16.865  -4.122   7.529
  233    HA   MET  24           HA       MET  24 -14.784  -4.650   8.252
  234    HB2  MET  24           HB2      MET  24 -16.173  -6.732   9.298
  235    HB3  MET  24           HB3      MET  24 -15.093  -7.586   8.205
  236    HG2  MET  24           HG2      MET  24 -13.199  -6.901   9.326
  237    HG3  MET  24           HG3      MET  24 -14.024  -5.538  10.090
  238    HE1  MET  24           HE1      MET  24 -12.310  -6.819  11.989
  239    HE2  MET  24           HE2      MET  24 -13.619  -5.776  12.561
  240    HE3  MET  24           HE3      MET  24 -13.326  -7.337  13.337
  241    H    VAL  25           H        VAL  25 -13.000  -4.800   7.127
  242    HA   VAL  25           HA       VAL  25 -13.035  -4.610   4.435
  243    HB   VAL  25           HB       VAL  25 -10.723  -5.509   6.133
  244   HG11  VAL  25          HG11      VAL  25  -9.276  -4.780   4.291
  245   HG12  VAL  25          HG12      VAL  25 -10.287  -6.145   3.818
  246   HG13  VAL  25          HG13      VAL  25 -10.699  -4.516   3.283
  247   HG21  VAL  25          HG21      VAL  25 -11.538  -2.837   5.011
  248   HG22  VAL  25          HG22      VAL  25 -11.676  -3.346   6.694
  249   HG23  VAL  25          HG23      VAL  25 -10.084  -3.154   5.957
  250    H    TYR  26           H        TYR  26 -12.275  -7.660   6.142
  251    HA   TYR  26           HA       TYR  26 -11.629  -9.097   3.837
  252    HB2  TYR  26           HB2      TYR  26 -11.959 -11.143   5.143
  253    HB3  TYR  26           HB3      TYR  26 -11.023  -9.947   6.024
  254    HD1  TYR  26           HD1      TYR  26 -14.351 -11.545   5.769
  255    HD2  TYR  26           HD2      TYR  26 -11.764  -9.135   8.137
  256    HE1  TYR  26           HE1      TYR  26 -15.902 -11.744   7.662
  257    HE2  TYR  26           HE2      TYR  26 -13.306  -9.338  10.039
  258    HH   TYR  26           HH       TYR  26 -15.927 -11.563  10.051
  259    H    ASP  27           H        ASP  27 -14.720  -8.446   5.324
  260    HA   ASP  27           HA       ASP  27 -16.179 -10.280   3.649
  261    HB2  ASP  27           HB2      ASP  27 -16.843  -9.438   5.997
  262    HB3  ASP  27           HB3      ASP  27 -17.379  -7.977   5.175
  263    H    ALA  28           H        ALA  28 -15.588  -6.796   3.779
  264    HA   ALA  28           HA       ALA  28 -17.108  -5.940   1.638
  265    HB1  ALA  28           HB1      ALA  28 -15.857  -4.435   3.115
  266    HB2  ALA  28           HB2      ALA  28 -14.346  -4.983   2.390
  267    HB3  ALA  28           HB3      ALA  28 -15.521  -4.100   1.417
  268    H    CYS  29           H        CYS  29 -13.818  -7.205   1.625
  269    HA   CYS  29           HA       CYS  29 -13.230  -6.995  -1.065
  270    HB2  CYS  29           HB2      CYS  29 -11.608  -7.588   0.693
  271    HB3  CYS  29           HB3      CYS  29 -12.355  -9.173   0.841
  272    HG   CYS  29           HG       CYS  29  -9.778  -8.788  -0.710
  273    H    ARG  30           H        ARG  30 -15.197  -9.444   0.548
  274    HA   ARG  30           HA       ARG  30 -15.068 -11.259  -1.678
  275    HB2  ARG  30           HB2      ARG  30 -16.468 -12.709  -0.469
  276    HB3  ARG  30           HB3      ARG  30 -15.471 -11.931   0.750
  277    HG2  ARG  30           HG2      ARG  30 -17.312 -10.419   1.301
  278    HG3  ARG  30           HG3      ARG  30 -18.304 -11.185   0.058
  279    HD2  ARG  30           HD2      ARG  30 -18.280 -13.274   1.238
  280    HD3  ARG  30           HD3      ARG  30 -17.129 -12.643   2.416
  281    HE   ARG  30           HE       ARG  30 -19.056 -10.951   2.850
  282   HH11  ARG  30          HH11      ARG  30 -19.414 -14.376   2.143
  283   HH12  ARG  30          HH12      ARG  30 -20.872 -14.532   3.079
  284   HH21  ARG  30          HH21      ARG  30 -20.954 -11.180   4.082
  285   HH22  ARG  30          HH22      ARG  30 -21.741 -12.731   4.182
  286    H    MET  31           H        MET  31 -17.292  -8.790  -0.561
  287    HA   MET  31           HA       MET  31 -19.317  -9.482  -2.471
  288    HB2  MET  31           HB2      MET  31 -19.044  -7.013  -0.756
  289    HB3  MET  31           HB3      MET  31 -20.483  -7.515  -1.635
  290    HG2  MET  31           HG2      MET  31 -20.634  -9.522  -0.284
  291    HG3  MET  31           HG3      MET  31 -19.175  -9.063   0.583
  292    HE1  MET  31           HE1      MET  31 -18.925  -7.129   2.149
  293    HE2  MET  31           HE2      MET  31 -19.490  -5.949   0.964
  294    HE3  MET  31           HE3      MET  31 -20.185  -5.973   2.587
  295    H    ILE  32           H        ILE  32 -16.847  -6.940  -2.199
  296    HA   ILE  32           HA       ILE  32 -17.788  -5.435  -4.393
  297    HB   ILE  32           HB       ILE  32 -16.277  -4.476  -2.746
  298   HG12  ILE  32          HG12      ILE  32 -15.098  -4.496  -5.531
  299   HG13  ILE  32          HG13      ILE  32 -16.448  -3.498  -5.002
  300   HG21  ILE  32          HG21      ILE  32 -13.881  -4.971  -2.768
  301   HG22  ILE  32          HG22      ILE  32 -14.836  -6.388  -2.326
  302   HG23  ILE  32          HG23      ILE  32 -14.158  -6.252  -3.950
  303   HD11  ILE  32          HD11      ILE  32 -14.370  -2.247  -5.076
  304   HD12  ILE  32          HD12      ILE  32 -15.000  -2.352  -3.432
  305   HD13  ILE  32          HD13      ILE  32 -13.648  -3.372  -3.925
  306    H    ARG  33           H        ARG  33 -15.255  -7.913  -4.198
  307    HA   ARG  33           HA       ARG  33 -14.584  -8.000  -6.907
  308    HB2  ARG  33           HB2      ARG  33 -14.532 -10.129  -4.778
  309    HB3  ARG  33           HB3      ARG  33 -13.944 -10.413  -6.411
  310    HG2  ARG  33           HG2      ARG  33 -12.344  -8.557  -6.119
  311    HG3  ARG  33           HG3      ARG  33 -12.894  -8.385  -4.451
  312    HD2  ARG  33           HD2      ARG  33 -11.744 -10.917  -5.613
  313    HD3  ARG  33           HD3      ARG  33 -10.810  -9.728  -4.706
  314    HE   ARG  33           HE       ARG  33 -12.516 -10.211  -2.865
  315   HH11  ARG  33          HH11      ARG  33 -11.511 -12.590  -5.230
  316   HH12  ARG  33          HH12      ARG  33 -11.662 -13.933  -4.134
  317   HH21  ARG  33          HH21      ARG  33 -12.727 -11.988  -1.416
  318   HH22  ARG  33          HH22      ARG  33 -12.375 -13.590  -1.987
  319    H    GLU  34           H        GLU  34 -17.356  -9.158  -5.259
  320    HA   GLU  34           HA       GLU  34 -18.098 -11.212  -7.098
  321    HB2  GLU  34           HB2      GLU  34 -18.923 -11.195  -4.789
  322    HB3  GLU  34           HB3      GLU  34 -19.779  -9.691  -5.093
  323    HG2  GLU  34           HG2      GLU  34 -21.382 -11.412  -5.178
  324    HG3  GLU  34           HG3      GLU  34 -21.095 -10.912  -6.843
  325    H    ARG  35           H        ARG  35 -19.538  -8.001  -6.482
  326    HA   ARG  35           HA       ARG  35 -20.989  -8.166  -8.968
  327    HB2  ARG  35           HB2      ARG  35 -21.810  -5.859  -8.333
  328    HB3  ARG  35           HB3      ARG  35 -22.235  -7.173  -7.250
  329    HG2  ARG  35           HG2      ARG  35 -19.759  -5.885  -6.476
  330    HG3  ARG  35           HG3      ARG  35 -21.115  -4.756  -6.548
  331    HD2  ARG  35           HD2      ARG  35 -21.075  -7.370  -5.041
  332    HD3  ARG  35           HD3      ARG  35 -20.890  -5.769  -4.326
  333    HE   ARG  35           HE       ARG  35 -23.326  -6.237  -5.851
  334   HH11  ARG  35          HH11      ARG  35 -21.803  -6.175  -2.698
  335   HH12  ARG  35          HH12      ARG  35 -23.289  -5.921  -1.838
  336   HH21  ARG  35          HH21      ARG  35 -25.276  -5.934  -4.739
  337   HH22  ARG  35          HH22      ARG  35 -25.274  -5.786  -3.008
  338    H    ILE  36           H        ILE  36 -18.142  -6.437  -7.816
  339    HA   ILE  36           HA       ILE  36 -18.050  -4.974 -10.366
  340    HB   ILE  36           HB       ILE  36 -16.339  -4.501  -7.919
  341   HG12  ILE  36          HG12      ILE  36 -18.817  -3.019  -8.833
  342   HG13  ILE  36          HG13      ILE  36 -18.726  -4.085  -7.435
  343   HG21  ILE  36          HG21      ILE  36 -15.860  -2.343  -8.993
  344   HG22  ILE  36          HG22      ILE  36 -15.337  -3.705  -9.986
  345   HG23  ILE  36          HG23      ILE  36 -16.819  -2.835 -10.389
  346   HD11  ILE  36          HD11      ILE  36 -17.112  -2.572  -6.396
  347   HD12  ILE  36          HD12      ILE  36 -17.225  -1.501  -7.793
  348   HD13  ILE  36          HD13      ILE  36 -18.634  -1.761  -6.764
  349    HA   PRO  37           HA       PRO  37 -15.048  -8.208 -11.346
  350    HB2  PRO  37           HB2      PRO  37 -14.970  -7.697 -14.009
  351    HB3  PRO  37           HB3      PRO  37 -16.261  -8.633 -13.248
  352    HG2  PRO  37           HG2      PRO  37 -16.239  -5.760 -14.080
  353    HG3  PRO  37           HG3      PRO  37 -17.524  -6.969 -14.260
  354    HD2  PRO  37           HD2      PRO  37 -17.527  -5.091 -12.299
  355    HD3  PRO  37           HD3      PRO  37 -18.253  -6.697 -12.098
  356    H    GLU  38           H        GLU  38 -14.907  -4.798 -11.990
  357    HA   GLU  38           HA       GLU  38 -12.298  -4.702 -13.099
  358    HB2  GLU  38           HB2      GLU  38 -13.905  -2.566 -11.689
  359    HB3  GLU  38           HB3      GLU  38 -12.421  -2.277 -12.586
  360    HG2  GLU  38           HG2      GLU  38 -14.967  -3.389 -13.746
  361    HG3  GLU  38           HG3      GLU  38 -14.429  -1.714 -13.872
  362    H    ALA  39           H        ALA  39 -13.378  -5.303  -9.969
  363    HA   ALA  39           HA       ALA  39 -11.388  -3.939  -8.469
  364    HB1  ALA  39           HB1      ALA  39 -12.221  -5.205  -6.576
  365    HB2  ALA  39           HB2      ALA  39 -13.562  -4.579  -7.534
  366    HB3  ALA  39           HB3      ALA  39 -13.107  -6.279  -7.659
  367    H    LEU  40           H        LEU  40 -11.625  -7.237  -9.751
  368    HA   LEU  40           HA       LEU  40  -9.190  -7.896  -8.292
  369    HB2  LEU  40           HB2      LEU  40  -9.743 -10.293  -9.032
  370    HB3  LEU  40           HB3      LEU  40 -10.658  -9.551  -7.743
  371    HG   LEU  40           HG       LEU  40 -12.006 -10.945  -9.306
  372   HD11  LEU  40          HD11      LEU  40 -13.857  -9.379  -9.548
  373   HD12  LEU  40          HD12      LEU  40 -13.088  -9.245  -7.967
  374   HD13  LEU  40          HD13      LEU  40 -12.767  -8.035  -9.210
  375   HD21  LEU  40          HD21      LEU  40 -11.330  -8.782 -11.279
  376   HD22  LEU  40          HD22      LEU  40 -10.927 -10.493 -11.391
  377   HD23  LEU  40          HD23      LEU  40 -12.611  -9.977 -11.497
  378    H    ALA  41           H        ALA  41  -8.261  -6.381 -10.028
  379    HA   ALA  41           HA       ALA  41  -7.659  -7.564 -12.561
  380    HB1  ALA  41           HB1      ALA  41  -7.690  -5.141 -12.269
  381    HB2  ALA  41           HB2      ALA  41  -6.343  -5.253 -11.135
  382    HB3  ALA  41           HB3      ALA  41  -6.109  -5.687 -12.829
  383    H    GLY  42           H        GLY  42  -7.000  -8.956  -9.980
  384    HA2  GLY  42           HA2      GLY  42  -4.714 -10.354 -10.720
  385    HA3  GLY  42           HA3      GLY  42  -4.223  -9.110  -9.568
  386    HA   PRO  43           HA       PRO  43  -5.811 -12.661  -7.054
  387    HB2  PRO  43           HB2      PRO  43  -3.512 -12.205  -5.330
  388    HB3  PRO  43           HB3      PRO  43  -3.966 -13.664  -6.216
  389    HG2  PRO  43           HG2      PRO  43  -1.799 -12.136  -6.862
  390    HG3  PRO  43           HG3      PRO  43  -2.687 -13.125  -8.034
  391    HD2  PRO  43           HD2      PRO  43  -2.822 -10.178  -7.549
  392    HD3  PRO  43           HD3      PRO  43  -2.891 -11.075  -9.082
  393    HA   PRO  44           HA       PRO  44  -7.949  -9.727  -4.479
  394    HB2  PRO  44           HB2      PRO  44  -8.665 -11.635  -2.567
  395    HB3  PRO  44           HB3      PRO  44  -9.587 -11.223  -4.016
  396    HG2  PRO  44           HG2      PRO  44  -7.639 -13.454  -3.579
  397    HG3  PRO  44           HG3      PRO  44  -9.193 -13.471  -4.444
  398    HD2  PRO  44           HD2      PRO  44  -6.927 -13.398  -5.803
  399    HD3  PRO  44           HD3      PRO  44  -8.289 -12.369  -6.306
  400    H    ASN  45           H        ASN  45  -5.516 -11.934  -3.222
  401    HA   ASN  45           HA       ASN  45  -5.350 -10.751  -0.645
  402    HB2  ASN  45           HB2      ASN  45  -3.505 -12.173  -0.249
  403    HB3  ASN  45           HB3      ASN  45  -4.556 -13.075  -1.332
  404   HD21  ASN  45          HD21      ASN  45  -3.907 -13.536  -3.386
  405   HD22  ASN  45          HD22      ASN  45  -2.279 -13.282  -3.930
  406    H    ASP  46           H        ASP  46  -4.194  -9.803  -3.718
  407    HA   ASP  46           HA       ASP  46  -2.171  -8.028  -2.555
  408    HB2  ASP  46           HB2      ASP  46  -2.809  -8.740  -5.425
  409    HB3  ASP  46           HB3      ASP  46  -1.657  -7.485  -4.976
  410    H    PHE  47           H        PHE  47  -5.312  -7.834  -2.673
  411    HA   PHE  47           HA       PHE  47  -5.316  -4.999  -3.478
  412    HB2  PHE  47           HB2      PHE  47  -7.433  -7.092  -3.941
  413    HB3  PHE  47           HB3      PHE  47  -7.790  -5.371  -4.001
  414    HD1  PHE  47           HD1      PHE  47  -6.456  -3.951  -5.644
  415    HD2  PHE  47           HD2      PHE  47  -6.618  -8.198  -5.821
  416    HE1  PHE  47           HE1      PHE  47  -5.756  -3.874  -7.998
  417    HE2  PHE  47           HE2      PHE  47  -5.914  -8.128  -8.172
  418    HZ   PHE  47           HZ       PHE  47  -5.483  -5.965  -9.267
  419    H    GLY  48           H        GLY  48  -5.805  -3.638  -1.887
  420    HA2  GLY  48           HA2      GLY  48  -7.432  -4.673   0.355
  421    HA3  GLY  48           HA3      GLY  48  -6.030  -3.646   0.606
  422    H    LEU  49           H        LEU  49  -8.152  -2.743   1.788
  423    HA   LEU  49           HA       LEU  49  -9.556  -0.915  -0.009
  424    HB2  LEU  49           HB2      LEU  49 -10.048  -1.577   2.894
  425    HB3  LEU  49           HB3      LEU  49 -11.020  -0.479   1.933
  426    HG   LEU  49           HG       LEU  49 -10.729  -3.451   1.494
  427   HD11  LEU  49          HD11      LEU  49 -12.110  -2.887   3.415
  428   HD12  LEU  49          HD12      LEU  49 -13.057  -1.778   2.423
  429   HD13  LEU  49          HD13      LEU  49 -13.099  -3.510   2.095
  430   HD21  LEU  49          HD21      LEU  49 -12.384  -1.427  -0.007
  431   HD22  LEU  49          HD22      LEU  49 -10.955  -2.257  -0.623
  432   HD23  LEU  49          HD23      LEU  49 -12.413  -3.174  -0.245
  433    H    PHE  50           H        PHE  50  -8.505   0.879  -0.338
  434    HA   PHE  50           HA       PHE  50  -7.030   2.180   1.828
  435    HB2  PHE  50           HB2      PHE  50  -5.915   1.974  -0.366
  436    HB3  PHE  50           HB3      PHE  50  -7.215   2.898  -1.109
  437    HD1  PHE  50           HD1      PHE  50  -4.379   3.080   1.250
  438    HD2  PHE  50           HD2      PHE  50  -7.242   5.262  -1.025
  439    HE1  PHE  50           HE1      PHE  50  -3.155   5.159   1.708
  440    HE2  PHE  50           HE2      PHE  50  -6.019   7.346  -0.568
  441    HZ   PHE  50           HZ       PHE  50  -3.972   7.297   0.799
  442    H    LEU  51           H        LEU  51  -7.854   3.867   2.925
  443    HA   LEU  51           HA       LEU  51 -10.437   4.895   2.027
  444    HB2  LEU  51           HB2      LEU  51 -10.014   4.122   4.413
  445    HB3  LEU  51           HB3      LEU  51  -9.006   5.542   4.604
  446    HG   LEU  51           HG       LEU  51 -11.459   5.609   5.444
  447   HD11  LEU  51          HD11      LEU  51 -10.384   7.821   3.700
  448   HD12  LEU  51          HD12      LEU  51 -11.653   7.985   4.915
  449   HD13  LEU  51          HD13      LEU  51 -10.013   7.562   5.404
  450   HD21  LEU  51          HD21      LEU  51 -13.078   6.358   3.773
  451   HD22  LEU  51          HD22      LEU  51 -11.880   6.111   2.501
  452   HD23  LEU  51          HD23      LEU  51 -12.488   4.734   3.421
  453    H    SER  52           H        SER  52 -10.356   6.501   0.668
  454    HA   SER  52           HA       SER  52  -8.086   8.233   0.461
  455    HB2  SER  52           HB2      SER  52 -10.762   8.556  -0.910
  456    HB3  SER  52           HB3      SER  52  -9.195   9.160  -1.447
  457    HG   SER  52           HG       SER  52  -8.880   7.316  -2.398
  458    H    ASP  53           H        ASP  53  -8.023   9.230   2.495
  459    HA   ASP  53           HA       ASP  53 -10.128  10.689   3.653
  460    HB2  ASP  53           HB2      ASP  53  -8.141  10.055   4.926
  461    HB3  ASP  53           HB3      ASP  53  -7.138  11.083   3.907
  462    H    ASP  54           H        ASP  54  -7.203  12.102   2.261
  463    HA   ASP  54           HA       ASP  54  -8.343  13.589   0.216
  464    HB2  ASP  54           HB2      ASP  54  -9.452  14.777   2.185
  465    HB3  ASP  54           HB3      ASP  54  -7.844  15.343   2.631
  466    H    ASP  55           H        ASP  55  -6.010  13.880   2.865
  467    HA   ASP  55           HA       ASP  55  -3.872  14.488   0.970
  468    HB2  ASP  55           HB2      ASP  55  -3.970  14.355   3.987
  469    HB3  ASP  55           HB3      ASP  55  -2.458  14.512   3.103
  470    HA   PRO  56           HA       PRO  56  -2.609  10.240   0.573
  471    HB2  PRO  56           HB2      PRO  56   0.095  10.717   0.229
  472    HB3  PRO  56           HB3      PRO  56  -1.114  10.795  -1.056
  473    HG2  PRO  56           HG2      PRO  56   0.084  13.011   0.555
  474    HG3  PRO  56           HG3      PRO  56  -0.291  12.959  -1.178
  475    HD2  PRO  56           HD2      PRO  56  -1.874  14.250   0.547
  476    HD3  PRO  56           HD3      PRO  56  -2.554  13.346  -0.822
  477    H    LYS  57           H        LYS  57  -1.054  12.446   2.815
  478    HA   LYS  57           HA       LYS  57   0.340  10.424   4.292
  479    HB2  LYS  57           HB2      LYS  57  -0.411  13.214   5.195
  480    HB3  LYS  57           HB3      LYS  57   0.844  12.188   5.877
  481    HG2  LYS  57           HG2      LYS  57   0.908  13.118   3.035
  482    HG3  LYS  57           HG3      LYS  57   1.590  14.069   4.349
  483    HD2  LYS  57           HD2      LYS  57   2.394  11.220   4.100
  484    HD3  LYS  57           HD3      LYS  57   3.032  12.364   2.921
  485    HE2  LYS  57           HE2      LYS  57   4.570  12.118   4.780
  486    HE3  LYS  57           HE3      LYS  57   3.906  13.749   4.744
  487    HZ1  LYS  57           HZ1      LYS  57   4.030  12.712   6.984
  488    HZ2  LYS  57           HZ2      LYS  57   2.850  11.594   6.492
  489    HZ3  LYS  57           HZ3      LYS  57   2.481  13.247   6.552
  490    H    LYS  58           H        LYS  58  -2.780  11.999   4.488
  491    HA   LYS  58           HA       LYS  58  -3.406  10.880   7.081
  492    HB2  LYS  58           HB2      LYS  58  -5.158  12.366   5.119
  493    HB3  LYS  58           HB3      LYS  58  -5.567  11.993   6.786
  494    HG2  LYS  58           HG2      LYS  58  -3.930  13.484   7.619
  495    HG3  LYS  58           HG3      LYS  58  -3.201  13.678   6.022
  496    HD2  LYS  58           HD2      LYS  58  -5.328  14.681   5.235
  497    HD3  LYS  58           HD3      LYS  58  -5.935  14.600   6.890
  498    HE2  LYS  58           HE2      LYS  58  -4.270  16.119   7.655
  499    HE3  LYS  58           HE3      LYS  58  -3.411  16.043   6.114
  500    HZ1  LYS  58           HZ1      LYS  58  -6.115  17.204   6.559
  501    HZ2  LYS  58           HZ2      LYS  58  -5.343  17.069   5.051
  502    HZ3  LYS  58           HZ3      LYS  58  -4.687  18.067   6.254
  503    H    GLY  59           H        GLY  59  -3.725  10.019   3.786
  504    HA2  GLY  59           HA2      GLY  59  -5.952   8.305   3.865
  505    HA3  GLY  59           HA3      GLY  59  -4.603   8.171   2.744
  506    H    ILE  60           H        ILE  60  -6.057   6.001   4.022
  507    HA   ILE  60           HA       ILE  60  -3.874   4.761   5.517
  508    HB   ILE  60           HB       ILE  60  -5.513   3.880   7.202
  509   HG12  ILE  60          HG12      ILE  60  -7.271   6.117   6.171
  510   HG13  ILE  60          HG13      ILE  60  -7.542   4.409   5.847
  511   HG21  ILE  60          HG21      ILE  60  -3.947   5.660   7.752
  512   HG22  ILE  60          HG22      ILE  60  -5.101   6.865   7.180
  513   HG23  ILE  60          HG23      ILE  60  -5.480   5.884   8.596
  514   HD11  ILE  60          HD11      ILE  60  -7.865   3.996   8.216
  515   HD12  ILE  60          HD12      ILE  60  -7.550   5.697   8.564
  516   HD13  ILE  60          HD13      ILE  60  -8.974   5.237   7.631
  517    H    TRP  61           H        TRP  61  -4.126   2.454   5.737
  518    HA   TRP  61           HA       TRP  61  -5.830   1.303   3.647
  519    HB2  TRP  61           HB2      TRP  61  -3.376   0.252   5.052
  520    HB3  TRP  61           HB3      TRP  61  -4.415  -0.775   4.070
  521    HD1  TRP  61           HD1      TRP  61  -1.826   1.995   3.792
  522    HE1  TRP  61           HE1      TRP  61  -1.092   2.220   1.336
  523    HE3  TRP  61           HE3      TRP  61  -5.278  -1.103   1.657
  524    HZ2  TRP  61           HZ2      TRP  61  -1.891   1.206  -1.178
  525    HZ3  TRP  61           HZ3      TRP  61  -5.227  -1.422  -0.780
  526    HH2  TRP  61           HH2      TRP  61  -3.567  -0.289  -2.167
  527    H    LEU  62           H        LEU  62  -7.605   0.358   4.216
  528    HA   LEU  62           HA       LEU  62  -8.306  -0.034   6.969
  529    HB2  LEU  62           HB2      LEU  62  -9.770  -0.896   4.466
  530    HB3  LEU  62           HB3      LEU  62 -10.454  -0.735   6.071
  531    HG   LEU  62           HG       LEU  62  -9.318   1.614   4.558
  532   HD11  LEU  62          HD11      LEU  62 -12.187   0.699   4.678
  533   HD12  LEU  62          HD12      LEU  62 -11.592   2.185   3.938
  534   HD13  LEU  62          HD13      LEU  62 -11.143   0.621   3.258
  535   HD21  LEU  62          HD21      LEU  62 -11.236   1.403   6.868
  536   HD22  LEU  62          HD22      LEU  62  -9.541   1.891   6.968
  537   HD23  LEU  62          HD23      LEU  62 -10.698   2.897   6.097
  538    H    GLU  63           H        GLU  63  -7.476  -1.754   8.053
  539    HA   GLU  63           HA       GLU  63  -6.802  -4.185   6.640
  540    HB2  GLU  63           HB2      GLU  63  -5.911  -4.952   8.769
  541    HB3  GLU  63           HB3      GLU  63  -5.337  -3.328   8.421
  542    HG2  GLU  63           HG2      GLU  63  -6.949  -2.396   9.972
  543    HG3  GLU  63           HG3      GLU  63  -7.606  -4.003  10.282
  544    H    ALA  64           H        ALA  64  -7.541  -6.308   7.413
  545    HA   ALA  64           HA       ALA  64 -10.383  -6.410   7.471
  546    HB1  ALA  64           HB1      ALA  64  -9.019  -8.133   6.393
  547    HB2  ALA  64           HB2      ALA  64  -8.392  -8.618   7.968
  548    HB3  ALA  64           HB3      ALA  64 -10.104  -8.824   7.599
  549    H    GLY  65           H        GLY  65  -8.130  -5.924   9.908
  550    HA2  GLY  65           HA2      GLY  65  -9.531  -7.358  11.989
  551    HA3  GLY  65           HA3      GLY  65  -8.098  -6.366  12.185
  552    H    LYS  66           H        LYS  66 -10.620  -4.780  10.505
  553    HA   LYS  66           HA       LYS  66 -12.089  -4.005  12.856
  554    HB2  LYS  66           HB2      LYS  66 -11.456  -1.828  13.098
  555    HB3  LYS  66           HB3      LYS  66  -9.935  -2.460  12.490
  556    HG2  LYS  66           HG2      LYS  66 -12.030  -1.195  10.745
  557    HG3  LYS  66           HG3      LYS  66 -10.693  -0.308  11.473
  558    HD2  LYS  66           HD2      LYS  66  -9.109  -1.381  10.164
  559    HD3  LYS  66           HD3      LYS  66 -10.180  -2.740   9.808
  560    HE2  LYS  66           HE2      LYS  66 -10.565   0.082   8.803
  561    HE3  LYS  66           HE3      LYS  66  -9.869  -1.242   7.870
  562    HZ1  LYS  66           HZ1      LYS  66 -12.152  -1.030   7.306
  563    HZ2  LYS  66           HZ2      LYS  66 -12.629  -1.047   8.932
  564    HZ3  LYS  66           HZ3      LYS  66 -11.985  -2.445   8.223
  565    H    ALA  67           H        ALA  67 -13.948  -2.604  12.304
  566    HA   ALA  67           HA       ALA  67 -15.052  -3.476   9.762
  567    HB1  ALA  67           HB1      ALA  67 -16.340  -3.636  11.860
  568    HB2  ALA  67           HB2      ALA  67 -16.328  -1.874  11.976
  569    HB3  ALA  67           HB3      ALA  67 -17.156  -2.663  10.632
  570    H    LEU  68           H        LEU  68 -16.575  -1.608   8.735
  571    HA   LEU  68           HA       LEU  68 -14.592   0.291   7.812
  572    HB2  LEU  68           HB2      LEU  68 -17.465   0.066   6.961
  573    HB3  LEU  68           HB3      LEU  68 -16.186   0.924   6.147
  574    HG   LEU  68           HG       LEU  68 -16.325  -2.069   6.482
  575   HD11  LEU  68          HD11      LEU  68 -16.754  -0.334   4.054
  576   HD12  LEU  68          HD12      LEU  68 -16.726  -2.098   4.076
  577   HD13  LEU  68          HD13      LEU  68 -18.002  -1.227   4.926
  578   HD21  LEU  68          HD21      LEU  68 -14.420  -2.096   4.952
  579   HD22  LEU  68          HD22      LEU  68 -14.383  -0.332   4.970
  580   HD23  LEU  68          HD23      LEU  68 -14.038  -1.235   6.444
  581    H    ASP  69           H        ASP  69 -17.925   0.617   9.023
  582    HA   ASP  69           HA       ASP  69 -17.791   3.415   9.402
  583    HB2  ASP  69           HB2      ASP  69 -19.936   2.427   9.112
  584    HB3  ASP  69           HB3      ASP  69 -19.679   1.306  10.439
  585    H    TYR  70           H        TYR  70 -16.512   0.862  11.217
  586    HA   TYR  70           HA       TYR  70 -16.328   1.956  13.764
  587    HB2  TYR  70           HB2      TYR  70 -15.448  -0.186  13.634
  588    HB3  TYR  70           HB3      TYR  70 -14.600   0.127  12.126
  589    HD1  TYR  70           HD1      TYR  70 -14.481   0.586  15.789
  590    HD2  TYR  70           HD2      TYR  70 -12.377   0.935  12.113
  591    HE1  TYR  70           HE1      TYR  70 -12.384   0.931  17.028
  592    HE2  TYR  70           HE2      TYR  70 -10.279   1.283  13.335
  593    HH   TYR  70           HH       TYR  70  -9.928   0.634  16.610
  594    H    TYR  71           H        TYR  71 -14.574   2.664  10.806
  595    HA   TYR  71           HA       TYR  71 -13.000   4.754  11.994
  596    HB2  TYR  71           HB2      TYR  71 -13.311   3.529   9.308
  597    HB3  TYR  71           HB3      TYR  71 -12.703   5.170   9.374
  598    HD1  TYR  71           HD1      TYR  71 -10.645   5.644  10.774
  599    HD2  TYR  71           HD2      TYR  71 -11.922   1.704   9.807
  600    HE1  TYR  71           HE1      TYR  71  -8.406   4.790  11.331
  601    HE2  TYR  71           HE2      TYR  71  -9.685   0.843  10.367
  602    HH   TYR  71           HH       TYR  71  -7.434   2.539  12.095
  603    H    MET  72           H        MET  72 -13.234   6.749  10.010
  604    HA   MET  72           HA       MET  72 -15.735   7.944  10.924
  605    HB2  MET  72           HB2      MET  72 -13.256   9.166   9.708
  606    HB3  MET  72           HB3      MET  72 -14.691  10.078  10.153
  607    HG2  MET  72           HG2      MET  72 -14.400   9.451  12.473
  608    HG3  MET  72           HG3      MET  72 -13.000   8.467  12.048
  609    HE1  MET  72           HE1      MET  72 -11.495  10.209   9.911
  610    HE2  MET  72           HE2      MET  72 -10.394  11.144  10.924
  611    HE3  MET  72           HE3      MET  72 -10.675   9.437  11.268
  612    H    LEU  73           H        LEU  73 -15.331   6.029   8.550
  613    HA   LEU  73           HA       LEU  73 -16.258   7.775   6.397
  614    HB2  LEU  73           HB2      LEU  73 -16.024   5.768   4.949
  615    HB3  LEU  73           HB3      LEU  73 -14.529   6.317   5.674
  616    HG   LEU  73           HG       LEU  73 -14.900   4.471   7.422
  617   HD11  LEU  73          HD11      LEU  73 -17.205   3.945   6.953
  618   HD12  LEU  73          HD12      LEU  73 -16.799   3.535   5.284
  619   HD13  LEU  73          HD13      LEU  73 -16.183   2.546   6.609
  620   HD21  LEU  73          HD21      LEU  73 -14.006   2.746   5.876
  621   HD22  LEU  73          HD22      LEU  73 -14.318   3.862   4.545
  622   HD23  LEU  73          HD23      LEU  73 -13.162   4.298   5.806
  623    H    ARG  74           H        ARG  74 -18.134   7.503   5.340
  624    HA   ARG  74           HA       ARG  74 -20.177   5.720   6.385
  625    HB2  ARG  74           HB2      ARG  74 -20.579   8.713   6.581
  626    HB3  ARG  74           HB3      ARG  74 -21.698   7.466   7.081
  627    HG2  ARG  74           HG2      ARG  74 -20.540   7.012   8.997
  628    HG3  ARG  74           HG3      ARG  74 -19.012   7.618   8.345
  629    HD2  ARG  74           HD2      ARG  74 -21.411   9.301   9.046
  630    HD3  ARG  74           HD3      ARG  74 -19.971   9.114  10.030
  631    HE   ARG  74           HE       ARG  74 -19.481  10.065   7.348
  632   HH11  ARG  74          HH11      ARG  74 -20.093  10.952  10.681
  633   HH12  ARG  74          HH12      ARG  74 -19.400  12.540  10.513
  634   HH21  ARG  74          HH21      ARG  74 -18.606  12.151   7.115
  635   HH22  ARG  74          HH22      ARG  74 -18.557  13.225   8.478
  636    H    ASN  75           H        ASN  75 -22.326   7.292   5.425
  637    HA   ASN  75           HA       ASN  75 -22.338   6.606   2.685
  638    HB2  ASN  75           HB2      ASN  75 -24.175   8.060   4.518
  639    HB3  ASN  75           HB3      ASN  75 -24.392   8.320   2.790
  640   HD21  ASN  75          HD21      ASN  75 -24.523   5.997   5.380
  641   HD22  ASN  75          HD22      ASN  75 -25.416   4.796   4.504
  642    H    GLY  76           H        GLY  76 -21.183   7.574   1.165
  643    HA2  GLY  76           HA2      GLY  76 -21.197   9.550  -0.281
  644    HA3  GLY  76           HA3      GLY  76 -21.153  10.531   1.176
  645    H    ASP  77           H        ASP  77 -19.164   8.211   2.048
  646    HA   ASP  77           HA       ASP  77 -16.831   9.760   1.369
  647    HB2  ASP  77           HB2      ASP  77 -17.299   7.340   3.082
  648    HB3  ASP  77           HB3      ASP  77 -15.661   7.820   2.643
  649    H    THR  78           H        THR  78 -15.076   9.121   0.169
  650    HA   THR  78           HA       THR  78 -15.622   7.064  -1.820
  651    HB   THR  78           HB       THR  78 -13.279   8.975  -1.675
  652    HG1  THR  78           HG1      THR  78 -15.760   9.650  -1.936
  653   HG21  THR  78          HG21      THR  78 -12.985   7.059  -3.188
  654   HG22  THR  78          HG22      THR  78 -13.124   8.573  -4.080
  655   HG23  THR  78          HG23      THR  78 -14.499   7.471  -3.994
  656    H    MET  79           H        MET  79 -14.728   5.094  -1.702
  657    HA   MET  79           HA       MET  79 -12.431   4.736   0.101
  658    HB2  MET  79           HB2      MET  79 -14.673   3.774   0.915
  659    HB3  MET  79           HB3      MET  79 -14.510   2.611  -0.394
  660    HG2  MET  79           HG2      MET  79 -12.339   1.911   0.541
  661    HG3  MET  79           HG3      MET  79 -12.593   3.015   1.890
  662    HE1  MET  79           HE1      MET  79 -15.064   0.509  -0.002
  663    HE2  MET  79           HE2      MET  79 -13.499  -0.296   0.178
  664    HE3  MET  79           HE3      MET  79 -14.903  -0.873   1.082
  665    H    GLU  80           H        GLU  80 -10.735   4.233  -1.053
  666    HA   GLU  80           HA       GLU  80 -11.051   3.465  -3.821
  667    HB2  GLU  80           HB2      GLU  80  -9.372   5.139  -2.663
  668    HB3  GLU  80           HB3      GLU  80  -8.416   3.687  -2.415
  669    HG2  GLU  80           HG2      GLU  80  -8.230   3.319  -4.755
  670    HG3  GLU  80           HG3      GLU  80  -9.408   4.587  -5.103
  671    H    TYR  81           H        TYR  81 -11.021   1.365  -4.518
  672    HA   TYR  81           HA       TYR  81  -9.830  -0.645  -2.759
  673    HB2  TYR  81           HB2      TYR  81 -12.153  -1.057  -3.591
  674    HB3  TYR  81           HB3      TYR  81 -11.540  -1.018  -5.239
  675    HD1  TYR  81           HD1      TYR  81 -10.150  -2.877  -6.091
  676    HD2  TYR  81           HD2      TYR  81 -11.815  -2.979  -2.177
  677    HE1  TYR  81           HE1      TYR  81  -9.729  -5.300  -5.978
  678    HE2  TYR  81           HE2      TYR  81 -11.397  -5.400  -2.053
  679    HH   TYR  81           HH       TYR  81  -9.397  -7.027  -4.214
  680    H    ARG  82           H        ARG  82  -7.750  -0.860  -3.163
  681    HA   ARG  82           HA       ARG  82  -6.874  -0.788  -5.942
  682    HB2  ARG  82           HB2      ARG  82  -4.974   0.709  -5.381
  683    HB3  ARG  82           HB3      ARG  82  -6.545   1.488  -5.281
  684    HG2  ARG  82           HG2      ARG  82  -6.508   1.273  -2.855
  685    HG3  ARG  82           HG3      ARG  82  -4.939   0.469  -2.948
  686    HD2  ARG  82           HD2      ARG  82  -5.538   3.274  -3.883
  687    HD3  ARG  82           HD3      ARG  82  -4.724   2.847  -2.379
  688    HE   ARG  82           HE       ARG  82  -3.142   1.655  -4.163
  689   HH11  ARG  82          HH11      ARG  82  -4.584   4.853  -4.273
  690   HH12  ARG  82          HH12      ARG  82  -3.214   5.572  -5.068
  691   HH21  ARG  82          HH21      ARG  82  -1.370   2.585  -5.239
  692   HH22  ARG  82          HH22      ARG  82  -1.381   4.287  -5.618
  693    H    LYS  83           H        LYS  83  -4.685  -1.518  -6.246
  694    HA   LYS  83           HA       LYS  83  -4.129  -3.921  -4.941
  695    HB2  LYS  83           HB2      LYS  83  -3.332  -3.158  -7.215
  696    HB3  LYS  83           HB3      LYS  83  -2.147  -2.159  -6.390
  697    HG2  LYS  83           HG2      LYS  83  -1.066  -4.094  -5.478
  698    HG3  LYS  83           HG3      LYS  83  -2.330  -5.151  -6.123
  699    HD2  LYS  83           HD2      LYS  83  -1.704  -4.427  -8.404
  700    HD3  LYS  83           HD3      LYS  83  -0.390  -3.473  -7.713
  701    HE2  LYS  83           HE2      LYS  83   0.517  -5.544  -8.495
  702    HE3  LYS  83           HE3      LYS  83   0.527  -5.563  -6.729
  703    HZ1  LYS  83           HZ1      LYS  83  -1.377  -6.972  -6.719
  704    HZ2  LYS  83           HZ2      LYS  83  -0.258  -7.660  -7.790
  705    HZ3  LYS  83           HZ3      LYS  83  -1.600  -6.811  -8.390
  706    H    LYS  84           H        LYS  84  -3.133  -4.378  -3.083
  707    HA   LYS  84           HA       LYS  84  -2.549  -2.532  -1.101
  708    HB2  LYS  84           HB2      LYS  84  -1.654  -5.357  -1.582
  709    HB3  LYS  84           HB3      LYS  84  -0.989  -4.448  -0.236
  710    HG2  LYS  84           HG2      LYS  84  -3.928  -4.933  -0.667
  711    HG3  LYS  84           HG3      LYS  84  -2.889  -5.914   0.368
  712    HD2  LYS  84           HD2      LYS  84  -2.299  -3.721   1.544
  713    HD3  LYS  84           HD3      LYS  84  -3.688  -3.038   0.700
  714    HE2  LYS  84           HE2      LYS  84  -4.431  -3.712   2.860
  715    HE3  LYS  84           HE3      LYS  84  -5.081  -4.866   1.697
  716    HZ1  LYS  84           HZ1      LYS  84  -3.312  -6.406   2.282
  717    HZ2  LYS  84           HZ2      LYS  84  -4.213  -5.977   3.654
  718    HZ3  LYS  84           HZ3      LYS  84  -2.682  -5.294   3.399
  719    H    GLN  85           H        GLN  85  -0.592  -3.688  -3.716
  720    HA   GLN  85           HA       GLN  85   1.823  -2.515  -2.614
  721    HB2  GLN  85           HB2      GLN  85   2.166  -3.801  -5.160
  722    HB3  GLN  85           HB3      GLN  85   2.887  -4.200  -3.607
  723    HG2  GLN  85           HG2      GLN  85   0.625  -5.303  -3.108
  724    HG3  GLN  85           HG3      GLN  85   0.384  -5.251  -4.850
  725   HE21  GLN  85          HE21      GLN  85   2.136  -6.619  -2.231
  726   HE22  GLN  85          HE22      GLN  85   2.943  -7.859  -3.133
  727    H    ARG  86           H        ARG  86   3.116  -1.168  -3.806
  728    HA   ARG  86           HA       ARG  86   1.913   0.099  -6.162
  729    HB2  ARG  86           HB2      ARG  86   3.307   2.158  -5.106
  730    HB3  ARG  86           HB3      ARG  86   1.602   1.876  -4.791
  731    HG2  ARG  86           HG2      ARG  86   2.448   2.235  -2.678
  732    HG3  ARG  86           HG3      ARG  86   2.444   0.476  -2.786
  733    HD2  ARG  86           HD2      ARG  86   4.522   1.120  -1.824
  734    HD3  ARG  86           HD3      ARG  86   4.853   0.608  -3.481
  735    HE   ARG  86           HE       ARG  86   5.462   2.759  -4.003
  736   HH11  ARG  86          HH11      ARG  86   3.966   2.695  -0.847
  737   HH12  ARG  86          HH12      ARG  86   4.311   4.359  -0.496
  738   HH21  ARG  86          HH21      ARG  86   5.922   4.980  -3.542
  739   HH22  ARG  86          HH22      ARG  86   5.398   5.654  -2.033
  740    HA   PRO  87           HA       PRO  87   5.601  -0.868  -8.243
  741    HB2  PRO  87           HB2      PRO  87   5.601   1.737  -9.607
  742    HB3  PRO  87           HB3      PRO  87   5.375   0.119 -10.275
  743    HG2  PRO  87           HG2      PRO  87   3.344   1.872 -10.084
  744    HG3  PRO  87           HG3      PRO  87   3.105   0.127  -9.888
  745    HD2  PRO  87           HD2      PRO  87   3.283   2.265  -7.800
  746    HD3  PRO  87           HD3      PRO  87   2.203   0.856  -7.884
  747    H    LEU  88           H        LEU  88   7.353  -0.916  -6.983
  748    HA   LEU  88           HA       LEU  88   8.571   1.630  -6.182
  749    HB2  LEU  88           HB2      LEU  88   8.561  -1.077  -4.921
  750    HB3  LEU  88           HB3      LEU  88   9.879   0.034  -4.589
  751    HG   LEU  88           HG       LEU  88   6.962   0.666  -4.140
  752   HD11  LEU  88          HD11      LEU  88   9.103  -0.122  -2.174
  753   HD12  LEU  88          HD12      LEU  88   7.491   0.463  -1.758
  754   HD13  LEU  88          HD13      LEU  88   7.679  -1.067  -2.613
  755   HD21  LEU  88          HD21      LEU  88   8.290   2.625  -4.603
  756   HD22  LEU  88          HD22      LEU  88   7.881   2.580  -2.887
  757   HD23  LEU  88          HD23      LEU  88   9.500   2.122  -3.423
  758    H    LYS  89           H        LYS  89  10.400   2.238  -7.102
  759    HA   LYS  89           HA       LYS  89  11.838   0.295  -8.731
  760    HB2  LYS  89           HB2      LYS  89  11.974   3.304  -8.607
  761    HB3  LYS  89           HB3      LYS  89  13.116   2.331  -9.529
  762    HG2  LYS  89           HG2      LYS  89  10.958   1.309 -10.573
  763    HG3  LYS  89           HG3      LYS  89  10.216   2.805 -10.002
  764    HD2  LYS  89           HD2      LYS  89  12.724   2.780 -11.652
  765    HD3  LYS  89           HD3      LYS  89  11.120   2.783 -12.376
  766    HE2  LYS  89           HE2      LYS  89  10.599   4.877 -11.239
  767    HE3  LYS  89           HE3      LYS  89  12.180   4.856 -10.458
  768    HZ1  LYS  89           HZ1      LYS  89  13.234   5.061 -12.600
  769    HZ2  LYS  89           HZ2      LYS  89  12.113   6.320 -12.409
  770    HZ3  LYS  89           HZ3      LYS  89  11.738   4.991 -13.397
  771    H    ILE  90           H        ILE  90  13.511  -0.672  -7.977
  772    HA   ILE  90           HA       ILE  90  14.878   0.444  -5.611
  773    HB   ILE  90           HB       ILE  90  14.282  -2.491  -6.040
  774   HG12  ILE  90          HG12      ILE  90  12.201  -1.242  -5.597
  775   HG13  ILE  90          HG13      ILE  90  12.620  -2.303  -4.257
  776   HG21  ILE  90          HG21      ILE  90  15.413  -0.999  -3.679
  777   HG22  ILE  90          HG22      ILE  90  15.004  -2.714  -3.696
  778   HG23  ILE  90          HG23      ILE  90  16.283  -2.102  -4.745
  779   HD11  ILE  90          HD11      ILE  90  13.070   0.670  -4.366
  780   HD12  ILE  90          HD12      ILE  90  11.808  -0.164  -3.460
  781   HD13  ILE  90          HD13      ILE  90  13.502  -0.387  -3.023
  782    H    ARG  91           H        ARG  91  17.111   0.314  -5.663
  783    HA   ARG  91           HA       ARG  91  18.285  -1.219  -7.874
  784    HB2  ARG  91           HB2      ARG  91  18.597   1.261  -7.933
  785    HB3  ARG  91           HB3      ARG  91  19.448   1.148  -6.400
  786    HG2  ARG  91           HG2      ARG  91  21.234  -0.057  -7.373
  787    HG3  ARG  91           HG3      ARG  91  20.334  -0.303  -8.873
  788    HD2  ARG  91           HD2      ARG  91  21.261   2.357  -7.792
  789    HD3  ARG  91           HD3      ARG  91  22.027   1.457  -9.102
  790    HE   ARG  91           HE       ARG  91  19.286   2.546  -9.252
  791   HH11  ARG  91          HH11      ARG  91  22.401   1.854 -10.674
  792   HH12  ARG  91          HH12      ARG  91  21.950   2.420 -12.258
  793   HH21  ARG  91          HH21      ARG  91  18.680   3.322 -11.322
  794   HH22  ARG  91          HH22      ARG  91  19.830   3.254 -12.630
  795    H    MET  92           H        MET  92  19.564  -2.884  -7.354
  796    HA   MET  92           HA       MET  92  19.973  -3.561  -4.583
  797    HB2  MET  92           HB2      MET  92  20.797  -4.956  -7.136
  798    HB3  MET  92           HB3      MET  92  21.074  -5.604  -5.530
  799    HG2  MET  92           HG2      MET  92  19.177  -6.712  -6.087
  800    HG3  MET  92           HG3      MET  92  18.487  -5.289  -5.312
  801    HE1  MET  92           HE1      MET  92  16.277  -3.784  -7.806
  802    HE2  MET  92           HE2      MET  92  16.308  -4.634  -6.261
  803    HE3  MET  92           HE3      MET  92  17.416  -3.293  -6.551
  804    H    LEU  93           H        LEU  93  22.194  -4.629  -4.123
  805    HA   LEU  93           HA       LEU  93  23.957  -2.555  -3.606
  806    HB2  LEU  93           HB2      LEU  93  24.664  -5.488  -3.769
  807    HB3  LEU  93           HB3      LEU  93  25.567  -4.255  -2.920
  808    HG   LEU  93           HG       LEU  93  24.485  -5.389  -1.222
  809   HD11  LEU  93          HD11      LEU  93  22.761  -3.907  -0.334
  810   HD12  LEU  93          HD12      LEU  93  24.142  -3.014  -0.975
  811   HD13  LEU  93          HD13      LEU  93  22.645  -3.112  -1.904
  812   HD21  LEU  93          HD21      LEU  93  21.861  -5.367  -2.695
  813   HD22  LEU  93          HD22      LEU  93  23.012  -6.703  -2.774
  814   HD23  LEU  93          HD23      LEU  93  22.283  -6.253  -1.234
  815    H    ASP  94           H        ASP  94  23.927  -4.912  -6.208
  816    HA   ASP  94           HA       ASP  94  26.546  -4.297  -7.171
  817    HB2  ASP  94           HB2      ASP  94  25.293  -6.472  -7.516
  818    HB3  ASP  94           HB3      ASP  94  24.314  -5.631  -8.712
  819    H    GLY  95           H        GLY  95  23.564  -2.718  -7.418
  820    HA2  GLY  95           HA2      GLY  95  23.427  -0.559  -8.450
  821    HA3  GLY  95           HA3      GLY  95  24.584  -1.097  -9.659
  822    H    THR  96           H        THR  96  22.333  -3.493  -8.995
  823    HA   THR  96           HA       THR  96  21.117  -3.206 -11.586
  824    HB   THR  96           HB       THR  96  20.357  -5.168  -9.419
  825    HG1  THR  96           HG1      THR  96  22.616  -5.105 -11.124
  826   HG21  THR  96          HG21      THR  96  19.824  -6.621 -11.340
  827   HG22  THR  96          HG22      THR  96  20.251  -5.305 -12.434
  828   HG23  THR  96          HG23      THR  96  18.875  -5.135 -11.342
  829    H    VAL  97           H        VAL  97  19.110  -2.310 -12.002
  830    HA   VAL  97           HA       VAL  97  17.516  -1.660  -9.614
  831    HB   VAL  97           HB       VAL  97  18.390   0.348 -10.698
  832   HG11  VAL  97          HG11      VAL  97  17.609   1.033 -12.901
  833   HG12  VAL  97          HG12      VAL  97  18.561  -0.450 -12.973
  834   HG13  VAL  97          HG13      VAL  97  16.805  -0.524 -13.097
  835   HG21  VAL  97          HG21      VAL  97  16.285   1.573 -10.918
  836   HG22  VAL  97          HG22      VAL  97  15.407   0.046 -11.006
  837   HG23  VAL  97          HG23      VAL  97  16.265   0.486  -9.530
  838    H    LYS  98           H        LYS  98  15.446  -2.138  -9.528
  839    HA   LYS  98           HA       LYS  98  14.089  -3.243 -11.875
  840    HB2  LYS  98           HB2      LYS  98  13.356  -5.255 -10.830
  841    HB3  LYS  98           HB3      LYS  98  15.096  -5.178 -10.611
  842    HG2  LYS  98           HG2      LYS  98  14.903  -4.689  -8.328
  843    HG3  LYS  98           HG3      LYS  98  13.201  -4.246  -8.481
  844    HD2  LYS  98           HD2      LYS  98  14.232  -7.032  -8.988
  845    HD3  LYS  98           HD3      LYS  98  13.655  -6.503  -7.405
  846    HE2  LYS  98           HE2      LYS  98  11.775  -7.488  -8.315
  847    HE3  LYS  98           HE3      LYS  98  11.530  -5.784  -8.700
  848    HZ1  LYS  98           HZ1      LYS  98  12.354  -6.209 -10.938
  849    HZ2  LYS  98           HZ2      LYS  98  11.031  -7.205 -10.588
  850    HZ3  LYS  98           HZ3      LYS  98  12.605  -7.842 -10.560
  851    H    THR  99           H        THR  99  11.734  -3.331 -11.628
  852    HA   THR  99           HA       THR  99  10.777  -1.578  -9.470
  853    HB   THR  99           HB       THR  99   9.467  -2.112 -12.149
  854    HG1  THR  99           HG1      THR  99  11.509  -0.659 -11.845
  855   HG21  THR  99          HG21      THR  99   7.867  -1.621 -10.367
  856   HG22  THR  99          HG22      THR  99   7.964  -0.281 -11.510
  857   HG23  THR  99          HG23      THR  99   8.771  -0.166  -9.946
  858    H    ILE 100           H        ILE 100   9.733  -2.688  -7.920
  859    HA   ILE 100           HA       ILE 100   8.197  -5.062  -8.718
  860    HB   ILE 100           HB       ILE 100  10.335  -5.712  -7.624
  861   HG12  ILE 100          HG12      ILE 100   7.970  -6.882  -7.325
  862   HG13  ILE 100          HG13      ILE 100   9.404  -7.476  -6.501
  863   HG21  ILE 100          HG21      ILE 100  10.658  -3.816  -6.168
  864   HG22  ILE 100          HG22      ILE 100   9.230  -4.258  -5.231
  865   HG23  ILE 100          HG23      ILE 100  10.648  -5.307  -5.224
  866   HD11  ILE 100          HD11      ILE 100   7.493  -7.437  -5.016
  867   HD12  ILE 100          HD12      ILE 100   8.720  -6.292  -4.475
  868   HD13  ILE 100          HD13      ILE 100   7.278  -5.711  -5.307
  869    H    MET 101           H        MET 101   6.250  -5.360  -7.591
  870    HA   MET 101           HA       MET 101   5.280  -2.898  -6.383
  871    HB2  MET 101           HB2      MET 101   3.805  -5.413  -7.142
  872    HB3  MET 101           HB3      MET 101   3.067  -3.915  -6.590
  873    HG2  MET 101           HG2      MET 101   4.435  -2.913  -8.611
  874    HG3  MET 101           HG3      MET 101   4.312  -4.572  -9.198
  875    HE1  MET 101           HE1      MET 101   1.644  -2.718  -6.938
  876    HE2  MET 101           HE2      MET 101   2.443  -1.473  -7.903
  877    HE3  MET 101           HE3      MET 101   0.745  -1.857  -8.190
  878    H    VAL 102           H        VAL 102   5.495  -2.597  -4.402
  879    HA   VAL 102           HA       VAL 102   5.271  -4.858  -2.519
  880    HB   VAL 102           HB       VAL 102   6.673  -2.373  -1.680
  881   HG11  VAL 102          HG11      VAL 102   7.032  -5.314  -1.169
  882   HG12  VAL 102          HG12      VAL 102   8.079  -4.062  -0.509
  883   HG13  VAL 102          HG13      VAL 102   6.375  -4.103  -0.068
  884   HG21  VAL 102          HG21      VAL 102   7.921  -4.422  -3.509
  885   HG22  VAL 102          HG22      VAL 102   7.661  -2.710  -3.857
  886   HG23  VAL 102          HG23      VAL 102   8.811  -3.193  -2.608
  887    H    ASP 103           H        ASP 103   4.000  -4.644  -0.744
  888    HA   ASP 103           HA       ASP 103   1.725  -3.039  -0.992
  889    HB2  ASP 103           HB2      ASP 103   2.594  -4.209   1.637
  890    HB3  ASP 103           HB3      ASP 103   0.960  -3.977   1.025
  891    H    ASP 104           H        ASP 104   1.164  -1.089  -0.302
  892    HA   ASP 104           HA       ASP 104   3.111   0.563   1.099
  893    HB2  ASP 104           HB2      ASP 104   1.919   1.553  -0.776
  894    HB3  ASP 104           HB3      ASP 104   0.368   1.164  -0.043
  895    H    SER 105           H        SER 105   0.665  -1.537   1.881
  896    HA   SER 105           HA       SER 105  -0.457  -0.156   4.128
  897    HB2  SER 105           HB2      SER 105  -1.396  -2.543   4.537
  898    HB3  SER 105           HB3      SER 105  -1.926  -1.648   3.110
  899    HG   SER 105           HG       SER 105  -0.644  -4.005   3.238
  900    H    LYS 106           H        LYS 106   2.537  -1.406   3.784
  901    HA   LYS 106           HA       LYS 106   2.687  -2.177   6.608
  902    HB2  LYS 106           HB2      LYS 106   4.458  -3.873   5.817
  903    HB3  LYS 106           HB3      LYS 106   2.759  -4.265   5.599
  904    HG2  LYS 106           HG2      LYS 106   3.401  -4.780   3.520
  905    HG3  LYS 106           HG3      LYS 106   3.280  -3.048   3.254
  906    HD2  LYS 106           HD2      LYS 106   5.620  -2.745   3.549
  907    HD3  LYS 106           HD3      LYS 106   5.818  -4.401   4.132
  908    HE2  LYS 106           HE2      LYS 106   4.957  -3.606   1.354
  909    HE3  LYS 106           HE3      LYS 106   6.572  -4.144   1.813
  910    HZ1  LYS 106           HZ1      LYS 106   4.065  -5.737   1.871
  911    HZ2  LYS 106           HZ2      LYS 106   5.522  -6.261   2.562
  912    HZ3  LYS 106           HZ3      LYS 106   5.423  -5.991   0.888
  913    H    THR 107           H        THR 107   5.210  -2.502   7.116
  914    HA   THR 107           HA       THR 107   6.263   0.177   6.745
  915    HB   THR 107           HB       THR 107   7.920  -0.570   8.505
  916    HG1  THR 107           HG1      THR 107   7.521  -2.522   9.537
  917   HG21  THR 107          HG21      THR 107   4.981  -0.765   9.184
  918   HG22  THR 107          HG22      THR 107   5.920   0.724   9.070
  919   HG23  THR 107          HG23      THR 107   6.286  -0.454  10.331
  920    H    VAL 108           H        VAL 108   8.909  -0.063   7.085
  921    HA   VAL 108           HA       VAL 108   9.822  -0.502   4.463
  922    HB   VAL 108           HB       VAL 108  11.432  -0.237   6.989
  923   HG11  VAL 108          HG11      VAL 108  13.203   0.607   5.521
  924   HG12  VAL 108          HG12      VAL 108  12.762  -1.058   5.144
  925   HG13  VAL 108          HG13      VAL 108  12.191   0.259   4.120
  926   HG21  VAL 108          HG21      VAL 108   9.919   1.621   6.815
  927   HG22  VAL 108          HG22      VAL 108  11.547   2.167   6.417
  928   HG23  VAL 108          HG23      VAL 108  10.373   1.881   5.133
  929    H    THR 109           H        THR 109  10.697  -2.111   7.451
  930    HA   THR 109           HA       THR 109  12.329  -4.106   6.665
  931    HB   THR 109           HB       THR 109  10.105  -4.482   8.670
  932    HG1  THR 109           HG1      THR 109  12.132  -3.694   9.991
  933   HG21  THR 109          HG21      THR 109  11.388  -6.520   8.195
  934   HG22  THR 109          HG22      THR 109  11.738  -5.917   9.816
  935   HG23  THR 109          HG23      THR 109  12.891  -5.652   8.507
  936    H    ASP 110           H        ASP 110   8.760  -4.334   6.602
  937    HA   ASP 110           HA       ASP 110   8.719  -6.994   5.622
  938    HB2  ASP 110           HB2      ASP 110   6.809  -5.823   6.763
  939    HB3  ASP 110           HB3      ASP 110   6.572  -4.886   5.292
  940    H    MET 111           H        MET 111   8.637  -3.826   4.085
  941    HA   MET 111           HA       MET 111   8.303  -4.667   1.423
  942    HB2  MET 111           HB2      MET 111   7.981  -2.389   1.751
  943    HB3  MET 111           HB3      MET 111   9.422  -2.222   2.739
  944    HG2  MET 111           HG2      MET 111  10.819  -2.454   0.748
  945    HG3  MET 111           HG3      MET 111   9.377  -2.630  -0.245
  946    HE1  MET 111           HE1      MET 111  10.846  -0.333   2.545
  947    HE2  MET 111           HE2      MET 111   9.983   1.178   2.238
  948    HE3  MET 111           HE3      MET 111   9.094  -0.250   2.772
  949    H    LEU 112           H        LEU 112  11.235  -4.108   3.348
  950    HA   LEU 112           HA       LEU 112  13.093  -4.653   1.302
  951    HB2  LEU 112           HB2      LEU 112  13.407  -3.664   3.704
  952    HB3  LEU 112           HB3      LEU 112  13.628  -5.340   4.168
  953    HG   LEU 112           HG       LEU 112  15.475  -5.463   2.429
  954   HD11  LEU 112          HD11      LEU 112  14.820  -3.512   1.125
  955   HD12  LEU 112          HD12      LEU 112  15.120  -2.469   2.516
  956   HD13  LEU 112          HD13      LEU 112  16.458  -3.325   1.751
  957   HD21  LEU 112          HD21      LEU 112  15.779  -3.550   4.737
  958   HD22  LEU 112          HD22      LEU 112  15.947  -5.304   4.802
  959   HD23  LEU 112          HD23      LEU 112  17.100  -4.340   3.878
  960    H    MET 113           H        MET 113  11.545  -6.687   3.721
  961    HA   MET 113           HA       MET 113  12.725  -9.157   3.184
  962    HB2  MET 113           HB2      MET 113  11.189  -8.690   5.063
  963    HB3  MET 113           HB3      MET 113   9.856  -8.543   3.931
  964    HG2  MET 113           HG2      MET 113  10.363 -10.937   3.255
  965    HG3  MET 113           HG3      MET 113  11.391 -11.006   4.685
  966    HE1  MET 113           HE1      MET 113   9.652  -9.011   6.605
  967    HE2  MET 113           HE2      MET 113   8.722 -10.203   7.512
  968    HE3  MET 113           HE3      MET 113  10.432 -10.485   7.184
  969    H    THR 114           H        THR 114  10.169  -7.423   1.601
  970    HA   THR 114           HA       THR 114   9.376  -9.530  -0.149
  971    HB   THR 114           HB       THR 114   8.851  -6.562  -0.187
  972    HG1  THR 114           HG1      THR 114   7.963  -7.762   1.589
  973   HG21  THR 114          HG21      THR 114   7.568  -8.758  -1.823
  974   HG22  THR 114          HG22      THR 114   8.591  -7.457  -2.440
  975   HG23  THR 114          HG23      THR 114   7.012  -7.086  -1.747
  976    H    ILE 115           H        ILE 115  11.555  -6.738  -0.410
  977    HA   ILE 115           HA       ILE 115  11.832  -6.867  -3.239
  978    HB   ILE 115           HB       ILE 115  13.621  -5.563  -1.179
  979   HG12  ILE 115          HG12      ILE 115  11.503  -4.329  -2.952
  980   HG13  ILE 115          HG13      ILE 115  11.253  -4.751  -1.260
  981   HG21  ILE 115          HG21      ILE 115  13.507  -5.192  -4.172
  982   HG22  ILE 115          HG22      ILE 115  14.473  -4.226  -3.056
  983   HG23  ILE 115          HG23      ILE 115  14.816  -5.945  -3.261
  984   HD11  ILE 115          HD11      ILE 115  12.997  -3.177  -0.611
  985   HD12  ILE 115          HD12      ILE 115  13.252  -2.760  -2.305
  986   HD13  ILE 115          HD13      ILE 115  11.716  -2.384  -1.526
  987    H    CYS 116           H        CYS 116  13.809  -8.013  -0.520
  988    HA   CYS 116           HA       CYS 116  15.995  -8.882  -2.064
  989    HB2  CYS 116           HB2      CYS 116  16.652 -10.161  -0.077
  990    HB3  CYS 116           HB3      CYS 116  16.136  -8.536   0.363
  991    HG   CYS 116           HG       CYS 116  14.866 -11.499   1.234
  992    H    ALA 117           H        ALA 117  12.943 -10.368  -1.243
  993    HA   ALA 117           HA       ALA 117  13.628 -13.029  -1.946
  994    HB1  ALA 117           HB1      ALA 117  11.745 -12.485  -0.478
  995    HB2  ALA 117           HB2      ALA 117  10.915 -11.715  -1.830
  996    HB3  ALA 117           HB3      ALA 117  11.231 -13.450  -1.861
  997    H    ARG 118           H        ARG 118  12.639 -10.232  -3.773
  998    HA   ARG 118           HA       ARG 118  11.752 -11.655  -6.085
  999    HB2  ARG 118           HB2      ARG 118  12.877  -8.843  -6.132
 1000    HB3  ARG 118           HB3      ARG 118  11.705  -9.571  -7.223
 1001    HG2  ARG 118           HG2      ARG 118  11.251  -8.829  -4.346
 1002    HG3  ARG 118           HG3      ARG 118  10.604  -8.014  -5.769
 1003    HD2  ARG 118           HD2      ARG 118   9.996 -10.861  -4.984
 1004    HD3  ARG 118           HD3      ARG 118   8.967  -9.472  -4.639
 1005    HE   ARG 118           HE       ARG 118   9.593  -9.807  -7.438
 1006   HH11  ARG 118          HH11      ARG 118   7.434 -10.747  -4.831
 1007   HH12  ARG 118          HH12      ARG 118   6.086 -11.040  -5.893
 1008   HH21  ARG 118          HH21      ARG 118   7.798 -10.212  -8.826
 1009   HH22  ARG 118          HH22      ARG 118   6.296 -10.759  -8.139
 1010    H    ILE 119           H        ILE 119  14.801 -10.216  -5.053
 1011    HA   ILE 119           HA       ILE 119  16.192 -10.738  -7.484
 1012    HB   ILE 119           HB       ILE 119  17.636 -10.499  -4.877
 1013   HG12  ILE 119          HG12      ILE 119  15.789  -8.862  -4.706
 1014   HG13  ILE 119          HG13      ILE 119  17.359  -8.081  -4.829
 1015   HG21  ILE 119          HG21      ILE 119  18.897 -10.717  -6.940
 1016   HG22  ILE 119          HG22      ILE 119  18.073  -9.307  -7.610
 1017   HG23  ILE 119          HG23      ILE 119  19.150  -9.124  -6.226
 1018   HD11  ILE 119          HD11      ILE 119  16.947  -7.618  -7.181
 1019   HD12  ILE 119          HD12      ILE 119  15.373  -8.407  -7.061
 1020   HD13  ILE 119          HD13      ILE 119  15.690  -6.930  -6.152
 1021    H    GLY 120           H        GLY 120  16.017 -12.301  -4.321
 1022    HA2  GLY 120           HA2      GLY 120  16.215 -14.788  -4.335
 1023    HA3  GLY 120           HA3      GLY 120  17.589 -14.555  -5.410
 1024    H    ILE 121           H        ILE 121  17.063 -12.304  -2.867
 1025    HA   ILE 121           HA       ILE 121  19.477 -13.254  -1.516
 1026    HB   ILE 121           HB       ILE 121  17.977 -10.666  -1.067
 1027   HG12  ILE 121          HG12      ILE 121  20.481 -11.106  -2.705
 1028   HG13  ILE 121          HG13      ILE 121  18.877 -10.853  -3.386
 1029   HG21  ILE 121          HG21      ILE 121  20.048  -9.942   0.021
 1030   HG22  ILE 121          HG22      ILE 121  19.358 -11.360   0.811
 1031   HG23  ILE 121          HG23      ILE 121  20.748 -11.537  -0.261
 1032   HD11  ILE 121          HD11      ILE 121  20.388  -8.884  -1.677
 1033   HD12  ILE 121          HD12      ILE 121  20.205  -8.812  -3.430
 1034   HD13  ILE 121          HD13      ILE 121  18.794  -8.632  -2.388
 1035    H    THR 122           H        THR 122  19.268 -14.406   0.280
 1036    HA   THR 122           HA       THR 122  16.687 -14.832   1.469
 1037    HB   THR 122           HB       THR 122  19.295 -15.803   2.614
 1038    HG1  THR 122           HG1      THR 122  17.870 -17.075   0.486
 1039   HG21  THR 122          HG21      THR 122  17.245 -16.298   3.863
 1040   HG22  THR 122          HG22      THR 122  17.943 -17.773   3.193
 1041   HG23  THR 122          HG23      THR 122  16.538 -17.032   2.425
 1042    H    ASN 123           H        ASN 123  19.513 -12.942   2.129
 1043    HA   ASN 123           HA       ASN 123  18.790 -12.345   4.860
 1044    HB2  ASN 123           HB2      ASN 123  20.964 -11.288   3.047
 1045    HB3  ASN 123           HB3      ASN 123  20.730 -10.737   4.700
 1046   HD21  ASN 123          HD21      ASN 123  22.736 -11.447   5.353
 1047   HD22  ASN 123          HD22      ASN 123  23.106 -13.126   5.534
 1048    H    HIS 124           H        HIS 124  17.815 -10.507   5.597
 1049    HA   HIS 124           HA       HIS 124  17.646  -8.209   3.841
 1050    HB2  HIS 124           HB2      HIS 124  15.305  -7.954   3.823
 1051    HB3  HIS 124           HB3      HIS 124  15.588  -9.638   3.408
 1052    HD1  HIS 124           HD1      HIS 124  14.000  -7.446   5.932
 1053    HD2  HIS 124           HD2      HIS 124  14.797 -11.499   5.431
 1054    HE1  HIS 124           HE1      HIS 124  12.497  -8.633   7.546
 1055    HE2  HIS 124           HE2      HIS 124  13.102 -11.074   7.347
 1056    H    ASP 125           H        ASP 125  18.432  -9.388   6.704
 1057    HA   ASP 125           HA       ASP 125  17.225  -7.277   8.323
 1058    HB2  ASP 125           HB2      ASP 125  18.762  -9.778   9.053
 1059    HB3  ASP 125           HB3      ASP 125  18.246  -8.577  10.230
 1060    H    GLU 126           H        GLU 126  20.085  -8.136   6.705
 1061    HA   GLU 126           HA       GLU 126  21.705  -6.278   8.272
 1062    HB2  GLU 126           HB2      GLU 126  23.612  -7.138   6.934
 1063    HB3  GLU 126           HB3      GLU 126  22.801  -8.364   7.893
 1064    HG2  GLU 126           HG2      GLU 126  21.660  -9.190   5.928
 1065    HG3  GLU 126           HG3      GLU 126  22.382  -7.912   4.950
 1066    H    TYR 127           H        TYR 127  19.532  -5.615   6.287
 1067    HA   TYR 127           HA       TYR 127  21.164  -3.774   4.676
 1068    HB2  TYR 127           HB2      TYR 127  18.613  -5.155   3.826
 1069    HB3  TYR 127           HB3      TYR 127  19.442  -3.910   2.901
 1070    HD1  TYR 127           HD1      TYR 127  21.972  -4.447   2.399
 1071    HD2  TYR 127           HD2      TYR 127  19.031  -7.361   3.315
 1072    HE1  TYR 127           HE1      TYR 127  23.353  -6.156   1.318
 1073    HE2  TYR 127           HE2      TYR 127  20.396  -9.089   2.243
 1074    HH   TYR 127           HH       TYR 127  22.190  -9.169   0.446
 1075    H    SER 128           H        SER 128  20.539  -1.680   4.638
 1076    HA   SER 128           HA       SER 128  17.967  -1.005   5.894
 1077    HB2  SER 128           HB2      SER 128  20.479   0.657   5.558
 1078    HB3  SER 128           HB3      SER 128  18.946   1.287   6.157
 1079    HG   SER 128           HG       SER 128  20.264   0.722   7.894
 1080    H    LEU 129           H        LEU 129  16.830   0.848   4.825
 1081    HA   LEU 129           HA       LEU 129  17.304   0.662   1.929
 1082    HB2  LEU 129           HB2      LEU 129  15.039   0.002   3.173
 1083    HB3  LEU 129           HB3      LEU 129  14.743   1.722   3.023
 1084    HG   LEU 129           HG       LEU 129  15.486   0.092   0.611
 1085   HD11  LEU 129          HD11      LEU 129  12.716   0.465   1.742
 1086   HD12  LEU 129          HD12      LEU 129  13.102  -0.226   0.166
 1087   HD13  LEU 129          HD13      LEU 129  13.603  -1.057   1.640
 1088   HD21  LEU 129          HD21      LEU 129  14.222   1.823  -0.557
 1089   HD22  LEU 129          HD22      LEU 129  13.852   2.600   0.983
 1090   HD23  LEU 129          HD23      LEU 129  15.517   2.528   0.409
 1091    H    VAL 130           H        VAL 130  17.297   2.577   0.703
 1092    HA   VAL 130           HA       VAL 130  17.168   5.091   2.186
 1093    HB   VAL 130           HB       VAL 130  19.522   4.629   2.238
 1094   HG11  VAL 130          HG11      VAL 130  19.625   2.955   0.511
 1095   HG12  VAL 130          HG12      VAL 130  19.342   4.184  -0.723
 1096   HG13  VAL 130          HG13      VAL 130  20.828   4.213   0.225
 1097   HG21  VAL 130          HG21      VAL 130  18.961   6.939   1.750
 1098   HG22  VAL 130          HG22      VAL 130  20.460   6.474   0.942
 1099   HG23  VAL 130          HG23      VAL 130  18.959   6.587   0.022
 1100    H    ARG 131           H        ARG 131  15.776   6.334   1.170
 1101    HA   ARG 131           HA       ARG 131  15.199   5.748  -1.648
 1102    HB2  ARG 131           HB2      ARG 131  13.602   7.423   0.284
 1103    HB3  ARG 131           HB3      ARG 131  13.086   6.841  -1.290
 1104    HG2  ARG 131           HG2      ARG 131  13.192   4.534  -0.437
 1105    HG3  ARG 131           HG3      ARG 131  13.610   5.174   1.157
 1106    HD2  ARG 131           HD2      ARG 131  11.257   4.771   1.138
 1107    HD3  ARG 131           HD3      ARG 131  11.519   6.522   1.080
 1108    HE   ARG 131           HE       ARG 131  10.964   6.463  -1.262
 1109   HH11  ARG 131          HH11      ARG 131  10.225   3.543   0.512
 1110   HH12  ARG 131          HH12      ARG 131   9.022   3.007  -0.610
 1111   HH21  ARG 131          HH21      ARG 131   9.376   5.780  -2.753
 1112   HH22  ARG 131          HH22      ARG 131   8.537   4.289  -2.479
 1113    H    GLU 132           H        GLU 132  16.661   6.959  -2.787
 1114    HA   GLU 132           HA       GLU 132  17.034   9.727  -2.221
 1115    HB2  GLU 132           HB2      GLU 132  17.648   8.136  -4.730
 1116    HB3  GLU 132           HB3      GLU 132  18.143   9.802  -4.456
 1117    HG2  GLU 132           HG2      GLU 132  19.343   8.944  -2.394
 1118    HG3  GLU 132           HG3      GLU 132  19.060   7.326  -3.036
 1119    H    LEU 133           H        LEU 133  15.162  10.833  -2.192
 1120    HA   LEU 133           HA       LEU 133  13.213  10.312  -4.288
 1121    HB2  LEU 133           HB2      LEU 133  12.906  12.178  -1.949
 1122    HB3  LEU 133           HB3      LEU 133  11.645  11.610  -3.016
 1123    HG   LEU 133           HG       LEU 133  13.126  10.014  -0.934
 1124   HD11  LEU 133          HD11      LEU 133  10.217  10.732  -1.293
 1125   HD12  LEU 133          HD12      LEU 133  10.869   9.704  -0.014
 1126   HD13  LEU 133          HD13      LEU 133  11.318  11.409  -0.093
 1127   HD21  LEU 133          HD21      LEU 133  11.106   9.029  -2.944
 1128   HD22  LEU 133          HD22      LEU 133  12.832   8.661  -2.959
 1129   HD23  LEU 133          HD23      LEU 133  11.821   8.095  -1.631
 1130    H    MET 134           H        MET 134  11.886  12.419  -4.678
 1131    HA   MET 134           HA       MET 134  13.707  14.358  -5.934
 1132    HB2  MET 134           HB2      MET 134  11.535  14.881  -7.255
 1133    HB3  MET 134           HB3      MET 134  12.387  13.388  -7.627
 1134    HG2  MET 134           HG2      MET 134  10.017  12.966  -7.513
 1135    HG3  MET 134           HG3      MET 134  10.835  12.151  -6.185
 1136    HE1  MET 134           HE1      MET 134   8.860  11.760  -4.595
 1137    HE2  MET 134           HE2      MET 134   7.576  12.934  -4.306
 1138    HE3  MET 134           HE3      MET 134   7.809  12.263  -5.920
 1139    H    GLU 135           H        GLU 135  12.329  14.008  -3.187
 1140    HA   GLU 135           HA       GLU 135  10.221  15.685  -2.782
 1141    HB2  GLU 135           HB2      GLU 135  12.128  14.293  -1.154
 1142    HB3  GLU 135           HB3      GLU 135  11.789  15.878  -0.471
 1143    HG2  GLU 135           HG2      GLU 135   9.617  13.991  -1.286
 1144    HG3  GLU 135           HG3      GLU 135  10.339  13.988   0.324
 1145    H    GLU 136           H        GLU 136  10.008  17.696  -3.296
 1146    HA   GLU 136           HA       GLU 136  12.120  19.612  -3.284
 1147    HB2  GLU 136           HB2      GLU 136  10.305  21.200  -3.820
 1148    HB3  GLU 136           HB3      GLU 136  10.259  19.768  -4.842
 1149    HG2  GLU 136           HG2      GLU 136   8.486  18.829  -3.431
 1150    HG3  GLU 136           HG3      GLU 136   8.505  20.297  -2.456
 1151    H    LYS 137           H        LYS 137   9.884  18.387  -0.976
 1152    HA   LYS 137           HA       LYS 137  10.058  20.731   0.748
 1153    HB2  LYS 137           HB2      LYS 137   8.740  18.068   1.302
 1154    HB3  LYS 137           HB3      LYS 137   8.501  19.565   2.189
 1155    HG2  LYS 137           HG2      LYS 137   7.405  20.559   0.273
 1156    HG3  LYS 137           HG3      LYS 137   7.713  19.107  -0.682
 1157    HD2  LYS 137           HD2      LYS 137   6.381  17.808   0.960
 1158    HD3  LYS 137           HD3      LYS 137   5.993  19.316   1.787
 1159    HE2  LYS 137           HE2      LYS 137   5.317  18.656  -1.076
 1160    HE3  LYS 137           HE3      LYS 137   4.195  18.597   0.282
 1161    HZ1  LYS 137           HZ1      LYS 137   3.915  20.642  -0.906
 1162    HZ2  LYS 137           HZ2      LYS 137   5.563  21.013  -0.781
 1163    HZ3  LYS 137           HZ3      LYS 137   4.590  20.991   0.608
 1164    H    LYS 138           H        LYS 138  10.764  17.266   0.944
 1165    HA   LYS 138           HA       LYS 138  12.220  17.523   3.388
 1166    HB2  LYS 138           HB2      LYS 138  11.100  15.420   1.860
 1167    HB3  LYS 138           HB3      LYS 138  12.814  15.071   2.033
 1168    HG2  LYS 138           HG2      LYS 138  12.613  15.286   4.460
 1169    HG3  LYS 138           HG3      LYS 138  10.894  15.638   4.286
 1170    HD2  LYS 138           HD2      LYS 138  12.239  13.081   3.416
 1171    HD3  LYS 138           HD3      LYS 138  11.337  13.290   4.917
 1172    HE2  LYS 138           HE2      LYS 138  10.219  13.604   2.132
 1173    HE3  LYS 138           HE3      LYS 138  10.000  12.200   3.171
 1174    HZ1  LYS 138           HZ1      LYS 138   8.088  13.709   3.204
 1175    HZ2  LYS 138           HZ2      LYS 138   9.066  14.948   3.814
 1176    HZ3  LYS 138           HZ3      LYS 138   8.788  13.556   4.739
 1177    H    ASP 169           H        ASP 169  13.259  16.448   0.152
 1178    HA   ASP 169           HA       ASP 169  15.283  16.285  -0.843
 1179    HB2  ASP 169           HB2      ASP 169  15.207  18.787  -0.580
 1180    HB3  ASP 169           HB3      ASP 169  16.097  18.602   0.927
 1181    H    GLU 170           H        GLU 170  15.576  14.282   0.101
 1182    HA   GLU 170           HA       GLU 170  17.744  14.130   1.993
 1183    HB2  GLU 170           HB2      GLU 170  15.037  13.998   2.888
 1184    HB3  GLU 170           HB3      GLU 170  15.754  12.403   3.063
 1185    HG2  GLU 170           HG2      GLU 170  17.046  14.904   4.109
 1186    HG3  GLU 170           HG3      GLU 170  15.927  13.925   5.055
 1187    H    LEU 171           H        LEU 171  18.551  12.024   2.289
 1188    HA   LEU 171           HA       LEU 171  18.333  10.324  -0.018
 1189    HB2  LEU 171           HB2      LEU 171  19.723   9.820   2.617
 1190    HB3  LEU 171           HB3      LEU 171  19.961   8.917   1.134
 1191    HG   LEU 171           HG       LEU 171  20.714  11.783   1.632
 1192   HD11  LEU 171          HD11      LEU 171  22.382   9.322   1.130
 1193   HD12  LEU 171          HD12      LEU 171  22.999  10.967   1.295
 1194   HD13  LEU 171          HD13      LEU 171  22.220  10.175   2.665
 1195   HD21  LEU 171          HD21      LEU 171  21.673  11.700  -0.634
 1196   HD22  LEU 171          HD22      LEU 171  20.947  10.105  -0.860
 1197   HD23  LEU 171          HD23      LEU 171  19.915  11.525  -0.639
 1198    H    ASN 172           H        ASN 172  16.736  10.692   2.903
 1199    HA   ASN 172           HA       ASN 172  15.263   9.463   4.119
 1200    HB2  ASN 172           HB2      ASN 172  14.605   8.618   1.304
 1201    HB3  ASN 172           HB3      ASN 172  13.636   8.137   2.683
 1202   HD21  ASN 172          HD21      ASN 172  14.261  10.503   0.402
 1203   HD22  ASN 172          HD22      ASN 172  13.221  11.737   1.015
 1204    H    TRP 173           H        TRP 173  17.106   8.236   5.080
 1205    HA   TRP 173           HA       TRP 173  17.549   5.578   4.011
 1206    HB2  TRP 173           HB2      TRP 173  18.619   7.107   6.384
 1207    HB3  TRP 173           HB3      TRP 173  18.909   5.382   6.196
 1208    HD1  TRP 173           HD1      TRP 173  19.793   8.761   4.593
 1209    HE1  TRP 173           HE1      TRP 173  21.944   8.469   3.231
 1210    HE3  TRP 173           HE3      TRP 173  20.326   3.695   5.005
 1211    HZ2  TRP 173           HZ2      TRP 173  23.656   6.368   2.428
 1212    HZ3  TRP 173           HZ3      TRP 173  22.252   2.621   3.915
 1213    HH2  TRP 173           HH2      TRP 173  23.882   3.933   2.653
 1214    H    LEU 174           H        LEU 174  15.743   4.385   4.259
 1215    HA   LEU 174           HA       LEU 174  13.778   4.818   6.190
 1216    HB2  LEU 174           HB2      LEU 174  14.389   2.337   4.598
 1217    HB3  LEU 174           HB3      LEU 174  12.936   2.579   5.545
 1218    HG   LEU 174           HG       LEU 174  13.748   3.911   2.984
 1219   HD11  LEU 174          HD11      LEU 174  11.349   3.246   2.475
 1220   HD12  LEU 174          HD12      LEU 174  12.520   1.937   2.661
 1221   HD13  LEU 174          HD13      LEU 174  11.407   2.312   3.978
 1222   HD21  LEU 174          HD21      LEU 174  13.079   5.814   4.143
 1223   HD22  LEU 174          HD22      LEU 174  11.586   5.282   3.369
 1224   HD23  LEU 174          HD23      LEU 174  11.874   4.938   5.077
 1225    H    ASP 175           H        ASP 175  13.714   4.430   8.205
 1226    HA   ASP 175           HA       ASP 175  15.922   3.189   9.554
 1227    HB2  ASP 175           HB2      ASP 175  14.789   4.020  11.586
 1228    HB3  ASP 175           HB3      ASP 175  14.967   5.282  10.368
 1229    H    HIS 176           H        HIS 176  13.058   2.025   8.348
 1230    HA   HIS 176           HA       HIS 176  12.195  -0.077   8.382
 1231    HB2  HIS 176           HB2      HIS 176  14.283  -0.542  10.489
 1232    HB3  HIS 176           HB3      HIS 176  13.081  -1.763  10.088
 1233    HD1  HIS 176           HD1      HIS 176  13.283  -2.919   7.807
 1234    HD2  HIS 176           HD2      HIS 176  16.298  -0.180   8.585
 1235    HE1  HIS 176           HE1      HIS 176  15.002  -3.281   6.010
 1236    HE2  HIS 176           HE2      HIS 176  16.955  -1.863   6.732
 1237    H    GLY 177           H        GLY 177  12.096   2.078  10.975
 1238    HA2  GLY 177           HA2      GLY 177  10.038   0.464  12.351
 1239    HA3  GLY 177           HA3      GLY 177  10.972   1.752  13.098
 1240    H    ARG 178           H        ARG 178   9.901   2.370   9.935
 1241    HA   ARG 178           HA       ARG 178   7.504   3.767  10.849
 1242    HB2  ARG 178           HB2      ARG 178   9.050   5.496  11.065
 1243    HB3  ARG 178           HB3      ARG 178   9.971   4.981   9.664
 1244    HG2  ARG 178           HG2      ARG 178   8.278   5.819   8.180
 1245    HG3  ARG 178           HG3      ARG 178   7.234   6.223   9.551
 1246    HD2  ARG 178           HD2      ARG 178   8.663   8.089   8.484
 1247    HD3  ARG 178           HD3      ARG 178   8.603   7.965  10.243
 1248    HE   ARG 178           HE       ARG 178  10.755   6.429   9.409
 1249   HH11  ARG 178          HH11      ARG 178   9.819   9.810   9.238
 1250   HH12  ARG 178          HH12      ARG 178  11.460  10.379   9.354
 1251   HH21  ARG 178          HH21      ARG 178  12.875   7.179   9.557
 1252   HH22  ARG 178          HH22      ARG 178  13.194   8.891   9.533
 1253    H    THR 179           H        THR 179   6.013   4.283   9.176
 1254    HA   THR 179           HA       THR 179   6.162   2.429   6.952
 1255    HB   THR 179           HB       THR 179   4.073   2.640   8.226
 1256    HG1  THR 179           HG1      THR 179   3.467   1.951   6.294
 1257   HG21  THR 179          HG21      THR 179   3.922   5.412   7.059
 1258   HG22  THR 179          HG22      THR 179   4.193   5.023   8.757
 1259   HG23  THR 179          HG23      THR 179   2.656   4.613   7.993
 1260    H    LEU 180           H        LEU 180   4.892   3.534   4.910
 1261    HA   LEU 180           HA       LEU 180   7.020   5.270   3.923
 1262    HB2  LEU 180           HB2      LEU 180   4.917   3.737   2.405
 1263    HB3  LEU 180           HB3      LEU 180   6.343   4.509   1.729
 1264    HG   LEU 180           HG       LEU 180   6.383   2.206   3.678
 1265   HD11  LEU 180          HD11      LEU 180   6.864   2.268   0.708
 1266   HD12  LEU 180          HD12      LEU 180   7.186   0.892   1.766
 1267   HD13  LEU 180          HD13      LEU 180   5.534   1.473   1.554
 1268   HD21  LEU 180          HD21      LEU 180   8.605   3.568   2.163
 1269   HD22  LEU 180          HD22      LEU 180   8.326   3.639   3.905
 1270   HD23  LEU 180          HD23      LEU 180   8.773   2.111   3.143
 1271    H    ARG 181           H        ARG 181   3.475   5.112   4.019
 1272    HA   ARG 181           HA       ARG 181   2.928   7.524   2.695
 1273    HB2  ARG 181           HB2      ARG 181   1.496   5.680   4.451
 1274    HB3  ARG 181           HB3      ARG 181   0.979   7.348   4.645
 1275    HG2  ARG 181           HG2      ARG 181   0.408   7.508   2.324
 1276    HG3  ARG 181           HG3      ARG 181   1.097   5.913   2.003
 1277    HD2  ARG 181           HD2      ARG 181  -1.234   6.456   3.840
 1278    HD3  ARG 181           HD3      ARG 181  -1.368   5.878   2.178
 1279    HE   ARG 181           HE       ARG 181  -0.184   3.865   2.879
 1280   HH11  ARG 181          HH11      ARG 181  -1.723   5.826   5.349
 1281   HH12  ARG 181          HH12      ARG 181  -1.678   4.572   6.557
 1282   HH21  ARG 181          HH21      ARG 181  -0.124   2.226   4.457
 1283   HH22  ARG 181          HH22      ARG 181  -0.817   2.501   6.030
 1284    H    GLU 182           H        GLU 182   4.152   6.854   5.816
 1285    HA   GLU 182           HA       GLU 182   3.476   9.278   7.134
 1286    HB2  GLU 182           HB2      GLU 182   4.173   7.038   8.144
 1287    HB3  GLU 182           HB3      GLU 182   5.818   7.437   7.686
 1288    HG2  GLU 182           HG2      GLU 182   5.962   8.243   9.741
 1289    HG3  GLU 182           HG3      GLU 182   5.107   9.645   9.092
 1290    H    GLN 183           H        GLN 183   5.867   8.375   4.841
 1291    HA   GLN 183           HA       GLN 183   7.514  10.727   5.458
 1292    HB2  GLN 183           HB2      GLN 183   8.121   8.201   3.917
 1293    HB3  GLN 183           HB3      GLN 183   9.230   9.560   4.033
 1294    HG2  GLN 183           HG2      GLN 183   9.458   9.279   6.378
 1295    HG3  GLN 183           HG3      GLN 183   8.146   8.103   6.423
 1296   HE21  GLN 183          HE21      GLN 183   8.483   6.048   5.627
 1297   HE22  GLN 183          HE22      GLN 183  10.071   5.400   5.428
 1298    H    GLY 184           H        GLY 184   5.168   9.609   3.334
 1299    HA2  GLY 184           HA2      GLY 184   4.193  10.630   1.521
 1300    HA3  GLY 184           HA3      GLY 184   5.263  11.998   1.794
 1301    H    VAL 185           H        VAL 185   6.183   8.657   1.132
 1302    HA   VAL 185           HA       VAL 185   7.815   9.545  -1.086
 1303    HB   VAL 185           HB       VAL 185   8.634   7.238  -1.141
 1304   HG11  VAL 185          HG11      VAL 185   8.466   8.382   1.649
 1305   HG12  VAL 185          HG12      VAL 185   9.639   7.185   1.098
 1306   HG13  VAL 185          HG13      VAL 185   9.652   8.812   0.417
 1307   HG21  VAL 185          HG21      VAL 185   6.560   6.074  -0.592
 1308   HG22  VAL 185          HG22      VAL 185   7.851   5.598   0.510
 1309   HG23  VAL 185          HG23      VAL 185   6.610   6.731   1.043
 1310    H    GLU 186           H        GLU 186   7.631   8.827  -3.231
 1311    HA   GLU 186           HA       GLU 186   4.913   7.975  -3.969
 1312    HB2  GLU 186           HB2      GLU 186   6.994   9.602  -5.428
 1313    HB3  GLU 186           HB3      GLU 186   5.571   8.956  -6.224
 1314    HG2  GLU 186           HG2      GLU 186   5.424  10.736  -3.834
 1315    HG3  GLU 186           HG3      GLU 186   5.453  11.345  -5.487
 1316    H    GLU 187           H        GLU 187   5.453   7.277  -6.605
 1317    HA   GLU 187           HA       GLU 187   7.023   4.821  -6.212
 1318    HB2  GLU 187           HB2      GLU 187   4.634   5.329  -7.984
 1319    HB3  GLU 187           HB3      GLU 187   5.542   3.827  -7.937
 1320    HG2  GLU 187           HG2      GLU 187   3.799   3.297  -6.579
 1321    HG3  GLU 187           HG3      GLU 187   4.944   3.913  -5.390
 1322    H    HIS 188           H        HIS 188   7.926   7.522  -7.262
 1323    HA   HIS 188           HA       HIS 188   8.829   6.526  -9.876
 1324    HB2  HIS 188           HB2      HIS 188   8.746   8.907 -10.721
 1325    HB3  HIS 188           HB3      HIS 188   7.207   8.094 -10.507
 1326    HD1  HIS 188           HD1      HIS 188   5.491   9.345  -9.262
 1327    HD2  HIS 188           HD2      HIS 188   9.305  10.792  -8.487
 1328    HE1  HIS 188           HE1      HIS 188   5.157  11.448  -7.940
 1329    HE2  HIS 188           HE2      HIS 188   7.456  12.444  -7.735
 1330    H    GLU 189           H        GLU 189   9.770   7.726  -6.891
 1331    HA   GLU 189           HA       GLU 189  12.332   8.727  -7.839
 1332    HB2  GLU 189           HB2      GLU 189  11.733   8.035  -4.978
 1333    HB3  GLU 189           HB3      GLU 189  12.831   9.252  -5.607
 1334    HG2  GLU 189           HG2      GLU 189  11.120  10.536  -4.795
 1335    HG3  GLU 189           HG3      GLU 189  10.666  10.374  -6.492
 1336    H    THR 190           H        THR 190  14.334   7.668  -7.555
 1337    HA   THR 190           HA       THR 190  14.194   4.813  -7.541
 1338    HB   THR 190           HB       THR 190  16.633   6.607  -7.547
 1339    HG1  THR 190           HG1      THR 190  15.168   6.823  -9.382
 1340   HG21  THR 190          HG21      THR 190  17.156   4.328  -6.828
 1341   HG22  THR 190          HG22      THR 190  17.796   4.635  -8.443
 1342   HG23  THR 190          HG23      THR 190  16.324   3.681  -8.243
 1343    H    LEU 191           H        LEU 191  14.316   3.508  -5.865
 1344    HA   LEU 191           HA       LEU 191  15.345   4.582  -3.313
 1345    HB2  LEU 191           HB2      LEU 191  13.585   2.146  -3.610
 1346    HB3  LEU 191           HB3      LEU 191  13.972   3.012  -2.140
 1347    HG   LEU 191           HG       LEU 191  11.835   3.722  -2.450
 1348   HD11  LEU 191          HD11      LEU 191  13.197   5.727  -2.452
 1349   HD12  LEU 191          HD12      LEU 191  13.302   5.668  -4.211
 1350   HD13  LEU 191          HD13      LEU 191  11.746   5.944  -3.429
 1351   HD21  LEU 191          HD21      LEU 191  12.238   3.656  -5.430
 1352   HD22  LEU 191          HD22      LEU 191  11.422   2.431  -4.458
 1353   HD23  LEU 191          HD23      LEU 191  10.732   4.048  -4.599
 1354    H    LEU 192           H        LEU 192  17.016   3.419  -2.265
 1355    HA   LEU 192           HA       LEU 192  18.177   1.318  -3.970
 1356    HB2  LEU 192           HB2      LEU 192  19.835   2.904  -2.080
 1357    HB3  LEU 192           HB3      LEU 192  20.269   2.198  -3.622
 1358    HG   LEU 192           HG       LEU 192  18.473   4.604  -3.383
 1359   HD11  LEU 192          HD11      LEU 192  20.415   5.962  -3.915
 1360   HD12  LEU 192          HD12      LEU 192  20.633   5.118  -2.383
 1361   HD13  LEU 192          HD13      LEU 192  21.447   4.533  -3.834
 1362   HD21  LEU 192          HD21      LEU 192  18.347   3.325  -5.476
 1363   HD22  LEU 192          HD22      LEU 192  19.035   4.933  -5.714
 1364   HD23  LEU 192          HD23      LEU 192  20.089   3.518  -5.685
 1365    H    LEU 193           H        LEU 193  18.728  -0.580  -3.049
 1366    HA   LEU 193           HA       LEU 193  18.320  -0.958  -0.200
 1367    HB2  LEU 193           HB2      LEU 193  17.526  -2.595  -1.907
 1368    HB3  LEU 193           HB3      LEU 193  19.190  -2.900  -2.354
 1369    HG   LEU 193           HG       LEU 193  18.386  -3.360   0.485
 1370   HD11  LEU 193          HD11      LEU 193  17.655  -5.622  -0.079
 1371   HD12  LEU 193          HD12      LEU 193  16.606  -4.414  -0.822
 1372   HD13  LEU 193          HD13      LEU 193  17.816  -5.250  -1.795
 1373   HD21  LEU 193          HD21      LEU 193  20.039  -5.135   0.305
 1374   HD22  LEU 193          HD22      LEU 193  20.233  -4.802  -1.417
 1375   HD23  LEU 193          HD23      LEU 193  20.727  -3.599  -0.225
 1376    H    ARG 194           H        ARG 194  19.943  -0.912   1.266
 1377    HA   ARG 194           HA       ARG 194  22.712  -0.882   0.241
 1378    HB2  ARG 194           HB2      ARG 194  21.548   0.748   2.504
 1379    HB3  ARG 194           HB3      ARG 194  23.253   0.685   2.086
 1380    HG2  ARG 194           HG2      ARG 194  21.085   1.663   0.251
 1381    HG3  ARG 194           HG3      ARG 194  22.080   2.700   1.272
 1382    HD2  ARG 194           HD2      ARG 194  22.993   0.946  -1.002
 1383    HD3  ARG 194           HD3      ARG 194  22.983   2.713  -0.943
 1384    HE   ARG 194           HE       ARG 194  24.592   1.359   1.074
 1385   HH11  ARG 194          HH11      ARG 194  24.496   3.030  -2.008
 1386   HH12  ARG 194          HH12      ARG 194  26.204   3.319  -2.043
 1387   HH21  ARG 194          HH21      ARG 194  26.839   1.756   1.024
 1388   HH22  ARG 194          HH22      ARG 194  27.534   2.624  -0.310
 1389    H    ARG 195           H        ARG 195  24.254  -1.941   1.449
 1390    HA   ARG 195           HA       ARG 195  23.197  -3.863   3.347
 1391    HB2  ARG 195           HB2      ARG 195  24.944  -4.312   1.485
 1392    HB3  ARG 195           HB3      ARG 195  26.096  -3.603   2.611
 1393    HG2  ARG 195           HG2      ARG 195  25.653  -5.281   4.240
 1394    HG3  ARG 195           HG3      ARG 195  24.302  -5.913   3.297
 1395    HD2  ARG 195           HD2      ARG 195  26.042  -6.331   1.461
 1396    HD3  ARG 195           HD3      ARG 195  27.240  -6.098   2.735
 1397    HE   ARG 195           HE       ARG 195  25.347  -7.939   3.663
 1398   HH11  ARG 195          HH11      ARG 195  27.901  -7.728   1.249
 1399   HH12  ARG 195          HH12      ARG 195  28.146  -9.453   1.196
 1400   HH21  ARG 195          HH21      ARG 195  25.635 -10.155   3.555
 1401   HH22  ARG 195          HH22      ARG 195  26.835 -10.845   2.491
 1402    H    LYS 196           H        LYS 196  23.102  -3.467   5.422
 1403    HA   LYS 196           HA       LYS 196  24.483  -1.169   6.535
 1404    HB2  LYS 196           HB2      LYS 196  22.094  -1.556   7.031
 1405    HB3  LYS 196           HB3      LYS 196  22.507  -3.081   7.801
 1406    HG2  LYS 196           HG2      LYS 196  23.767  -1.903   9.508
 1407    HG3  LYS 196           HG3      LYS 196  23.426  -0.363   8.715
 1408    HD2  LYS 196           HD2      LYS 196  21.020  -0.735   9.074
 1409    HD3  LYS 196           HD3      LYS 196  21.391  -2.241   9.915
 1410    HE2  LYS 196           HE2      LYS 196  20.982  -0.425  11.494
 1411    HE3  LYS 196           HE3      LYS 196  22.644  -1.002  11.600
 1412    HZ1  LYS 196           HZ1      LYS 196  21.751   1.435  10.149
 1413    HZ2  LYS 196           HZ2      LYS 196  23.350   0.883  10.263
 1414    HZ3  LYS 196           HZ3      LYS 196  22.536   1.410  11.653
 1415    H    PHE 197           H        PHE 197  24.089  -4.602   7.416
 1416    HA   PHE 197           HA       PHE 197  26.686  -4.486   8.786
 1417    HB2  PHE 197           HB2      PHE 197  24.832  -6.858   8.821
 1418    HB3  PHE 197           HB3      PHE 197  26.084  -6.430   9.977
 1419    HD1  PHE 197           HD1      PHE 197  25.614  -4.024  11.142
 1420    HD2  PHE 197           HD2      PHE 197  22.704  -6.641   9.495
 1421    HE1  PHE 197           HE1      PHE 197  23.888  -3.005  12.573
 1422    HE2  PHE 197           HE2      PHE 197  20.968  -5.636  10.903
 1423    HZ   PHE 197           HZ       PHE 197  21.562  -3.809  12.457
 1424    H    PHE 198           H        PHE 198  28.074  -6.478   8.454
 1425    HA   PHE 198           HA       PHE 198  27.816  -7.425   5.675
 1426    HB2  PHE 198           HB2      PHE 198  30.337  -6.458   7.037
 1427    HB3  PHE 198           HB3      PHE 198  30.293  -7.261   5.471
 1428    HD1  PHE 198           HD1      PHE 198  29.093  -6.160   3.572
 1429    HD2  PHE 198           HD2      PHE 198  29.889  -4.156   7.240
 1430    HE1  PHE 198           HE1      PHE 198  28.707  -3.996   2.470
 1431    HE2  PHE 198           HE2      PHE 198  29.500  -1.989   6.144
 1432    HZ   PHE 198           HZ       PHE 198  28.910  -1.907   3.755
 1433    H    TYR 199           H        TYR 199  27.309  -8.548   8.467
 1434    HA   TYR 199           HA       TYR 199  29.241 -10.548   8.937
 1435    HB2  TYR 199           HB2      TYR 199  27.596 -11.596  10.415
 1436    HB3  TYR 199           HB3      TYR 199  27.693  -9.864  10.693
 1437    HD1  TYR 199           HD1      TYR 199  25.593 -12.605   9.472
 1438    HD2  TYR 199           HD2      TYR 199  25.811  -8.421  10.179
 1439    HE1  TYR 199           HE1      TYR 199  23.150 -12.447   9.248
 1440    HE2  TYR 199           HE2      TYR 199  23.371  -8.250   9.953
 1441    HH   TYR 199           HH       TYR 199  21.330 -11.041   9.824
 1442    H    SER 200           H        SER 200  26.618 -10.330   6.710
 1443    HA   SER 200           HA       SER 200  26.077 -11.588   4.904
 1444    HB2  SER 200           HB2      SER 200  28.656 -13.075   5.423
 1445    HB3  SER 200           HB3      SER 200  27.809 -12.906   3.885
 1446    HG   SER 200           HG       SER 200  28.951 -10.773   5.385
 1447    H    ASP 201           H        ASP 201  24.724 -12.309   7.035
 1448    HA   ASP 201           HA       ASP 201  23.519 -13.919   8.082
 1449    HB2  ASP 201           HB2      ASP 201  23.029 -14.401   5.663
 1450    HB3  ASP 201           HB3      ASP 201  24.266 -15.646   5.726
 1451    H    GLN 202           H        GLN 202  26.339 -13.722   8.699
 1452    HA   GLN 202           HA       GLN 202  26.697 -16.404   9.843
 1453    HB2  GLN 202           HB2      GLN 202  28.817 -14.590   8.683
 1454    HB3  GLN 202           HB3      GLN 202  29.177 -15.985   9.689
 1455    HG2  GLN 202           HG2      GLN 202  28.409 -17.493   8.077
 1456    HG3  GLN 202           HG3      GLN 202  27.559 -16.233   7.181
 1457   HE21  GLN 202          HE21      GLN 202  28.684 -14.908   5.815
 1458   HE22  GLN 202          HE22      GLN 202  30.312 -15.222   5.316
  Start of MODEL    8
    1    H1   GLY  -5           H1       GLY  -5 -41.685  -3.264   5.469
    2    H2   GLY  -5           H2       GLY  -5 -42.693  -2.842   6.764
    3    H3   GLY  -5           H3       GLY  -5 -42.946  -4.300   5.934
    4    HA2  GLY  -5           HA2      GLY  -5 -40.603  -3.615   7.619
    5    HA3  GLY  -5           HA3      GLY  -5 -41.884  -4.749   8.030
    6    H    ILE  -4           H        ILE  -4 -39.528  -5.776   8.225
    7    HA   ILE  -4           HA       ILE  -4 -37.882  -7.135   7.441
    8    HB   ILE  -4           HB       ILE  -4 -38.732  -9.265   6.469
    9   HG12  ILE  -4          HG12      ILE  -4 -41.445  -7.944   6.721
   10   HG13  ILE  -4          HG13      ILE  -4 -40.647  -8.332   5.201
   11   HG21  ILE  -4          HG21      ILE  -4 -38.550  -8.953   8.855
   12   HG22  ILE  -4          HG22      ILE  -4 -40.145  -8.202   8.906
   13   HG23  ILE  -4          HG23      ILE  -4 -39.986  -9.906   8.481
   14   HD11  ILE  -4          HD11      ILE  -4 -40.740 -10.703   5.754
   15   HD12  ILE  -4          HD12      ILE  -4 -41.527 -10.318   7.285
   16   HD13  ILE  -4          HD13      ILE  -4 -42.346  -9.974   5.761
   17    H    ASP  -3           H        ASP  -3 -37.583  -5.119   5.898
   18    HA   ASP  -3           HA       ASP  -3 -37.473  -6.122   3.139
   19    HB2  ASP  -3           HB2      ASP  -3 -37.069  -3.807   2.458
   20    HB3  ASP  -3           HB3      ASP  -3 -38.539  -3.919   3.418
   21    HA   PRO  -2           HA       PRO  -2 -33.224  -7.065   3.436
   22    HB2  PRO  -2           HB2      PRO  -2 -32.392  -6.337   0.913
   23    HB3  PRO  -2           HB3      PRO  -2 -33.215  -7.852   1.300
   24    HG2  PRO  -2           HG2      PRO  -2 -34.339  -5.314   0.188
   25    HG3  PRO  -2           HG3      PRO  -2 -34.700  -6.991  -0.261
   26    HD2  PRO  -2           HD2      PRO  -2 -36.360  -5.582   1.298
   27    HD3  PRO  -2           HD3      PRO  -2 -36.086  -7.316   1.572
   28    H    PHE  -1           H        PHE  -1 -32.115  -5.794   4.759
   29    HA   PHE  -1           HA       PHE  -1 -31.015  -4.121   5.700
   30    HB2  PHE  -1           HB2      PHE  -1 -30.097  -4.053   2.868
   31    HB3  PHE  -1           HB3      PHE  -1 -29.332  -3.125   4.144
   32    HD1  PHE  -1           HD1      PHE  -1 -29.436  -5.033   6.375
   33    HD2  PHE  -1           HD2      PHE  -1 -28.514  -5.635   2.266
   34    HE1  PHE  -1           HE1      PHE  -1 -28.057  -6.979   6.974
   35    HE2  PHE  -1           HE2      PHE  -1 -27.137  -7.586   2.857
   36    HZ   PHE  -1           HZ       PHE  -1 -26.980  -8.310   5.208
   37    H    THR   0           H        THR   0 -32.363  -2.661   6.456
   38    HA   THR   0           HA       THR   0 -33.652  -0.620   4.973
   39    HB   THR   0           HB       THR   0 -33.925   0.470   7.214
   40    HG1  THR   0           HG1      THR   0 -33.140  -0.790   9.029
   41   HG21  THR   0          HG21      THR   0 -35.530  -1.211   6.442
   42   HG22  THR   0          HG22      THR   0 -35.308  -1.299   8.189
   43   HG23  THR   0          HG23      THR   0 -34.535  -2.488   7.141
   44    H    MET   1           H        MET   1 -32.591   1.435   7.055
   45    HA   MET   1           HA       MET   1 -30.539   2.516   5.346
   46    HB2  MET   1           HB2      MET   1 -32.286   3.924   6.475
   47    HB3  MET   1           HB3      MET   1 -31.500   3.578   8.006
   48    HG2  MET   1           HG2      MET   1 -30.805   5.734   7.277
   49    HG3  MET   1           HG3      MET   1 -29.437   4.633   7.130
   50    HE1  MET   1           HE1      MET   1 -28.704   4.442   3.405
   51    HE2  MET   1           HE2      MET   1 -28.027   4.431   5.032
   52    HE3  MET   1           HE3      MET   1 -29.234   3.231   4.573
   53    H    VAL   2           H        VAL   2 -29.730   0.153   6.225
   54    HA   VAL   2           HA       VAL   2 -27.495   0.840   7.996
   55    HB   VAL   2           HB       VAL   2 -27.438  -1.497   8.790
   56   HG11  VAL   2          HG11      VAL   2 -28.588   0.176  10.122
   57   HG12  VAL   2          HG12      VAL   2 -30.081  -0.115   9.229
   58   HG13  VAL   2          HG13      VAL   2 -29.405  -1.383  10.253
   59   HG21  VAL   2          HG21      VAL   2 -29.319  -2.998   8.372
   60   HG22  VAL   2          HG22      VAL   2 -30.043  -1.798   7.299
   61   HG23  VAL   2          HG23      VAL   2 -28.508  -2.554   6.868
   62    H    ALA   3           H        ALA   3 -27.384   1.331   5.442
   63    HA   ALA   3           HA       ALA   3 -25.389  -0.559   4.494
   64    HB1  ALA   3           HB1      ALA   3 -27.685   0.488   2.825
   65    HB2  ALA   3           HB2      ALA   3 -26.260  -0.320   2.168
   66    HB3  ALA   3           HB3      ALA   3 -27.358  -1.196   3.238
   67    H    LEU   4           H        LEU   4 -23.765   0.439   3.367
   68    HA   LEU   4           HA       LEU   4 -23.823   3.375   3.574
   69    HB2  LEU   4           HB2      LEU   4 -21.498   1.481   3.874
   70    HB3  LEU   4           HB3      LEU   4 -21.355   3.230   3.853
   71    HG   LEU   4           HG       LEU   4 -22.737   1.541   5.938
   72   HD11  LEU   4          HD11      LEU   4 -20.332   3.347   6.096
   73   HD12  LEU   4          HD12      LEU   4 -21.044   2.438   7.430
   74   HD13  LEU   4          HD13      LEU   4 -20.301   1.582   6.078
   75   HD21  LEU   4          HD21      LEU   4 -24.041   3.539   5.626
   76   HD22  LEU   4          HD22      LEU   4 -23.120   3.681   7.122
   77   HD23  LEU   4          HD23      LEU   4 -22.592   4.541   5.675
   78    H    SER   5           H        SER   5 -23.294   4.524   1.834
   79    HA   SER   5           HA       SER   5 -22.909   3.004  -0.648
   80    HB2  SER   5           HB2      SER   5 -23.933   5.834  -0.276
   81    HB3  SER   5           HB3      SER   5 -23.796   4.985  -1.809
   82    HG   SER   5           HG       SER   5 -25.629   4.653   0.265
   83    H    LEU   6           H        LEU   6 -20.784   2.806  -0.961
   84    HA   LEU   6           HA       LEU   6 -19.080   5.093  -0.249
   85    HB2  LEU   6           HB2      LEU   6 -18.234   2.221  -0.624
   86    HB3  LEU   6           HB3      LEU   6 -17.289   3.527   0.075
   87    HG   LEU   6           HG       LEU   6 -19.728   2.224   1.290
   88   HD11  LEU   6          HD11      LEU   6 -16.833   2.223   2.125
   89   HD12  LEU   6          HD12      LEU   6 -18.167   1.502   3.026
   90   HD13  LEU   6          HD13      LEU   6 -17.726   0.862   1.443
   91   HD21  LEU   6          HD21      LEU   6 -19.295   3.660   3.235
   92   HD22  LEU   6          HD22      LEU   6 -18.050   4.509   2.318
   93   HD23  LEU   6          HD23      LEU   6 -19.736   4.590   1.802
   94    H    LYS   7           H        LYS   7 -17.818   6.038  -1.710
   95    HA   LYS   7           HA       LYS   7 -18.071   5.296  -4.484
   96    HB2  LYS   7           HB2      LYS   7 -16.784   7.531  -2.990
   97    HB3  LYS   7           HB3      LYS   7 -16.221   7.184  -4.618
   98    HG2  LYS   7           HG2      LYS   7 -18.542   7.432  -5.425
   99    HG3  LYS   7           HG3      LYS   7 -19.020   7.905  -3.791
  100    HD2  LYS   7           HD2      LYS   7 -17.717   9.859  -3.863
  101    HD3  LYS   7           HD3      LYS   7 -16.819   9.303  -5.278
  102    HE2  LYS   7           HE2      LYS   7 -18.828   9.479  -6.635
  103    HE3  LYS   7           HE3      LYS   7 -19.748  10.010  -5.223
  104    HZ1  LYS   7           HZ1      LYS   7 -17.458  11.444  -6.471
  105    HZ2  LYS   7           HZ2      LYS   7 -18.271  11.946  -5.068
  106    HZ3  LYS   7           HZ3      LYS   7 -19.092  11.902  -6.552
  107    H    ILE   8           H        ILE   8 -17.023   3.496  -5.043
  108    HA   ILE   8           HA       ILE   8 -14.436   2.879  -3.892
  109    HB   ILE   8           HB       ILE   8 -16.011   1.394  -6.000
  110   HG12  ILE   8          HG12      ILE   8 -17.241   1.485  -3.887
  111   HG13  ILE   8          HG13      ILE   8 -16.632  -0.141  -4.174
  112   HG21  ILE   8          HG21      ILE   8 -14.542  -0.474  -5.492
  113   HG22  ILE   8          HG22      ILE   8 -13.619   0.920  -6.047
  114   HG23  ILE   8          HG23      ILE   8 -13.662   0.518  -4.331
  115   HD11  ILE   8          HD11      ILE   8 -16.381   0.493  -1.850
  116   HD12  ILE   8          HD12      ILE   8 -14.805   0.269  -2.609
  117   HD13  ILE   8          HD13      ILE   8 -15.421   1.896  -2.320
  118    H    SER   9           H        SER   9 -12.983   4.341  -4.709
  119    HA   SER   9           HA       SER   9 -12.883   4.732  -7.590
  120    HB2  SER   9           HB2      SER   9 -12.573   6.675  -6.038
  121    HB3  SER   9           HB3      SER   9 -11.081   5.937  -5.478
  122    HG   SER   9           HG       SER   9 -11.392   6.267  -8.227
  123    H    ILE  10           H        ILE  10 -12.151   2.924  -8.500
  124    HA   ILE  10           HA       ILE  10  -9.927   1.463  -7.357
  125    HB   ILE  10           HB       ILE  10 -11.347   0.940  -9.973
  126   HG12  ILE  10          HG12      ILE  10 -11.901  -0.287  -7.263
  127   HG13  ILE  10          HG13      ILE  10 -12.874   0.990  -7.982
  128   HG21  ILE  10          HG21      ILE  10  -9.669  -0.840  -8.203
  129   HG22  ILE  10          HG22      ILE  10 -10.498  -1.343  -9.676
  130   HG23  ILE  10          HG23      ILE  10  -9.186  -0.169  -9.762
  131   HD11  ILE  10          HD11      ILE  10 -13.471  -0.485  -9.818
  132   HD12  ILE  10          HD12      ILE  10 -12.466  -1.760  -9.131
  133   HD13  ILE  10          HD13      ILE  10 -13.896  -1.201  -8.263
  134    H    GLY  11           H        GLY  11  -8.323   3.070  -7.519
  135    HA2  GLY  11           HA2      GLY  11  -6.372   3.797  -8.539
  136    HA3  GLY  11           HA3      GLY  11  -6.909   3.047 -10.037
  137    H    ASN  12           H        ASN  12  -8.741   4.174 -11.144
  138    HA   ASN  12           HA       ASN  12  -8.649   7.093 -10.751
  139    HB2  ASN  12           HB2      ASN  12  -8.552   5.687 -13.434
  140    HB3  ASN  12           HB3      ASN  12  -8.582   7.428 -13.177
  141   HD21  ASN  12          HD21      ASN  12  -6.683   4.530 -12.987
  142   HD22  ASN  12          HD22      ASN  12  -5.149   5.308 -12.797
  143    H    VAL  13           H        VAL  13 -10.289   4.346 -12.217
  144    HA   VAL  13           HA       VAL  13 -12.740   5.634 -12.777
  145    HB   VAL  13           HB       VAL  13 -12.039   3.494 -13.804
  146   HG11  VAL  13          HG11      VAL  13 -10.998   2.444 -11.889
  147   HG12  VAL  13          HG12      VAL  13 -12.564   2.309 -11.084
  148   HG13  VAL  13          HG13      VAL  13 -12.248   1.392 -12.561
  149   HG21  VAL  13          HG21      VAL  13 -14.194   2.315 -13.670
  150   HG22  VAL  13          HG22      VAL  13 -14.643   3.326 -12.296
  151   HG23  VAL  13          HG23      VAL  13 -14.388   4.058 -13.882
  152    H    VAL  14           H        VAL  14 -14.809   5.266 -11.621
  153    HA   VAL  14           HA       VAL  14 -14.453   4.647  -8.781
  154    HB   VAL  14           HB       VAL  14 -14.428   7.098  -8.916
  155   HG11  VAL  14          HG11      VAL  14 -17.194   6.854 -10.078
  156   HG12  VAL  14          HG12      VAL  14 -16.390   8.351  -9.602
  157   HG13  VAL  14          HG13      VAL  14 -15.751   7.396 -10.939
  158   HG21  VAL  14          HG21      VAL  14 -16.280   7.538  -7.323
  159   HG22  VAL  14          HG22      VAL  14 -16.909   5.926  -7.669
  160   HG23  VAL  14          HG23      VAL  14 -15.325   6.111  -6.917
  161    H    LYS  15           H        LYS  15 -15.811   3.206  -8.126
  162    HA   LYS  15           HA       LYS  15 -18.292   2.756  -9.651
  163    HB2  LYS  15           HB2      LYS  15 -16.641   0.809  -8.022
  164    HB3  LYS  15           HB3      LYS  15 -18.148   0.419  -8.840
  165    HG2  LYS  15           HG2      LYS  15 -15.624   1.335 -10.203
  166    HG3  LYS  15           HG3      LYS  15 -16.161  -0.339 -10.067
  167    HD2  LYS  15           HD2      LYS  15 -18.179   0.197 -11.326
  168    HD3  LYS  15           HD3      LYS  15 -17.669   1.884 -11.438
  169    HE2  LYS  15           HE2      LYS  15 -15.713   1.234 -12.714
  170    HE3  LYS  15           HE3      LYS  15 -16.141  -0.469 -12.543
  171    HZ1  LYS  15           HZ1      LYS  15 -17.771   1.580 -13.950
  172    HZ2  LYS  15           HZ2      LYS  15 -18.143  -0.073 -13.810
  173    HZ3  LYS  15           HZ3      LYS  15 -16.784   0.419 -14.699
  174    H    THR  16           H        THR  16 -20.204   2.429  -8.466
  175    HA   THR  16           HA       THR  16 -20.012   3.414  -5.700
  176    HB   THR  16           HB       THR  16 -22.420   3.394  -7.528
  177    HG1  THR  16           HG1      THR  16 -20.302   4.914  -7.656
  178   HG21  THR  16          HG21      THR  16 -23.380   4.941  -5.885
  179   HG22  THR  16          HG22      THR  16 -21.934   4.782  -4.887
  180   HG23  THR  16          HG23      THR  16 -22.990   3.392  -5.138
  181    H    MET  17           H        MET  17 -20.147   1.879  -4.202
  182    HA   MET  17           HA       MET  17 -21.962  -0.394  -4.631
  183    HB2  MET  17           HB2      MET  17 -19.044  -0.453  -4.200
  184    HB3  MET  17           HB3      MET  17 -19.946  -1.487  -3.104
  185    HG2  MET  17           HG2      MET  17 -20.429  -1.608  -6.052
  186    HG3  MET  17           HG3      MET  17 -19.061  -2.449  -5.328
  187    HE1  MET  17           HE1      MET  17 -19.210  -4.364  -3.649
  188    HE2  MET  17           HE2      MET  17 -20.257  -3.543  -2.492
  189    HE3  MET  17           HE3      MET  17 -20.689  -5.150  -3.092
  190    H    GLN  18           H        GLN  18 -22.889  -1.230  -2.758
  191    HA   GLN  18           HA       GLN  18 -22.533   0.468  -0.392
  192    HB2  GLN  18           HB2      GLN  18 -24.934  -1.034  -1.407
  193    HB3  GLN  18           HB3      GLN  18 -24.830  -0.433   0.250
  194    HG2  GLN  18           HG2      GLN  18 -24.908   1.754  -0.384
  195    HG3  GLN  18           HG3      GLN  18 -24.275   1.427  -1.998
  196   HE21  GLN  18          HE21      GLN  18 -25.849   2.458  -3.096
  197   HE22  GLN  18          HE22      GLN  18 -27.477   1.902  -3.173
  198    H    PHE  19           H        PHE  19 -22.120  -0.418   1.547
  199    HA   PHE  19           HA       PHE  19 -21.910  -3.335   1.719
  200    HB2  PHE  19           HB2      PHE  19 -19.928  -1.330   2.838
  201    HB3  PHE  19           HB3      PHE  19 -19.849  -3.077   3.032
  202    HD1  PHE  19           HD1      PHE  19 -19.262  -4.502   1.129
  203    HD2  PHE  19           HD2      PHE  19 -19.190  -0.261   0.849
  204    HE1  PHE  19           HE1      PHE  19 -17.887  -4.665  -0.907
  205    HE2  PHE  19           HE2      PHE  19 -17.815  -0.411  -1.186
  206    HZ   PHE  19           HZ       PHE  19 -17.162  -2.618  -2.067
  207    H    GLU  20           H        GLU  20 -22.073  -4.059   3.973
  208    HA   GLU  20           HA       GLU  20 -23.954  -2.481   5.464
  209    HB2  GLU  20           HB2      GLU  20 -22.489  -5.019   6.209
  210    HB3  GLU  20           HB3      GLU  20 -23.790  -4.289   7.136
  211    HG2  GLU  20           HG2      GLU  20 -25.371  -4.734   5.419
  212    HG3  GLU  20           HG3      GLU  20 -24.097  -5.234   4.303
  213    HA   PRO  21           HA       PRO  21 -21.197  -0.130   7.992
  214    HB2  PRO  21           HB2      PRO  21 -22.543  -0.433  10.411
  215    HB3  PRO  21           HB3      PRO  21 -22.913   0.783   9.187
  216    HG2  PRO  21           HG2      PRO  21 -24.238  -1.834   9.712
  217    HG3  PRO  21           HG3      PRO  21 -24.955  -0.283   9.231
  218    HD2  PRO  21           HD2      PRO  21 -24.610  -2.269   7.474
  219    HD3  PRO  21           HD3      PRO  21 -24.397  -0.568   7.010
  220    H    SER  22           H        SER  22 -22.277  -3.308   9.015
  221    HA   SER  22           HA       SER  22 -19.861  -3.664  10.632
  222    HB2  SER  22           HB2      SER  22 -21.145  -5.740  11.410
  223    HB3  SER  22           HB3      SER  22 -21.804  -4.173  11.884
  224    HG   SER  22           HG       SER  22 -22.685  -5.881   9.789
  225    H    THR  23           H        THR  23 -20.340  -3.950   7.536
  226    HA   THR  23           HA       THR  23 -20.038  -6.602   6.783
  227    HB   THR  23           HB       THR  23 -19.197  -4.021   5.524
  228    HG1  THR  23           HG1      THR  23 -21.141  -6.020   5.149
  229   HG21  THR  23          HG21      THR  23 -17.432  -5.576   4.884
  230   HG22  THR  23          HG22      THR  23 -18.478  -5.207   3.513
  231   HG23  THR  23          HG23      THR  23 -18.644  -6.746   4.358
  232    H    MET  24           H        MET  24 -17.489  -4.238   7.503
  233    HA   MET  24           HA       MET  24 -15.381  -4.504   8.340
  234    HB2  MET  24           HB2      MET  24 -16.531  -6.675   9.360
  235    HB3  MET  24           HB3      MET  24 -15.485  -7.483   8.209
  236    HG2  MET  24           HG2      MET  24 -13.549  -6.682   9.267
  237    HG3  MET  24           HG3      MET  24 -14.467  -5.509  10.217
  238    HE1  MET  24           HE1      MET  24 -13.955  -6.034  12.625
  239    HE2  MET  24           HE2      MET  24 -13.539  -7.654  13.196
  240    HE3  MET  24           HE3      MET  24 -12.586  -6.898  11.917
  241    H    VAL  25           H        VAL  25 -13.471  -4.486   7.320
  242    HA   VAL  25           HA       VAL  25 -13.301  -4.207   4.668
  243    HB   VAL  25           HB       VAL  25 -11.112  -5.147   6.502
  244   HG11  VAL  25          HG11      VAL  25 -10.494  -5.688   4.197
  245   HG12  VAL  25          HG12      VAL  25 -10.855  -4.033   3.708
  246   HG13  VAL  25          HG13      VAL  25  -9.524  -4.354   4.819
  247   HG21  VAL  25          HG21      VAL  25 -12.124  -3.012   7.069
  248   HG22  VAL  25          HG22      VAL  25 -10.487  -2.776   6.457
  249   HG23  VAL  25          HG23      VAL  25 -11.872  -2.438   5.421
  250    H    TYR  26           H        TYR  26 -12.360  -7.294   6.223
  251    HA   TYR  26           HA       TYR  26 -11.595  -8.563   3.861
  252    HB2  TYR  26           HB2      TYR  26 -11.608 -10.641   5.048
  253    HB3  TYR  26           HB3      TYR  26 -11.053  -9.387   6.146
  254    HD1  TYR  26           HD1      TYR  26 -12.503  -8.628   7.994
  255    HD2  TYR  26           HD2      TYR  26 -13.640 -11.848   5.457
  256    HE1  TYR  26           HE1      TYR  26 -14.205  -9.309   9.631
  257    HE2  TYR  26           HE2      TYR  26 -15.347 -12.532   7.086
  258    HH   TYR  26           HH       TYR  26 -15.747 -12.295   9.539
  259    H    ASP  27           H        ASP  27 -14.776  -8.142   5.196
  260    HA   ASP  27           HA       ASP  27 -16.001 -10.048   3.400
  261    HB2  ASP  27           HB2      ASP  27 -17.034  -9.622   5.572
  262    HB3  ASP  27           HB3      ASP  27 -17.257  -7.929   5.155
  263    H    ALA  28           H        ALA  28 -15.448  -6.576   3.521
  264    HA   ALA  28           HA       ALA  28 -17.128  -5.883   1.369
  265    HB1  ALA  28           HB1      ALA  28 -14.665  -4.463   2.382
  266    HB2  ALA  28           HB2      ALA  28 -15.915  -3.769   1.349
  267    HB3  ALA  28           HB3      ALA  28 -16.303  -4.250   3.001
  268    H    CYS  29           H        CYS  29 -13.650  -6.504   1.565
  269    HA   CYS  29           HA       CYS  29 -13.092  -6.033  -1.134
  270    HB2  CYS  29           HB2      CYS  29 -10.991  -7.241  -0.699
  271    HB3  CYS  29           HB3      CYS  29 -11.346  -6.046   0.536
  272    HG   CYS  29           HG       CYS  29 -10.321  -8.915   1.133
  273    H    ARG  30           H        ARG  30 -14.375  -8.859   0.444
  274    HA   ARG  30           HA       ARG  30 -13.767 -10.587  -1.781
  275    HB2  ARG  30           HB2      ARG  30 -15.082 -12.315  -0.643
  276    HB3  ARG  30           HB3      ARG  30 -13.851 -11.617   0.393
  277    HG2  ARG  30           HG2      ARG  30 -15.430 -10.478   1.686
  278    HG3  ARG  30           HG3      ARG  30 -16.723 -10.711   0.502
  279    HD2  ARG  30           HD2      ARG  30 -16.564 -13.165   0.921
  280    HD3  ARG  30           HD3      ARG  30 -15.370 -12.842   2.176
  281    HE   ARG  30           HE       ARG  30 -17.593 -11.307   2.798
  282   HH11  ARG  30          HH11      ARG  30 -16.889 -14.727   2.409
  283   HH12  ARG  30          HH12      ARG  30 -18.091 -15.229   3.561
  284   HH21  ARG  30          HH21      ARG  30 -19.159 -11.966   4.293
  285   HH22  ARG  30          HH22      ARG  30 -19.388 -13.653   4.635
  286    H    MET  31           H        MET  31 -16.583  -8.749  -0.728
  287    HA   MET  31           HA       MET  31 -18.255  -9.853  -2.776
  288    HB2  MET  31           HB2      MET  31 -18.629  -7.309  -1.196
  289    HB3  MET  31           HB3      MET  31 -19.842  -8.132  -2.158
  290    HG2  MET  31           HG2      MET  31 -19.798 -10.034  -0.706
  291    HG3  MET  31           HG3      MET  31 -18.478  -9.340   0.221
  292    HE1  MET  31           HE1      MET  31 -19.958  -6.441   2.104
  293    HE2  MET  31           HE2      MET  31 -18.544  -7.396   1.633
  294    HE3  MET  31           HE3      MET  31 -19.280  -6.276   0.480
  295    H    ILE  32           H        ILE  32 -16.334  -6.898  -2.430
  296    HA   ILE  32           HA       ILE  32 -17.313  -5.621  -4.724
  297    HB   ILE  32           HB       ILE  32 -16.023  -4.432  -3.025
  298   HG12  ILE  32          HG12      ILE  32 -14.801  -4.342  -5.789
  299   HG13  ILE  32          HG13      ILE  32 -16.238  -3.471  -5.258
  300   HG21  ILE  32          HG21      ILE  32 -13.583  -4.588  -2.963
  301   HG22  ILE  32          HG22      ILE  32 -14.348  -6.114  -2.519
  302   HG23  ILE  32          HG23      ILE  32 -13.642  -5.916  -4.123
  303   HD11  ILE  32          HD11      ILE  32 -14.916  -2.163  -3.728
  304   HD12  ILE  32          HD12      ILE  32 -13.472  -3.084  -4.152
  305   HD13  ILE  32          HD13      ILE  32 -14.248  -2.057  -5.355
  306    H    ARG  33           H        ARG  33 -14.498  -7.777  -4.359
  307    HA   ARG  33           HA       ARG  33 -13.722  -7.759  -7.058
  308    HB2  ARG  33           HB2      ARG  33 -12.434  -9.718  -6.593
  309    HB3  ARG  33           HB3      ARG  33 -12.375  -8.706  -5.160
  310    HG2  ARG  33           HG2      ARG  33 -14.166 -10.135  -4.168
  311    HG3  ARG  33           HG3      ARG  33 -14.004 -11.204  -5.562
  312    HD2  ARG  33           HD2      ARG  33 -12.702 -12.086  -3.734
  313    HD3  ARG  33           HD3      ARG  33 -11.611 -11.512  -4.996
  314    HE   ARG  33           HE       ARG  33 -11.902  -9.395  -3.280
  315   HH11  ARG  33          HH11      ARG  33 -10.805 -12.713  -2.964
  316   HH12  ARG  33          HH12      ARG  33  -9.732 -12.358  -1.640
  317   HH21  ARG  33          HH21      ARG  33 -10.474  -8.933  -1.566
  318   HH22  ARG  33          HH22      ARG  33  -9.552 -10.208  -0.839
  319    H    GLU  34           H        GLU  34 -16.300  -9.276  -5.431
  320    HA   GLU  34           HA       GLU  34 -16.868 -11.288  -7.407
  321    HB2  GLU  34           HB2      GLU  34 -17.512 -11.488  -4.995
  322    HB3  GLU  34           HB3      GLU  34 -18.695 -10.212  -5.250
  323    HG2  GLU  34           HG2      GLU  34 -19.775 -12.357  -5.314
  324    HG3  GLU  34           HG3      GLU  34 -19.825 -11.618  -6.914
  325    H    ARG  35           H        ARG  35 -18.108  -8.067  -6.607
  326    HA   ARG  35           HA       ARG  35 -20.140  -8.156  -8.662
  327    HB2  ARG  35           HB2      ARG  35 -19.219  -5.565  -7.497
  328    HB3  ARG  35           HB3      ARG  35 -20.843  -6.086  -7.903
  329    HG2  ARG  35           HG2      ARG  35 -19.285  -7.116  -5.550
  330    HG3  ARG  35           HG3      ARG  35 -20.407  -5.760  -5.480
  331    HD2  ARG  35           HD2      ARG  35 -21.110  -8.576  -6.300
  332    HD3  ARG  35           HD3      ARG  35 -21.404  -7.858  -4.713
  333    HE   ARG  35           HE       ARG  35 -22.570  -6.460  -6.989
  334   HH11  ARG  35          HH11      ARG  35 -23.032  -8.802  -4.416
  335   HH12  ARG  35          HH12      ARG  35 -24.759  -8.604  -4.370
  336   HH21  ARG  35          HH21      ARG  35 -24.842  -6.237  -6.966
  337   HH22  ARG  35          HH22      ARG  35 -25.793  -7.171  -5.846
  338    H    ILE  36           H        ILE  36 -17.145  -6.335  -8.131
  339    HA   ILE  36           HA       ILE  36 -17.237  -5.398 -10.915
  340    HB   ILE  36           HB       ILE  36 -15.483  -4.274  -8.736
  341   HG12  ILE  36          HG12      ILE  36 -18.248  -3.280  -9.461
  342   HG13  ILE  36          HG13      ILE  36 -17.912  -4.275  -8.049
  343   HG21  ILE  36          HG21      ILE  36 -15.591  -2.249 -10.138
  344   HG22  ILE  36          HG22      ILE  36 -14.923  -3.631 -11.010
  345   HG23  ILE  36          HG23      ILE  36 -16.587  -3.124 -11.300
  346   HD11  ILE  36          HD11      ILE  36 -16.443  -2.539  -7.175
  347   HD12  ILE  36          HD12      ILE  36 -16.775  -1.544  -8.592
  348   HD13  ILE  36          HD13      ILE  36 -18.072  -1.929  -7.461
  349    HA   PRO  37           HA       PRO  37 -13.728  -8.268 -11.353
  350    HB2  PRO  37           HB2      PRO  37 -13.600  -8.050 -14.072
  351    HB3  PRO  37           HB3      PRO  37 -14.683  -9.161 -13.227
  352    HG2  PRO  37           HG2      PRO  37 -15.266  -6.495 -14.437
  353    HG3  PRO  37           HG3      PRO  37 -16.245  -7.972 -14.437
  354    HD2  PRO  37           HD2      PRO  37 -16.732  -5.877 -12.777
  355    HD3  PRO  37           HD3      PRO  37 -17.096  -7.559 -12.339
  356    H    GLU  38           H        GLU  38 -14.179  -5.004 -12.433
  357    HA   GLU  38           HA       GLU  38 -11.475  -4.533 -13.242
  358    HB2  GLU  38           HB2      GLU  38 -13.385  -3.241 -14.119
  359    HB3  GLU  38           HB3      GLU  38 -13.678  -2.595 -12.512
  360    HG2  GLU  38           HG2      GLU  38 -11.637  -1.371 -12.549
  361    HG3  GLU  38           HG3      GLU  38 -11.119  -2.176 -14.031
  362    H    ALA  39           H        ALA  39 -13.031  -4.863 -10.270
  363    HA   ALA  39           HA       ALA  39 -11.531  -2.994  -8.733
  364    HB1  ALA  39           HB1      ALA  39 -13.015  -5.460  -7.829
  365    HB2  ALA  39           HB2      ALA  39 -12.438  -4.154  -6.792
  366    HB3  ALA  39           HB3      ALA  39 -13.699  -3.841  -7.984
  367    H    LEU  40           H        LEU  40 -11.356  -6.554  -8.957
  368    HA   LEU  40           HA       LEU  40  -8.997  -6.609  -7.382
  369    HB2  LEU  40           HB2      LEU  40  -8.871  -9.042  -7.984
  370    HB3  LEU  40           HB3      LEU  40 -10.298  -8.522  -7.131
  371    HG   LEU  40           HG       LEU  40 -10.817 -10.231  -8.773
  372   HD11  LEU  40          HD11      LEU  40 -11.960  -7.631  -9.738
  373   HD12  LEU  40          HD12      LEU  40 -12.671  -9.236  -9.865
  374   HD13  LEU  40          HD13      LEU  40 -12.488  -8.477  -8.283
  375   HD21  LEU  40          HD21      LEU  40 -10.665  -9.794 -11.186
  376   HD22  LEU  40          HD22      LEU  40  -9.757  -8.324 -10.839
  377   HD23  LEU  40          HD23      LEU  40  -9.088  -9.895 -10.398
  378    H    ALA  41           H        ALA  41  -9.583  -6.529 -10.801
  379    HA   ALA  41           HA       ALA  41  -8.257  -6.124 -12.583
  380    HB1  ALA  41           HB1      ALA  41  -6.067  -5.127 -12.269
  381    HB2  ALA  41           HB2      ALA  41  -7.248  -4.391 -11.185
  382    HB3  ALA  41           HB3      ALA  41  -6.093  -5.568 -10.562
  383    H    GLY  42           H        GLY  42  -6.590  -8.031 -10.129
  384    HA2  GLY  42           HA2      GLY  42  -6.078 -10.136 -12.040
  385    HA3  GLY  42           HA3      GLY  42  -4.642  -9.335 -11.414
  386    HA   PRO  43           HA       PRO  43  -5.119 -12.059  -7.919
  387    HB2  PRO  43           HB2      PRO  43  -2.992 -10.821  -6.523
  388    HB3  PRO  43           HB3      PRO  43  -2.887 -12.232  -7.577
  389    HG2  PRO  43           HG2      PRO  43  -1.753  -9.721  -8.070
  390    HG3  PRO  43           HG3      PRO  43  -1.968 -11.020  -9.254
  391    HD2  PRO  43           HD2      PRO  43  -3.621  -8.582  -8.790
  392    HD3  PRO  43           HD3      PRO  43  -3.263  -9.437 -10.307
  393    HA   PRO  44           HA       PRO  44  -7.506  -9.069  -5.491
  394    HB2  PRO  44           HB2      PRO  44  -9.166 -10.864  -4.345
  395    HB3  PRO  44           HB3      PRO  44  -9.363 -10.322  -6.016
  396    HG2  PRO  44           HG2      PRO  44  -8.133 -12.841  -4.973
  397    HG3  PRO  44           HG3      PRO  44  -9.215 -12.613  -6.359
  398    HD2  PRO  44           HD2      PRO  44  -6.511 -12.885  -6.592
  399    HD3  PRO  44           HD3      PRO  44  -7.506 -11.977  -7.746
  400    H    ASN  45           H        ASN  45  -5.181 -11.175  -4.573
  401    HA   ASN  45           HA       ASN  45  -5.628 -11.277  -1.735
  402    HB2  ASN  45           HB2      ASN  45  -3.102 -11.763  -3.332
  403    HB3  ASN  45           HB3      ASN  45  -3.333 -12.166  -1.636
  404   HD21  ASN  45          HD21      ASN  45  -2.733 -13.768  -4.057
  405   HD22  ASN  45          HD22      ASN  45  -3.924 -15.034  -4.056
  406    H    ASP  46           H        ASP  46  -3.497  -9.485  -3.914
  407    HA   ASP  46           HA       ASP  46  -2.562  -7.820  -1.732
  408    HB2  ASP  46           HB2      ASP  46  -1.286  -6.826  -3.848
  409    HB3  ASP  46           HB3      ASP  46  -0.700  -8.239  -2.987
  410    H    PHE  47           H        PHE  47  -5.319  -7.564  -2.579
  411    HA   PHE  47           HA       PHE  47  -5.206  -4.731  -3.352
  412    HB2  PHE  47           HB2      PHE  47  -7.020  -6.891  -4.322
  413    HB3  PHE  47           HB3      PHE  47  -7.674  -5.264  -4.156
  414    HD1  PHE  47           HD1      PHE  47  -4.745  -7.050  -5.604
  415    HD2  PHE  47           HD2      PHE  47  -7.476  -3.801  -5.947
  416    HE1  PHE  47           HE1      PHE  47  -3.771  -6.463  -7.784
  417    HE2  PHE  47           HE2      PHE  47  -6.501  -3.207  -8.122
  418    HZ   PHE  47           HZ       PHE  47  -4.656  -4.480  -9.034
  419    H    GLY  48           H        GLY  48  -5.965  -3.381  -1.898
  420    HA2  GLY  48           HA2      GLY  48  -7.698  -4.469   0.234
  421    HA3  GLY  48           HA3      GLY  48  -6.263  -3.537   0.620
  422    H    LEU  49           H        LEU  49  -8.125  -2.444   1.819
  423    HA   LEU  49           HA       LEU  49  -9.565  -0.568   0.087
  424    HB2  LEU  49           HB2      LEU  49 -10.073  -1.270   2.979
  425    HB3  LEU  49           HB3      LEU  49 -11.064  -0.222   1.983
  426    HG   LEU  49           HG       LEU  49 -10.671  -3.190   1.598
  427   HD11  LEU  49          HD11      LEU  49 -13.042  -3.326   2.169
  428   HD12  LEU  49          HD12      LEU  49 -12.097  -2.639   3.489
  429   HD13  LEU  49          HD13      LEU  49 -13.073  -1.588   2.463
  430   HD21  LEU  49          HD21      LEU  49 -10.907  -2.048  -0.543
  431   HD22  LEU  49          HD22      LEU  49 -12.345  -2.997  -0.166
  432   HD23  LEU  49          HD23      LEU  49 -12.364  -1.244   0.039
  433    H    PHE  50           H        PHE  50  -8.462   1.200  -0.178
  434    HA   PHE  50           HA       PHE  50  -7.112   2.477   2.099
  435    HB2  PHE  50           HB2      PHE  50  -5.845   2.251  -0.017
  436    HB3  PHE  50           HB3      PHE  50  -7.058   3.225  -0.836
  437    HD1  PHE  50           HD1      PHE  50  -4.258   3.267   1.540
  438    HD2  PHE  50           HD2      PHE  50  -7.151   5.610  -0.535
  439    HE1  PHE  50           HE1      PHE  50  -3.012   5.307   2.107
  440    HE2  PHE  50           HE2      PHE  50  -5.905   7.652   0.032
  441    HZ   PHE  50           HZ       PHE  50  -3.833   7.502   1.353
  442    H    LEU  51           H        LEU  51  -8.046   4.129   3.155
  443    HA   LEU  51           HA       LEU  51 -10.540   5.189   2.060
  444    HB2  LEU  51           HB2      LEU  51 -10.117   4.368   4.516
  445    HB3  LEU  51           HB3      LEU  51  -9.408   5.954   4.730
  446    HG   LEU  51           HG       LEU  51 -11.764   5.811   5.491
  447   HD11  LEU  51          HD11      LEU  51 -11.332   7.672   3.163
  448   HD12  LEU  51          HD12      LEU  51 -12.562   7.846   4.415
  449   HD13  LEU  51          HD13      LEU  51 -10.851   7.970   4.834
  450   HD21  LEU  51          HD21      LEU  51 -13.559   5.659   3.866
  451   HD22  LEU  51          HD22      LEU  51 -12.387   5.433   2.569
  452   HD23  LEU  51          HD23      LEU  51 -12.557   4.208   3.825
  453    H    SER  52           H        SER  52 -10.482   6.961   0.897
  454    HA   SER  52           HA       SER  52  -8.047   8.546   0.874
  455    HB2  SER  52           HB2      SER  52  -9.070   7.725  -1.254
  456    HB3  SER  52           HB3      SER  52 -10.464   8.751  -0.926
  457    HG   SER  52           HG       SER  52  -8.302   9.439  -2.192
  458    H    ASP  53           H        ASP  53  -7.885  10.266   2.089
  459    HA   ASP  53           HA       ASP  53 -10.278  11.787   2.828
  460    HB2  ASP  53           HB2      ASP  53  -8.717  11.101   4.643
  461    HB3  ASP  53           HB3      ASP  53  -7.443  12.038   3.869
  462    H    ASP  54           H        ASP  54  -6.906  12.609   2.036
  463    HA   ASP  54           HA       ASP  54  -7.536  14.007  -0.335
  464    HB2  ASP  54           HB2      ASP  54  -8.432  15.666   1.294
  465    HB3  ASP  54           HB3      ASP  54  -6.828  15.779   2.016
  466    H    ASP  55           H        ASP  55  -5.224  14.773   2.250
  467    HA   ASP  55           HA       ASP  55  -2.979  14.583   0.489
  468    HB2  ASP  55           HB2      ASP  55  -2.989  16.140   2.387
  469    HB3  ASP  55           HB3      ASP  55  -3.098  14.790   3.506
  470    HA   PRO  56           HA       PRO  56  -1.942  10.255   0.598
  471    HB2  PRO  56           HB2      PRO  56   0.786  10.676   1.284
  472    HB3  PRO  56           HB3      PRO  56   0.111  10.383  -0.318
  473    HG2  PRO  56           HG2      PRO  56   0.855  12.941   0.980
  474    HG3  PRO  56           HG3      PRO  56   0.848  12.509  -0.738
  475    HD2  PRO  56           HD2      PRO  56  -1.017  14.125   0.299
  476    HD3  PRO  56           HD3      PRO  56  -1.422  12.944  -0.964
  477    H    LYS  57           H        LYS  57  -0.770  12.333   3.262
  478    HA   LYS  57           HA       LYS  57  -0.430  10.038   5.000
  479    HB2  LYS  57           HB2      LYS  57  -0.337  12.978   5.668
  480    HB3  LYS  57           HB3      LYS  57   0.127  11.664   6.737
  481    HG2  LYS  57           HG2      LYS  57   1.782  11.073   4.816
  482    HG3  LYS  57           HG3      LYS  57   1.539  12.770   4.375
  483    HD2  LYS  57           HD2      LYS  57   2.022  13.358   6.759
  484    HD3  LYS  57           HD3      LYS  57   2.473  11.670   7.010
  485    HE2  LYS  57           HE2      LYS  57   4.221  11.878   5.333
  486    HE3  LYS  57           HE3      LYS  57   3.757  13.556   5.045
  487    HZ1  LYS  57           HZ1      LYS  57   4.433  14.158   7.223
  488    HZ2  LYS  57           HZ2      LYS  57   5.701  13.243   6.562
  489    HZ3  LYS  57           HZ3      LYS  57   4.643  12.542   7.687
  490    H    LYS  58           H        LYS  58  -2.971  12.205   4.194
  491    HA   LYS  58           HA       LYS  58  -4.436  11.969   6.653
  492    HB2  LYS  58           HB2      LYS  58  -5.496  12.702   3.917
  493    HB3  LYS  58           HB3      LYS  58  -6.273  13.009   5.460
  494    HG2  LYS  58           HG2      LYS  58  -3.686  14.235   4.539
  495    HG3  LYS  58           HG3      LYS  58  -5.265  15.013   4.489
  496    HD2  LYS  58           HD2      LYS  58  -3.839  14.072   6.974
  497    HD3  LYS  58           HD3      LYS  58  -3.947  15.741   6.408
  498    HE2  LYS  58           HE2      LYS  58  -6.418  15.589   6.595
  499    HE3  LYS  58           HE3      LYS  58  -6.233  13.975   7.279
  500    HZ1  LYS  58           HZ1      LYS  58  -6.489  15.514   9.056
  501    HZ2  LYS  58           HZ2      LYS  58  -5.286  16.538   8.440
  502    HZ3  LYS  58           HZ3      LYS  58  -4.864  15.015   9.061
  503    H    GLY  59           H        GLY  59  -4.351  10.351   3.555
  504    HA2  GLY  59           HA2      GLY  59  -6.587   8.634   4.064
  505    HA3  GLY  59           HA3      GLY  59  -5.387   8.433   2.794
  506    H    ILE  60           H        ILE  60  -6.434   6.288   4.274
  507    HA   ILE  60           HA       ILE  60  -4.023   5.301   5.553
  508    HB   ILE  60           HB       ILE  60  -5.503   4.323   7.442
  509   HG12  ILE  60          HG12      ILE  60  -7.206   6.189   8.132
  510   HG13  ILE  60          HG13      ILE  60  -7.221   6.548   6.409
  511   HG21  ILE  60          HG21      ILE  60  -5.036   6.245   8.881
  512   HG22  ILE  60          HG22      ILE  60  -3.670   5.820   7.848
  513   HG23  ILE  60          HG23      ILE  60  -4.678   7.212   7.449
  514   HD11  ILE  60          HD11      ILE  60  -7.910   4.256   5.942
  515   HD12  ILE  60          HD12      ILE  60  -7.906   3.907   7.671
  516   HD13  ILE  60          HD13      ILE  60  -9.045   5.080   7.011
  517    H    TRP  61           H        TRP  61  -4.178   2.961   6.025
  518    HA   TRP  61           HA       TRP  61  -5.769   1.661   3.950
  519    HB2  TRP  61           HB2      TRP  61  -3.399   0.755   5.574
  520    HB3  TRP  61           HB3      TRP  61  -4.363  -0.371   4.622
  521    HD1  TRP  61           HD1      TRP  61  -1.634   2.183   4.317
  522    HE1  TRP  61           HE1      TRP  61  -0.856   2.347   1.868
  523    HE3  TRP  61           HE3      TRP  61  -5.335  -0.574   2.129
  524    HZ2  TRP  61           HZ2      TRP  61  -1.710   1.409  -0.658
  525    HZ3  TRP  61           HZ3      TRP  61  -5.281  -0.899  -0.307
  526    HH2  TRP  61           HH2      TRP  61  -3.505   0.075  -1.671
  527    H    LEU  62           H        LEU  62  -7.463   0.475   4.372
  528    HA   LEU  62           HA       LEU  62  -8.398   0.344   7.096
  529    HB2  LEU  62           HB2      LEU  62  -9.647  -0.643   4.525
  530    HB3  LEU  62           HB3      LEU  62 -10.449  -0.573   6.084
  531    HG   LEU  62           HG       LEU  62  -9.437   1.828   4.553
  532   HD11  LEU  62          HD11      LEU  62 -12.236   0.781   4.930
  533   HD12  LEU  62          HD12      LEU  62 -11.799   2.309   4.162
  534   HD13  LEU  62          HD13      LEU  62 -11.317   0.781   3.424
  535   HD21  LEU  62          HD21      LEU  62 -11.131   1.629   7.036
  536   HD22  LEU  62          HD22      LEU  62  -9.445   2.148   6.973
  537   HD23  LEU  62          HD23      LEU  62 -10.694   3.115   6.188
  538    H    GLU  63           H        GLU  63  -7.595  -1.251   8.364
  539    HA   GLU  63           HA       GLU  63  -6.773  -3.767   7.246
  540    HB2  GLU  63           HB2      GLU  63  -6.086  -4.339   9.464
  541    HB3  GLU  63           HB3      GLU  63  -5.636  -2.666   9.182
  542    HG2  GLU  63           HG2      GLU  63  -7.660  -1.962  10.445
  543    HG3  GLU  63           HG3      GLU  63  -7.975  -3.660  10.795
  544    H    ALA  64           H        ALA  64  -7.593  -5.837   7.996
  545    HA   ALA  64           HA       ALA  64 -10.490  -5.835   7.899
  546    HB1  ALA  64           HB1      ALA  64  -9.210  -7.378   6.496
  547    HB2  ALA  64           HB2      ALA  64  -8.550  -8.142   7.941
  548    HB3  ALA  64           HB3      ALA  64 -10.278  -8.243   7.602
  549    H    GLY  65           H        GLY  65  -8.382  -5.494  10.353
  550    HA2  GLY  65           HA2      GLY  65  -9.548  -7.329  12.252
  551    HA3  GLY  65           HA3      GLY  65  -8.345  -6.095  12.593
  552    H    LYS  66           H        LYS  66 -10.926  -4.785  10.893
  553    HA   LYS  66           HA       LYS  66 -12.692  -4.375  13.101
  554    HB2  LYS  66           HB2      LYS  66 -12.173  -2.267  13.752
  555    HB3  LYS  66           HB3      LYS  66 -10.584  -2.649  13.097
  556    HG2  LYS  66           HG2      LYS  66 -12.753  -1.316  11.504
  557    HG3  LYS  66           HG3      LYS  66 -11.527  -0.439  12.420
  558    HD2  LYS  66           HD2      LYS  66  -9.826  -1.088  11.017
  559    HD3  LYS  66           HD3      LYS  66 -10.683  -2.537  10.479
  560    HE2  LYS  66           HE2      LYS  66 -12.198  -1.216   9.165
  561    HE3  LYS  66           HE3      LYS  66 -11.510   0.279   9.802
  562    HZ1  LYS  66           HZ1      LYS  66 -10.037  -1.720   8.189
  563    HZ2  LYS  66           HZ2      LYS  66  -9.432  -0.233   8.744
  564    HZ3  LYS  66           HZ3      LYS  66 -10.678  -0.269   7.594
  565    H    ALA  67           H        ALA  67 -14.559  -2.986  12.418
  566    HA   ALA  67           HA       ALA  67 -15.246  -3.762   9.711
  567    HB1  ALA  67           HB1      ALA  67 -16.772  -4.156  11.597
  568    HB2  ALA  67           HB2      ALA  67 -16.946  -2.410  11.797
  569    HB3  ALA  67           HB3      ALA  67 -17.507  -3.187  10.314
  570    H    LEU  68           H        LEU  68 -16.804  -2.043   8.598
  571    HA   LEU  68           HA       LEU  68 -15.030   0.055   7.789
  572    HB2  LEU  68           HB2      LEU  68 -17.877  -0.553   7.010
  573    HB3  LEU  68           HB3      LEU  68 -16.861   0.638   6.224
  574    HG   LEU  68           HG       LEU  68 -16.313  -2.332   6.305
  575   HD11  LEU  68          HD11      LEU  68 -18.245  -1.807   4.924
  576   HD12  LEU  68          HD12      LEU  68 -17.314  -0.577   4.070
  577   HD13  LEU  68          HD13      LEU  68 -16.870  -2.278   3.925
  578   HD21  LEU  68          HD21      LEU  68 -14.273  -0.994   6.199
  579   HD22  LEU  68          HD22      LEU  68 -14.567  -1.826   4.672
  580   HD23  LEU  68          HD23      LEU  68 -14.922  -0.104   4.823
  581    H    ASP  69           H        ASP  69 -18.209  -0.052   9.340
  582    HA   ASP  69           HA       ASP  69 -18.480   2.781   9.571
  583    HB2  ASP  69           HB2      ASP  69 -20.438   1.354   9.377
  584    HB3  ASP  69           HB3      ASP  69 -19.988   0.473  10.829
  585    H    TYR  70           H        TYR  70 -16.761   0.463  11.276
  586    HA   TYR  70           HA       TYR  70 -16.716   1.415  13.881
  587    HB2  TYR  70           HB2      TYR  70 -15.627  -0.673  13.011
  588    HB3  TYR  70           HB3      TYR  70 -14.376   0.337  12.295
  589    HD1  TYR  70           HD1      TYR  70 -16.015  -0.238  15.600
  590    HD2  TYR  70           HD2      TYR  70 -12.456   0.665  13.470
  591    HE1  TYR  70           HE1      TYR  70 -14.751  -0.298  17.706
  592    HE2  TYR  70           HE2      TYR  70 -11.179   0.613  15.562
  593    HH   TYR  70           HH       TYR  70 -12.404  -0.681  18.436
  594    H    TYR  71           H        TYR  71 -15.002   2.458  10.985
  595    HA   TYR  71           HA       TYR  71 -13.674   4.644  12.308
  596    HB2  TYR  71           HB2      TYR  71 -13.876   3.644   9.501
  597    HB3  TYR  71           HB3      TYR  71 -13.373   5.309   9.764
  598    HD1  TYR  71           HD1      TYR  71 -12.559   1.803  10.682
  599    HD2  TYR  71           HD2      TYR  71 -11.142   5.798  10.321
  600    HE1  TYR  71           HE1      TYR  71 -10.268   1.023  11.114
  601    HE2  TYR  71           HE2      TYR  71  -8.848   5.023  10.743
  602    HH   TYR  71           HH       TYR  71  -7.933   1.805  10.625
  603    H    MET  72           H        MET  72 -14.297   6.438   9.940
  604    HA   MET  72           HA       MET  72 -16.809   7.495  11.064
  605    HB2  MET  72           HB2      MET  72 -14.586   8.891   9.569
  606    HB3  MET  72           HB3      MET  72 -16.052   9.673  10.144
  607    HG2  MET  72           HG2      MET  72 -15.427   9.142  12.447
  608    HG3  MET  72           HG3      MET  72 -13.953   8.370  11.864
  609    HE1  MET  72           HE1      MET  72 -15.666  11.658  10.515
  610    HE2  MET  72           HE2      MET  72 -15.920  11.737  12.258
  611    HE3  MET  72           HE3      MET  72 -14.838  12.886  11.470
  612    H    LEU  73           H        LEU  73 -16.528   5.450   8.857
  613    HA   LEU  73           HA       LEU  73 -17.140   6.930   6.446
  614    HB2  LEU  73           HB2      LEU  73 -17.667   4.046   6.409
  615    HB3  LEU  73           HB3      LEU  73 -16.804   5.046   5.268
  616    HG   LEU  73           HG       LEU  73 -15.700   3.849   7.804
  617   HD11  LEU  73          HD11      LEU  73 -14.242   2.658   6.234
  618   HD12  LEU  73          HD12      LEU  73 -15.948   2.292   5.970
  619   HD13  LEU  73          HD13      LEU  73 -15.109   3.402   4.888
  620   HD21  LEU  73          HD21      LEU  73 -14.356   5.662   5.805
  621   HD22  LEU  73          HD22      LEU  73 -14.751   6.061   7.477
  622   HD23  LEU  73          HD23      LEU  73 -13.559   4.811   7.128
  623    H    ARG  74           H        ARG  74 -18.935   7.027   5.376
  624    HA   ARG  74           HA       ARG  74 -21.301   5.634   6.167
  625    HB2  ARG  74           HB2      ARG  74 -22.595   7.828   6.469
  626    HB3  ARG  74           HB3      ARG  74 -21.605   7.275   7.807
  627    HG2  ARG  74           HG2      ARG  74 -21.233   9.580   7.678
  628    HG3  ARG  74           HG3      ARG  74 -19.812   8.854   6.935
  629    HD2  ARG  74           HD2      ARG  74 -21.710   9.246   4.883
  630    HD3  ARG  74           HD3      ARG  74 -21.657  10.728   5.837
  631    HE   ARG  74           HE       ARG  74 -19.073   9.640   5.102
  632   HH11  ARG  74          HH11      ARG  74 -21.671  11.810   4.175
  633   HH12  ARG  74          HH12      ARG  74 -20.654  12.807   3.177
  634   HH21  ARG  74          HH21      ARG  74 -17.735  10.943   3.794
  635   HH22  ARG  74          HH22      ARG  74 -18.412  12.318   2.964
  636    H    ASN  75           H        ASN  75 -23.182   7.011   4.915
  637    HA   ASN  75           HA       ASN  75 -22.746   6.445   2.203
  638    HB2  ASN  75           HB2      ASN  75 -24.886   7.904   3.711
  639    HB3  ASN  75           HB3      ASN  75 -24.886   7.942   1.951
  640   HD21  ASN  75          HD21      ASN  75 -25.104   5.868   4.770
  641   HD22  ASN  75          HD22      ASN  75 -25.825   4.523   3.938
  642    H    GLY  76           H        GLY  76 -21.167   7.475   1.114
  643    HA2  GLY  76           HA2      GLY  76 -21.185   9.561  -0.335
  644    HA3  GLY  76           HA3      GLY  76 -21.187  10.425   1.193
  645    H    ASP  77           H        ASP  77 -19.319   8.030   2.100
  646    HA   ASP  77           HA       ASP  77 -16.927   9.555   1.633
  647    HB2  ASP  77           HB2      ASP  77 -17.432   6.966   3.093
  648    HB3  ASP  77           HB3      ASP  77 -15.819   7.649   2.902
  649    H    THR  78           H        THR  78 -15.306   9.197   0.256
  650    HA   THR  78           HA       THR  78 -15.568   7.115  -1.721
  651    HB   THR  78           HB       THR  78 -13.363   9.153  -1.317
  652    HG1  THR  78           HG1      THR  78 -15.267  10.214  -1.832
  653   HG21  THR  78          HG21      THR  78 -12.768   8.650  -3.647
  654   HG22  THR  78          HG22      THR  78 -14.003   7.391  -3.689
  655   HG23  THR  78          HG23      THR  78 -12.611   7.225  -2.618
  656    H    MET  79           H        MET  79 -14.694   5.160  -1.559
  657    HA   MET  79           HA       MET  79 -12.404   4.807   0.249
  658    HB2  MET  79           HB2      MET  79 -14.596   3.739   1.022
  659    HB3  MET  79           HB3      MET  79 -14.441   2.664  -0.363
  660    HG2  MET  79           HG2      MET  79 -12.293   1.876   0.488
  661    HG3  MET  79           HG3      MET  79 -12.450   2.952   1.875
  662    HE1  MET  79           HE1      MET  79 -15.062   0.590   0.027
  663    HE2  MET  79           HE2      MET  79 -13.546  -0.310   0.144
  664    HE3  MET  79           HE3      MET  79 -14.954  -0.823   1.079
  665    H    GLU  80           H        GLU  80 -10.684   4.464  -0.925
  666    HA   GLU  80           HA       GLU  80 -10.884   3.808  -3.721
  667    HB2  GLU  80           HB2      GLU  80  -9.271   5.451  -2.553
  668    HB3  GLU  80           HB3      GLU  80  -8.377   4.027  -2.047
  669    HG2  GLU  80           HG2      GLU  80  -7.794   3.485  -4.260
  670    HG3  GLU  80           HG3      GLU  80  -8.953   4.637  -4.926
  671    H    TYR  81           H        TYR  81 -10.889   1.707  -4.489
  672    HA   TYR  81           HA       TYR  81  -9.765  -0.350  -2.758
  673    HB2  TYR  81           HB2      TYR  81 -12.061  -0.693  -3.719
  674    HB3  TYR  81           HB3      TYR  81 -11.338  -0.688  -5.324
  675    HD1  TYR  81           HD1      TYR  81 -11.533  -2.547  -2.135
  676    HD2  TYR  81           HD2      TYR  81 -10.209  -2.607  -6.173
  677    HE1  TYR  81           HE1      TYR  81 -11.094  -4.960  -1.950
  678    HE2  TYR  81           HE2      TYR  81  -9.771  -5.018  -6.002
  679    HH   TYR  81           HH       TYR  81  -9.308  -6.679  -4.280
  680    H    ARG  82           H        ARG  82  -7.697  -0.539  -3.039
  681    HA   ARG  82           HA       ARG  82  -6.634  -0.438  -5.764
  682    HB2  ARG  82           HB2      ARG  82  -4.729   0.964  -4.935
  683    HB3  ARG  82           HB3      ARG  82  -6.280   1.790  -4.992
  684    HG2  ARG  82           HG2      ARG  82  -6.549   1.494  -2.596
  685    HG3  ARG  82           HG3      ARG  82  -5.014   0.621  -2.523
  686    HD2  ARG  82           HD2      ARG  82  -5.382   3.484  -3.391
  687    HD3  ARG  82           HD3      ARG  82  -4.784   2.957  -1.821
  688    HE   ARG  82           HE       ARG  82  -2.990   1.817  -3.361
  689   HH11  ARG  82          HH11      ARG  82  -4.470   4.965  -3.736
  690   HH12  ARG  82          HH12      ARG  82  -3.040   5.702  -4.414
  691   HH21  ARG  82          HH21      ARG  82  -1.103   2.777  -4.264
  692   HH22  ARG  82          HH22      ARG  82  -1.124   4.449  -4.717
  693    H    LYS  83           H        LYS  83  -4.514  -1.307  -5.976
  694    HA   LYS  83           HA       LYS  83  -4.070  -3.719  -4.647
  695    HB2  LYS  83           HB2      LYS  83  -3.157  -2.932  -6.887
  696    HB3  LYS  83           HB3      LYS  83  -1.973  -2.001  -5.989
  697    HG2  LYS  83           HG2      LYS  83  -1.000  -4.010  -5.090
  698    HG3  LYS  83           HG3      LYS  83  -2.266  -4.996  -5.837
  699    HD2  LYS  83           HD2      LYS  83  -1.520  -4.240  -8.051
  700    HD3  LYS  83           HD3      LYS  83  -0.249  -3.285  -7.291
  701    HE2  LYS  83           HE2      LYS  83   0.871  -5.203  -7.934
  702    HE3  LYS  83           HE3      LYS  83   0.488  -5.527  -6.245
  703    HZ1  LYS  83           HZ1      LYS  83  -1.226  -6.460  -8.478
  704    HZ2  LYS  83           HZ2      LYS  83  -1.244  -6.985  -6.860
  705    HZ3  LYS  83           HZ3      LYS  83   0.061  -7.376  -7.870
  706    H    LYS  84           H        LYS  84  -3.308  -4.133  -2.686
  707    HA   LYS  84           HA       LYS  84  -2.685  -2.315  -0.706
  708    HB2  LYS  84           HB2      LYS  84  -1.918  -5.186  -1.148
  709    HB3  LYS  84           HB3      LYS  84  -1.268  -4.310   0.226
  710    HG2  LYS  84           HG2      LYS  84  -4.206  -4.624  -0.333
  711    HG3  LYS  84           HG3      LYS  84  -3.273  -5.687   0.723
  712    HD2  LYS  84           HD2      LYS  84  -2.588  -3.535   1.947
  713    HD3  LYS  84           HD3      LYS  84  -3.929  -2.780   1.082
  714    HE2  LYS  84           HE2      LYS  84  -4.705  -3.475   3.244
  715    HE3  LYS  84           HE3      LYS  84  -5.438  -4.511   2.022
  716    HZ1  LYS  84           HZ1      LYS  84  -3.100  -5.209   3.719
  717    HZ2  LYS  84           HZ2      LYS  84  -3.771  -6.204   2.520
  718    HZ3  LYS  84           HZ3      LYS  84  -4.677  -5.805   3.895
  719    H    GLN  85           H        GLN  85  -0.636  -3.801  -3.097
  720    HA   GLN  85           HA       GLN  85   1.755  -2.562  -2.033
  721    HB2  GLN  85           HB2      GLN  85   2.025  -4.066  -4.514
  722    HB3  GLN  85           HB3      GLN  85   2.856  -4.283  -2.980
  723    HG2  GLN  85           HG2      GLN  85   0.847  -5.494  -2.147
  724    HG3  GLN  85           HG3      GLN  85   0.175  -5.391  -3.774
  725   HE21  GLN  85          HE21      GLN  85   2.521  -6.905  -1.735
  726   HE22  GLN  85          HE22      GLN  85   3.016  -8.115  -2.860
  727    H    ARG  86           H        ARG  86   3.025  -1.174  -3.297
  728    HA   ARG  86           HA       ARG  86   1.841  -0.254  -5.802
  729    HB2  ARG  86           HB2      ARG  86   2.679   2.116  -4.995
  730    HB3  ARG  86           HB3      ARG  86   1.077   1.517  -4.603
  731    HG2  ARG  86           HG2      ARG  86   1.763   2.349  -2.595
  732    HG3  ARG  86           HG3      ARG  86   2.231   0.657  -2.438
  733    HD2  ARG  86           HD2      ARG  86   4.468   1.120  -2.625
  734    HD3  ARG  86           HD3      ARG  86   4.195   2.598  -3.551
  735    HE   ARG  86           HE       ARG  86   3.475   2.457  -0.697
  736   HH11  ARG  86          HH11      ARG  86   5.360   3.858  -3.279
  737   HH12  ARG  86          HH12      ARG  86   5.751   5.301  -2.394
  738   HH21  ARG  86          HH21      ARG  86   3.970   4.312   0.489
  739   HH22  ARG  86          HH22      ARG  86   4.972   5.550  -0.220
  740    HA   PRO  87           HA       PRO  87   5.597  -0.819  -7.657
  741    HB2  PRO  87           HB2      PRO  87   5.948   1.333  -9.301
  742    HB3  PRO  87           HB3      PRO  87   4.774   0.047  -9.601
  743    HG2  PRO  87           HG2      PRO  87   4.353   2.752  -8.393
  744    HG3  PRO  87           HG3      PRO  87   3.356   1.885  -9.577
  745    HD2  PRO  87           HD2      PRO  87   2.706   1.986  -6.964
  746    HD3  PRO  87           HD3      PRO  87   2.370   0.556  -7.963
  747    H    LEU  88           H        LEU  88   7.329  -0.846  -6.406
  748    HA   LEU  88           HA       LEU  88   8.664   1.707  -5.829
  749    HB2  LEU  88           HB2      LEU  88   8.486  -0.798  -4.322
  750    HB3  LEU  88           HB3      LEU  88  10.099  -0.109  -4.417
  751    HG   LEU  88           HG       LEU  88   8.700   2.098  -3.775
  752   HD11  LEU  88          HD11      LEU  88   7.265  -0.157  -2.392
  753   HD12  LEU  88          HD12      LEU  88   7.084   1.562  -2.041
  754   HD13  LEU  88          HD13      LEU  88   6.579   0.923  -3.606
  755   HD21  LEU  88          HD21      LEU  88  10.710   1.279  -2.712
  756   HD22  LEU  88          HD22      LEU  88   9.511   1.759  -1.510
  757   HD23  LEU  88          HD23      LEU  88   9.777   0.050  -1.856
  758    H    LYS  89           H        LYS  89  10.421   2.191  -6.956
  759    HA   LYS  89           HA       LYS  89  11.606   0.117  -8.637
  760    HB2  LYS  89           HB2      LYS  89  11.734   3.116  -8.652
  761    HB3  LYS  89           HB3      LYS  89  12.992   2.185  -9.453
  762    HG2  LYS  89           HG2      LYS  89  11.369   2.787 -11.085
  763    HG3  LYS  89           HG3      LYS  89  11.218   1.056 -10.787
  764    HD2  LYS  89           HD2      LYS  89   9.011   1.910 -10.883
  765    HD3  LYS  89           HD3      LYS  89   9.356   1.624  -9.176
  766    HE2  LYS  89           HE2      LYS  89   8.245   3.752  -9.425
  767    HE3  LYS  89           HE3      LYS  89   9.916   4.015  -8.923
  768    HZ1  LYS  89           HZ1      LYS  89   8.925   4.215 -11.716
  769    HZ2  LYS  89           HZ2      LYS  89  10.504   4.542 -11.191
  770    HZ3  LYS  89           HZ3      LYS  89   9.224   5.531 -10.697
  771    H    ILE  90           H        ILE  90  13.416  -0.878  -8.062
  772    HA   ILE  90           HA       ILE  90  14.886   0.215  -5.752
  773    HB   ILE  90           HB       ILE  90  14.149  -2.692  -6.153
  774   HG12  ILE  90          HG12      ILE  90  12.182  -1.332  -5.538
  775   HG13  ILE  90          HG13      ILE  90  12.642  -2.440  -4.249
  776   HG21  ILE  90          HG21      ILE  90  15.578  -1.281  -3.909
  777   HG22  ILE  90          HG22      ILE  90  15.013  -2.951  -3.844
  778   HG23  ILE  90          HG23      ILE  90  16.245  -2.482  -5.016
  779   HD11  ILE  90          HD11      ILE  90  12.018  -0.271  -3.367
  780   HD12  ILE  90          HD12      ILE  90  13.723  -0.605  -3.060
  781   HD13  ILE  90          HD13      ILE  90  13.259   0.503  -4.352
  782    H    ARG  91           H        ARG  91  17.070   0.212  -6.022
  783    HA   ARG  91           HA       ARG  91  18.149  -1.369  -8.251
  784    HB2  ARG  91           HB2      ARG  91  18.484   1.148  -8.282
  785    HB3  ARG  91           HB3      ARG  91  19.480   0.949  -6.848
  786    HG2  ARG  91           HG2      ARG  91  21.028  -0.457  -8.081
  787    HG3  ARG  91           HG3      ARG  91  20.027  -0.305  -9.525
  788    HD2  ARG  91           HD2      ARG  91  21.345   1.994  -8.086
  789    HD3  ARG  91           HD3      ARG  91  21.985   1.213  -9.531
  790    HE   ARG  91           HE       ARG  91  19.793   1.932 -10.591
  791   HH11  ARG  91          HH11      ARG  91  21.424   3.736  -8.069
  792   HH12  ARG  91          HH12      ARG  91  20.663   5.249  -8.469
  793   HH21  ARG  91          HH21      ARG  91  18.844   3.941 -11.172
  794   HH22  ARG  91          HH22      ARG  91  19.220   5.371 -10.252
  795    H    MET  92           H        MET  92  19.283  -3.093  -7.729
  796    HA   MET  92           HA       MET  92  19.850  -3.686  -4.968
  797    HB2  MET  92           HB2      MET  92  19.714  -5.145  -7.529
  798    HB3  MET  92           HB3      MET  92  20.886  -5.768  -6.378
  799    HG2  MET  92           HG2      MET  92  18.508  -6.720  -6.397
  800    HG3  MET  92           HG3      MET  92  19.262  -6.359  -4.848
  801    HE1  MET  92           HE1      MET  92  15.911  -3.944  -6.866
  802    HE2  MET  92           HE2      MET  92  17.503  -4.160  -7.592
  803    HE3  MET  92           HE3      MET  92  16.440  -5.550  -7.373
  804    H    LEU  93           H        LEU  93  22.023  -4.968  -4.673
  805    HA   LEU  93           HA       LEU  93  23.956  -2.998  -4.399
  806    HB2  LEU  93           HB2      LEU  93  24.418  -5.984  -4.432
  807    HB3  LEU  93           HB3      LEU  93  25.506  -4.788  -3.766
  808    HG   LEU  93           HG       LEU  93  24.519  -5.639  -1.876
  809   HD11  LEU  93          HD11      LEU  93  24.286  -3.237  -1.833
  810   HD12  LEU  93          HD12      LEU  93  22.717  -3.352  -2.632
  811   HD13  LEU  93          HD13      LEU  93  22.926  -3.999  -1.006
  812   HD21  LEU  93          HD21      LEU  93  21.811  -5.666  -3.191
  813   HD22  LEU  93          HD22      LEU  93  22.895  -7.055  -3.099
  814   HD23  LEU  93          HD23      LEU  93  22.249  -6.339  -1.623
  815    H    ASP  94           H        ASP  94  23.696  -5.563  -6.821
  816    HA   ASP  94           HA       ASP  94  26.172  -5.021  -8.092
  817    HB2  ASP  94           HB2      ASP  94  25.030  -7.169  -8.354
  818    HB3  ASP  94           HB3      ASP  94  23.692  -6.375  -9.176
  819    H    GLY  95           H        GLY  95  23.246  -3.353  -8.059
  820    HA2  GLY  95           HA2      GLY  95  23.058  -1.176  -9.018
  821    HA3  GLY  95           HA3      GLY  95  24.133  -1.689 -10.316
  822    H    THR  96           H        THR  96  21.852  -4.021  -9.479
  823    HA   THR  96           HA       THR  96  20.506  -3.685 -12.016
  824    HB   THR  96           HB       THR  96  20.054  -5.792  -9.888
  825    HG1  THR  96           HG1      THR  96  21.914  -5.636 -12.039
  826   HG21  THR  96          HG21      THR  96  19.169  -7.122 -11.748
  827   HG22  THR  96          HG22      THR  96  19.440  -5.768 -12.847
  828   HG23  THR  96          HG23      THR  96  18.259  -5.626 -11.544
  829    H    VAL  97           H        VAL  97  18.536  -2.763 -12.253
  830    HA   VAL  97           HA       VAL  97  17.136  -2.088  -9.760
  831    HB   VAL  97           HB       VAL  97  17.816  -0.127 -11.045
  832   HG11  VAL  97          HG11      VAL  97  16.836   0.372 -13.220
  833   HG12  VAL  97          HG12      VAL  97  17.843  -1.075 -13.270
  834   HG13  VAL  97          HG13      VAL  97  16.086  -1.224 -13.246
  835   HG21  VAL  97          HG21      VAL  97  14.832  -0.560 -11.086
  836   HG22  VAL  97          HG22      VAL  97  15.786   0.029  -9.724
  837   HG23  VAL  97          HG23      VAL  97  15.645   1.003 -11.188
  838    H    LYS  98           H        LYS  98  15.095  -2.632  -9.436
  839    HA   LYS  98           HA       LYS  98  13.552  -3.827 -11.613
  840    HB2  LYS  98           HB2      LYS  98  12.919  -5.779 -10.436
  841    HB3  LYS  98           HB3      LYS  98  14.666  -5.685 -10.273
  842    HG2  LYS  98           HG2      LYS  98  14.524  -5.010  -8.022
  843    HG3  LYS  98           HG3      LYS  98  12.803  -4.646  -8.162
  844    HD2  LYS  98           HD2      LYS  98  13.969  -7.412  -8.446
  845    HD3  LYS  98           HD3      LYS  98  13.312  -6.774  -6.939
  846    HE2  LYS  98           HE2      LYS  98  11.497  -7.901  -7.775
  847    HE3  LYS  98           HE3      LYS  98  11.209  -6.279  -8.403
  848    HZ1  LYS  98           HZ1      LYS  98  10.847  -7.901 -10.123
  849    HZ2  LYS  98           HZ2      LYS  98  12.390  -8.567  -9.890
  850    HZ3  LYS  98           HZ3      LYS  98  12.229  -7.000 -10.511
  851    H    THR  99           H        THR  99  11.254  -3.827 -11.196
  852    HA   THR  99           HA       THR  99  10.487  -1.948  -9.066
  853    HB   THR  99           HB       THR  99   8.931  -2.734 -11.544
  854    HG1  THR  99           HG1      THR  99  10.789  -1.450 -12.023
  855   HG21  THR  99          HG21      THR  99   7.509  -2.060  -9.668
  856   HG22  THR  99          HG22      THR  99   7.479  -0.850 -10.952
  857   HG23  THR  99          HG23      THR  99   8.434  -0.568  -9.495
  858    H    ILE 100           H        ILE 100   9.631  -2.933  -7.305
  859    HA   ILE 100           HA       ILE 100   8.155  -5.432  -7.747
  860    HB   ILE 100           HB       ILE 100   9.951  -6.155  -6.454
  861   HG12  ILE 100          HG12      ILE 100   9.202  -6.300  -4.042
  862   HG13  ILE 100          HG13      ILE 100   7.849  -5.264  -4.475
  863   HG21  ILE 100          HG21      ILE 100  10.932  -4.907  -4.586
  864   HG22  ILE 100          HG22      ILE 100  11.045  -4.047  -6.125
  865   HG23  ILE 100          HG23      ILE 100   9.834  -3.570  -4.933
  866   HD11  ILE 100          HD11      ILE 100   8.423  -7.983  -5.617
  867   HD12  ILE 100          HD12      ILE 100   7.209  -7.594  -4.395
  868   HD13  ILE 100          HD13      ILE 100   7.052  -6.952  -6.031
  869    H    MET 101           H        MET 101   6.182  -5.589  -6.795
  870    HA   MET 101           HA       MET 101   5.033  -3.128  -5.782
  871    HB2  MET 101           HB2      MET 101   3.769  -5.848  -6.198
  872    HB3  MET 101           HB3      MET 101   2.911  -4.344  -5.888
  873    HG2  MET 101           HG2      MET 101   4.611  -4.887  -8.312
  874    HG3  MET 101           HG3      MET 101   2.855  -5.039  -8.250
  875    HE1  MET 101           HE1      MET 101   1.192  -2.952  -7.932
  876    HE2  MET 101           HE2      MET 101   2.027  -2.695  -6.399
  877    HE3  MET 101           HE3      MET 101   1.780  -1.344  -7.507
  878    H    VAL 102           H        VAL 102   5.354  -2.671  -3.766
  879    HA   VAL 102           HA       VAL 102   5.216  -4.825  -1.756
  880    HB   VAL 102           HB       VAL 102   6.341  -2.483  -0.600
  881   HG11  VAL 102          HG11      VAL 102   8.236  -3.984  -0.206
  882   HG12  VAL 102          HG12      VAL 102   6.693  -4.755   0.160
  883   HG13  VAL 102          HG13      VAL 102   7.541  -5.146  -1.336
  884   HG21  VAL 102          HG21      VAL 102   6.971  -1.752  -2.822
  885   HG22  VAL 102          HG22      VAL 102   8.401  -2.281  -1.936
  886   HG23  VAL 102          HG23      VAL 102   7.688  -3.327  -3.165
  887    H    ASP 103           H        ASP 103   3.861  -4.692  -0.106
  888    HA   ASP 103           HA       ASP 103   1.516  -3.186  -0.387
  889    HB2  ASP 103           HB2      ASP 103   1.529  -5.337   0.715
  890    HB3  ASP 103           HB3      ASP 103   2.620  -4.741   1.958
  891    H    ASP 104           H        ASP 104   1.042  -1.162   0.167
  892    HA   ASP 104           HA       ASP 104   3.017   0.446   1.508
  893    HB2  ASP 104           HB2      ASP 104   1.655   1.322  -0.373
  894    HB3  ASP 104           HB3      ASP 104   0.217   1.200   0.636
  895    H    SER 105           H        SER 105   0.560  -1.563   2.557
  896    HA   SER 105           HA       SER 105  -0.210  -0.018   4.880
  897    HB2  SER 105           HB2      SER 105  -0.623  -2.978   4.556
  898    HB3  SER 105           HB3      SER 105  -1.627  -1.818   5.422
  899    HG   SER 105           HG       SER 105  -1.341  -2.181   2.628
  900    H    LYS 106           H        LYS 106   2.617  -1.511   4.139
  901    HA   LYS 106           HA       LYS 106   3.139  -2.231   6.943
  902    HB2  LYS 106           HB2      LYS 106   4.586  -4.064   6.165
  903    HB3  LYS 106           HB3      LYS 106   2.920  -4.276   5.645
  904    HG2  LYS 106           HG2      LYS 106   4.018  -4.810   3.723
  905    HG3  LYS 106           HG3      LYS 106   3.791  -3.079   3.473
  906    HD2  LYS 106           HD2      LYS 106   6.082  -2.846   4.622
  907    HD3  LYS 106           HD3      LYS 106   6.264  -4.567   4.270
  908    HE2  LYS 106           HE2      LYS 106   7.265  -3.521   2.454
  909    HE3  LYS 106           HE3      LYS 106   5.650  -3.917   1.863
  910    HZ1  LYS 106           HZ1      LYS 106   4.947  -1.684   2.241
  911    HZ2  LYS 106           HZ2      LYS 106   6.367  -1.637   1.322
  912    HZ3  LYS 106           HZ3      LYS 106   6.417  -1.278   2.974
  913    H    THR 107           H        THR 107   5.533  -2.306   7.433
  914    HA   THR 107           HA       THR 107   6.590   0.278   6.667
  915    HB   THR 107           HB       THR 107   8.256  -0.261   8.516
  916    HG1  THR 107           HG1      THR 107   7.120  -2.018   9.906
  917   HG21  THR 107          HG21      THR 107   6.278   1.140   8.871
  918   HG22  THR 107          HG22      THR 107   6.619   0.144  10.287
  919   HG23  THR 107          HG23      THR 107   5.316  -0.303   9.188
  920    H    VAL 108           H        VAL 108   9.366  -0.263   7.216
  921    HA   VAL 108           HA       VAL 108  10.126  -0.820   4.533
  922    HB   VAL 108           HB       VAL 108  11.992  -0.456   6.863
  923   HG11  VAL 108          HG11      VAL 108  12.247   0.163   3.926
  924   HG12  VAL 108          HG12      VAL 108  13.454   0.533   5.157
  925   HG13  VAL 108          HG13      VAL 108  13.048  -1.146   4.797
  926   HG21  VAL 108          HG21      VAL 108  10.333   1.324   6.940
  927   HG22  VAL 108          HG22      VAL 108  11.898   1.952   6.424
  928   HG23  VAL 108          HG23      VAL 108  10.620   1.683   5.237
  929    H    THR 109           H        THR 109  10.768  -2.451   7.617
  930    HA   THR 109           HA       THR 109  12.455  -4.453   6.898
  931    HB   THR 109           HB       THR 109  10.072  -4.755   8.728
  932    HG1  THR 109           HG1      THR 109  12.611  -4.320   9.763
  933   HG21  THR 109          HG21      THR 109  12.668  -6.303   8.610
  934   HG22  THR 109          HG22      THR 109  11.073  -6.920   8.177
  935   HG23  THR 109          HG23      THR 109  11.423  -6.477   9.848
  936    H    ASP 110           H        ASP 110   8.890  -4.855   6.799
  937    HA   ASP 110           HA       ASP 110   8.903  -7.356   5.540
  938    HB2  ASP 110           HB2      ASP 110   6.935  -6.382   6.670
  939    HB3  ASP 110           HB3      ASP 110   6.804  -5.175   5.398
  940    H    MET 111           H        MET 111   9.021  -4.111   4.229
  941    HA   MET 111           HA       MET 111   8.594  -4.657   1.501
  942    HB2  MET 111           HB2      MET 111   8.678  -2.385   2.493
  943    HB3  MET 111           HB3      MET 111  10.404  -2.575   2.754
  944    HG2  MET 111           HG2      MET 111  10.564  -2.918   0.227
  945    HG3  MET 111           HG3      MET 111   8.920  -2.282   0.169
  946    HE1  MET 111           HE1      MET 111   8.395   0.122   1.669
  947    HE2  MET 111           HE2      MET 111   9.478  -0.459   2.935
  948    HE3  MET 111           HE3      MET 111   9.730   1.136   2.228
  949    H    LEU 112           H        LEU 112  11.596  -4.424   3.366
  950    HA   LEU 112           HA       LEU 112  13.323  -5.094   1.243
  951    HB2  LEU 112           HB2      LEU 112  13.630  -4.222   3.809
  952    HB3  LEU 112           HB3      LEU 112  14.162  -5.888   3.946
  953    HG   LEU 112           HG       LEU 112  15.794  -5.490   2.124
  954   HD11  LEU 112          HD11      LEU 112  14.632  -3.684   0.987
  955   HD12  LEU 112          HD12      LEU 112  14.860  -2.637   2.390
  956   HD13  LEU 112          HD13      LEU 112  16.257  -3.179   1.455
  957   HD21  LEU 112          HD21      LEU 112  15.947  -3.649   4.501
  958   HD22  LEU 112          HD22      LEU 112  16.520  -5.314   4.412
  959   HD23  LEU 112          HD23      LEU 112  17.302  -4.059   3.451
  960    H    MET 113           H        MET 113  11.765  -6.989   3.767
  961    HA   MET 113           HA       MET 113  12.772  -9.528   3.266
  962    HB2  MET 113           HB2      MET 113  11.267  -8.965   5.135
  963    HB3  MET 113           HB3      MET 113   9.945  -8.726   4.002
  964    HG2  MET 113           HG2      MET 113  10.248 -11.144   3.335
  965    HG3  MET 113           HG3      MET 113  11.313 -11.297   4.731
  966    HE1  MET 113           HE1      MET 113  10.463 -10.656   7.257
  967    HE2  MET 113           HE2      MET 113   9.766  -9.148   6.668
  968    HE3  MET 113           HE3      MET 113   8.785 -10.256   7.626
  969    H    THR 114           H        THR 114  10.121  -7.803   1.762
  970    HA   THR 114           HA       THR 114   9.345  -9.788  -0.073
  971    HB   THR 114           HB       THR 114   9.035  -6.789  -0.078
  972    HG1  THR 114           HG1      THR 114   7.844  -7.713   1.548
  973   HG21  THR 114          HG21      THR 114   7.255  -7.145  -1.777
  974   HG22  THR 114          HG22      THR 114   7.780  -8.823  -1.929
  975   HG23  THR 114          HG23      THR 114   8.872  -7.510  -2.379
  976    H    ILE 115           H        ILE 115  11.604  -7.030  -0.355
  977    HA   ILE 115           HA       ILE 115  11.922  -7.267  -3.163
  978    HB   ILE 115           HB       ILE 115  13.710  -5.905  -1.144
  979   HG12  ILE 115          HG12      ILE 115  11.589  -4.732  -2.954
  980   HG13  ILE 115          HG13      ILE 115  11.343  -5.094  -1.248
  981   HG21  ILE 115          HG21      ILE 115  13.589  -5.637  -4.146
  982   HG22  ILE 115          HG22      ILE 115  14.550  -4.623  -3.070
  983   HG23  ILE 115          HG23      ILE 115  14.905  -6.345  -3.210
  984   HD11  ILE 115          HD11      ILE 115  13.329  -3.131  -2.370
  985   HD12  ILE 115          HD12      ILE 115  11.797  -2.738  -1.589
  986   HD13  ILE 115          HD13      ILE 115  13.092  -3.494  -0.660
  987    H    CYS 116           H        CYS 116  13.922  -8.350  -0.419
  988    HA   CYS 116           HA       CYS 116  16.071  -9.254  -2.015
  989    HB2  CYS 116           HB2      CYS 116  16.789 -10.507  -0.010
  990    HB3  CYS 116           HB3      CYS 116  16.412  -8.824   0.346
  991    HG   CYS 116           HG       CYS 116  15.020 -11.622   1.553
  992    H    ALA 117           H        ALA 117  13.034 -10.671  -1.133
  993    HA   ALA 117           HA       ALA 117  13.737 -13.361  -1.800
  994    HB1  ALA 117           HB1      ALA 117  11.913 -12.847  -0.241
  995    HB2  ALA 117           HB2      ALA 117  11.013 -12.084  -1.553
  996    HB3  ALA 117           HB3      ALA 117  11.353 -13.815  -1.605
  997    H    ARG 118           H        ARG 118  12.484 -10.582  -3.522
  998    HA   ARG 118           HA       ARG 118  11.561 -11.990  -5.817
  999    HB2  ARG 118           HB2      ARG 118  12.558  -9.137  -5.881
 1000    HB3  ARG 118           HB3      ARG 118  11.315  -9.885  -6.875
 1001    HG2  ARG 118           HG2      ARG 118  11.113  -9.192  -3.956
 1002    HG3  ARG 118           HG3      ARG 118  10.297  -8.388  -5.294
 1003    HD2  ARG 118           HD2      ARG 118   9.888 -11.277  -4.547
 1004    HD3  ARG 118           HD3      ARG 118   8.872  -9.956  -3.981
 1005    HE   ARG 118           HE       ARG 118   9.131 -10.149  -6.858
 1006   HH11  ARG 118          HH11      ARG 118   7.282 -11.061  -4.011
 1007   HH12  ARG 118          HH12      ARG 118   5.830 -11.393  -4.909
 1008   HH21  ARG 118          HH21      ARG 118   7.226 -10.599  -8.031
 1009   HH22  ARG 118          HH22      ARG 118   5.810 -11.170  -7.202
 1010    H    ILE 119           H        ILE 119  14.615 -10.475  -4.909
 1011    HA   ILE 119           HA       ILE 119  15.924 -10.952  -7.394
 1012    HB   ILE 119           HB       ILE 119  17.435 -10.766  -4.814
 1013   HG12  ILE 119          HG12      ILE 119  15.651  -9.093  -4.611
 1014   HG13  ILE 119          HG13      ILE 119  17.225  -8.332  -4.804
 1015   HG21  ILE 119          HG21      ILE 119  17.877  -9.602  -7.558
 1016   HG22  ILE 119          HG22      ILE 119  18.973  -9.438  -6.185
 1017   HG23  ILE 119          HG23      ILE 119  18.672 -11.028  -6.889
 1018   HD11  ILE 119          HD11      ILE 119  15.541  -7.178  -6.090
 1019   HD12  ILE 119          HD12      ILE 119  16.725  -7.928  -7.160
 1020   HD13  ILE 119          HD13      ILE 119  15.140  -8.669  -6.941
 1021    H    GLY 120           H        GLY 120  15.903 -12.565  -4.247
 1022    HA2  GLY 120           HA2      GLY 120  16.132 -15.006  -4.167
 1023    HA3  GLY 120           HA3      GLY 120  17.295 -14.854  -5.480
 1024    H    ILE 121           H        ILE 121  17.189 -12.585  -2.875
 1025    HA   ILE 121           HA       ILE 121  19.934 -13.196  -2.181
 1026    HB   ILE 121           HB       ILE 121  18.052 -11.060  -1.154
 1027   HG12  ILE 121          HG12      ILE 121  20.364 -10.875  -3.098
 1028   HG13  ILE 121          HG13      ILE 121  18.660 -10.820  -3.537
 1029   HG21  ILE 121          HG21      ILE 121  20.034 -10.013  -0.187
 1030   HG22  ILE 121          HG22      ILE 121  19.740 -11.611   0.497
 1031   HG23  ILE 121          HG23      ILE 121  21.012 -11.387  -0.704
 1032   HD11  ILE 121          HD11      ILE 121  19.635  -8.597  -3.505
 1033   HD12  ILE 121          HD12      ILE 121  18.398  -8.755  -2.259
 1034   HD13  ILE 121          HD13      ILE 121  20.104  -8.811  -1.818
 1035    H    THR 122           H        THR 122  16.753 -13.176  -0.638
 1036    HA   THR 122           HA       THR 122  15.922 -14.141   1.244
 1037    HB   THR 122           HB       THR 122  18.282 -16.011   1.287
 1038    HG1  THR 122           HG1      THR 122  17.793 -16.573  -0.692
 1039   HG21  THR 122          HG21      THR 122  15.329 -16.398   1.809
 1040   HG22  THR 122          HG22      THR 122  16.580 -16.240   3.043
 1041   HG23  THR 122          HG23      THR 122  16.578 -17.636   1.966
 1042    H    ASN 123           H        ASN 123  17.785 -11.938   1.448
 1043    HA   ASN 123           HA       ASN 123  18.396 -12.097   4.275
 1044    HB2  ASN 123           HB2      ASN 123  20.464 -12.959   3.307
 1045    HB3  ASN 123           HB3      ASN 123  20.548 -11.592   2.207
 1046   HD21  ASN 123          HD21      ASN 123  22.619 -11.178   3.009
 1047   HD22  ASN 123          HD22      ASN 123  22.858 -10.379   4.523
 1048    H    HIS 124           H        HIS 124  17.702 -10.264   5.137
 1049    HA   HIS 124           HA       HIS 124  17.896  -7.796   3.590
 1050    HB2  HIS 124           HB2      HIS 124  15.560  -7.239   3.832
 1051    HB3  HIS 124           HB3      HIS 124  15.713  -8.778   2.996
 1052    HD1  HIS 124           HD1      HIS 124  14.363  -7.210   6.077
 1053    HD2  HIS 124           HD2      HIS 124  14.829 -11.032   4.495
 1054    HE1  HIS 124           HE1      HIS 124  12.844  -8.689   7.416
 1055    HE2  HIS 124           HE2      HIS 124  13.297 -11.030   6.586
 1056    H    ASP 125           H        ASP 125  18.735  -9.151   6.300
 1057    HA   ASP 125           HA       ASP 125  17.581  -7.278   8.186
 1058    HB2  ASP 125           HB2      ASP 125  17.956  -9.598   8.893
 1059    HB3  ASP 125           HB3      ASP 125  19.683  -9.425   8.586
 1060    H    GLU 126           H        GLU 126  20.594  -7.854   6.508
 1061    HA   GLU 126           HA       GLU 126  21.992  -5.812   8.003
 1062    HB2  GLU 126           HB2      GLU 126  23.905  -6.408   6.466
 1063    HB3  GLU 126           HB3      GLU 126  23.329  -7.693   7.518
 1064    HG2  GLU 126           HG2      GLU 126  22.301  -8.831   5.767
 1065    HG3  GLU 126           HG3      GLU 126  22.350  -7.435   4.697
 1066    H    TYR 127           H        TYR 127  19.794  -5.569   5.686
 1067    HA   TYR 127           HA       TYR 127  21.235  -3.464   4.224
 1068    HB2  TYR 127           HB2      TYR 127  18.764  -4.990   3.394
 1069    HB3  TYR 127           HB3      TYR 127  19.548  -3.728   2.453
 1070    HD1  TYR 127           HD1      TYR 127  21.984  -4.159   1.737
 1071    HD2  TYR 127           HD2      TYR 127  19.383  -7.196   3.135
 1072    HE1  TYR 127           HE1      TYR 127  23.389  -5.851   0.653
 1073    HE2  TYR 127           HE2      TYR 127  20.764  -8.904   2.057
 1074    HH   TYR 127           HH       TYR 127  23.855  -8.368   1.031
 1075    H    SER 128           H        SER 128  20.321  -1.449   3.988
 1076    HA   SER 128           HA       SER 128  17.761  -0.988   5.358
 1077    HB2  SER 128           HB2      SER 128  20.091   0.936   5.093
 1078    HB3  SER 128           HB3      SER 128  18.557   1.273   5.896
 1079    HG   SER 128           HG       SER 128  19.168   0.143   7.584
 1080    H    LEU 129           H        LEU 129  16.454   0.718   4.371
 1081    HA   LEU 129           HA       LEU 129  16.779   0.646   1.465
 1082    HB2  LEU 129           HB2      LEU 129  14.605   0.101   2.891
 1083    HB3  LEU 129           HB3      LEU 129  14.398   1.839   2.830
 1084    HG   LEU 129           HG       LEU 129  13.090   0.697   1.096
 1085   HD11  LEU 129          HD11      LEU 129  13.914   2.960   0.658
 1086   HD12  LEU 129          HD12      LEU 129  15.363   2.279  -0.085
 1087   HD13  LEU 129          HD13      LEU 129  13.781   2.005  -0.820
 1088   HD21  LEU 129          HD21      LEU 129  15.758  -0.225   0.040
 1089   HD22  LEU 129          HD22      LEU 129  14.515  -1.244   0.764
 1090   HD23  LEU 129          HD23      LEU 129  14.203  -0.427  -0.767
 1091    H    VAL 130           H        VAL 130  17.188   2.477   0.298
 1092    HA   VAL 130           HA       VAL 130  17.142   5.023   1.751
 1093    HB   VAL 130           HB       VAL 130  19.417   4.799   1.796
 1094   HG11  VAL 130          HG11      VAL 130  19.227   3.254  -0.767
 1095   HG12  VAL 130          HG12      VAL 130  20.741   3.665   0.039
 1096   HG13  VAL 130          HG13      VAL 130  19.567   2.628   0.845
 1097   HG21  VAL 130          HG21      VAL 130  19.021   5.839  -1.007
 1098   HG22  VAL 130          HG22      VAL 130  18.989   6.798   0.473
 1099   HG23  VAL 130          HG23      VAL 130  20.485   6.018  -0.039
 1100    H    ARG 131           H        ARG 131  15.822   6.359   0.802
 1101    HA   ARG 131           HA       ARG 131  15.046   5.840  -1.979
 1102    HB2  ARG 131           HB2      ARG 131  13.742   7.646   0.058
 1103    HB3  ARG 131           HB3      ARG 131  13.075   7.151  -1.488
 1104    HG2  ARG 131           HG2      ARG 131  12.960   4.839  -0.679
 1105    HG3  ARG 131           HG3      ARG 131  13.577   5.377   0.887
 1106    HD2  ARG 131           HD2      ARG 131  11.146   5.200   0.938
 1107    HD3  ARG 131           HD3      ARG 131  11.669   6.880   1.123
 1108    HE   ARG 131           HE       ARG 131  10.995   7.286  -1.143
 1109   HH11  ARG 131          HH11      ARG 131   9.931   4.242   0.200
 1110   HH12  ARG 131          HH12      ARG 131   8.681   4.014  -0.973
 1111   HH21  ARG 131          HH21      ARG 131   9.347   7.024  -2.688
 1112   HH22  ARG 131          HH22      ARG 131   8.338   5.608  -2.619
 1113    H    GLU 132           H        GLU 132  16.599   6.934  -3.184
 1114    HA   GLU 132           HA       GLU 132  17.085   9.709  -2.693
 1115    HB2  GLU 132           HB2      GLU 132  17.676   7.944  -5.080
 1116    HB3  GLU 132           HB3      GLU 132  18.085   9.650  -5.033
 1117    HG2  GLU 132           HG2      GLU 132  19.307   8.993  -2.819
 1118    HG3  GLU 132           HG3      GLU 132  19.255   7.374  -3.518
 1119    H    LEU 133           H        LEU 133  15.461  11.115  -2.872
 1120    HA   LEU 133           HA       LEU 133  13.425  10.556  -4.914
 1121    HB2  LEU 133           HB2      LEU 133  13.033  12.316  -2.515
 1122    HB3  LEU 133           HB3      LEU 133  11.812  11.634  -3.564
 1123    HG   LEU 133           HG       LEU 133  13.499  10.136  -1.567
 1124   HD11  LEU 133          HD11      LEU 133  11.686  11.429  -0.583
 1125   HD12  LEU 133          HD12      LEU 133  10.539  10.704  -1.710
 1126   HD13  LEU 133          HD13      LEU 133  11.336   9.704  -0.495
 1127   HD21  LEU 133          HD21      LEU 133  11.387   9.066  -3.433
 1128   HD22  LEU 133          HD22      LEU 133  13.124   8.827  -3.622
 1129   HD23  LEU 133          HD23      LEU 133  12.289   8.151  -2.225
 1130    H    MET 134           H        MET 134  12.088  12.643  -5.232
 1131    HA   MET 134           HA       MET 134  13.866  14.715  -6.305
 1132    HB2  MET 134           HB2      MET 134  11.795  15.398  -7.552
 1133    HB3  MET 134           HB3      MET 134  12.332  13.762  -7.918
 1134    HG2  MET 134           HG2      MET 134  10.036  13.529  -7.679
 1135    HG3  MET 134           HG3      MET 134  10.670  13.020  -6.115
 1136    HE1  MET 134           HE1      MET 134   8.445  13.276  -4.803
 1137    HE2  MET 134           HE2      MET 134   7.365  14.663  -4.949
 1138    HE3  MET 134           HE3      MET 134   7.646  13.614  -6.339
 1139    H    GLU 135           H        GLU 135  12.583  14.093  -3.544
 1140    HA   GLU 135           HA       GLU 135  10.577  15.760  -2.811
 1141    HB2  GLU 135           HB2      GLU 135  12.628  14.229  -1.486
 1142    HB3  GLU 135           HB3      GLU 135  12.285  15.710  -0.601
 1143    HG2  GLU 135           HG2      GLU 135  10.151  13.809  -1.512
 1144    HG3  GLU 135           HG3      GLU 135  10.934  13.714   0.067
 1145    H    GLU 136           H        GLU 136  10.370  17.838  -3.158
 1146    HA   GLU 136           HA       GLU 136  12.504  19.708  -3.162
 1147    HB2  GLU 136           HB2      GLU 136  10.686  21.383  -3.289
 1148    HB3  GLU 136           HB3      GLU 136  10.495  20.083  -4.458
 1149    HG2  GLU 136           HG2      GLU 136   8.805  19.041  -3.113
 1150    HG3  GLU 136           HG3      GLU 136   9.056  20.215  -1.822
 1151    H    LYS 137           H        LYS 137  10.554  18.299  -0.725
 1152    HA   LYS 137           HA       LYS 137  10.899  20.439   1.192
 1153    HB2  LYS 137           HB2      LYS 137  10.006  17.668   1.920
 1154    HB3  LYS 137           HB3      LYS 137   9.530  19.203   2.628
 1155    HG2  LYS 137           HG2      LYS 137   8.243  19.719   0.597
 1156    HG3  LYS 137           HG3      LYS 137   8.688  18.144  -0.063
 1157    HD2  LYS 137           HD2      LYS 137   7.662  17.163   2.066
 1158    HD3  LYS 137           HD3      LYS 137   6.949  18.758   2.311
 1159    HE2  LYS 137           HE2      LYS 137   5.290  17.553   1.188
 1160    HE3  LYS 137           HE3      LYS 137   6.050  18.524  -0.072
 1161    HZ1  LYS 137           HZ1      LYS 137   7.481  16.468  -0.488
 1162    HZ2  LYS 137           HZ2      LYS 137   5.861  16.404  -0.989
 1163    HZ3  LYS 137           HZ3      LYS 137   6.332  15.625   0.436
 1164    H    LYS 138           H        LYS 138  11.696  16.978   1.288
 1165    HA   LYS 138           HA       LYS 138  13.771  17.300   3.201
 1166    HB2  LYS 138           HB2      LYS 138  13.312  14.974   1.338
 1167    HB3  LYS 138           HB3      LYS 138  14.164  14.951   2.878
 1168    HG2  LYS 138           HG2      LYS 138  12.148  15.332   4.079
 1169    HG3  LYS 138           HG3      LYS 138  11.253  15.614   2.587
 1170    HD2  LYS 138           HD2      LYS 138  11.711  13.291   1.908
 1171    HD3  LYS 138           HD3      LYS 138  12.507  13.026   3.467
 1172    HE2  LYS 138           HE2      LYS 138  10.332  12.256   3.809
 1173    HE3  LYS 138           HE3      LYS 138  10.360  13.886   4.494
 1174    HZ1  LYS 138           HZ1      LYS 138   8.410  13.856   3.290
 1175    HZ2  LYS 138           HZ2      LYS 138   9.074  12.972   2.011
 1176    HZ3  LYS 138           HZ3      LYS 138   9.488  14.603   2.211
 1177    H    ASP 169           H        ASP 169  13.875  16.406  -0.250
 1178    HA   ASP 169           HA       ASP 169  15.619  15.853  -1.589
 1179    HB2  ASP 169           HB2      ASP 169  15.759  18.344  -1.681
 1180    HB3  ASP 169           HB3      ASP 169  16.921  18.297  -0.357
 1181    H    GLU 170           H        GLU 170  15.702  14.066   0.076
 1182    HA   GLU 170           HA       GLU 170  18.422  13.971   1.184
 1183    HB2  GLU 170           HB2      GLU 170  15.900  12.783   2.345
 1184    HB3  GLU 170           HB3      GLU 170  17.518  12.451   2.938
 1185    HG2  GLU 170           HG2      GLU 170  17.787  14.818   3.499
 1186    HG3  GLU 170           HG3      GLU 170  16.139  15.123   2.940
 1187    H    LEU 171           H        LEU 171  19.166  11.733   1.564
 1188    HA   LEU 171           HA       LEU 171  18.664   9.980  -0.665
 1189    HB2  LEU 171           HB2      LEU 171  20.146   9.336   1.884
 1190    HB3  LEU 171           HB3      LEU 171  20.284   8.520   0.340
 1191    HG   LEU 171           HG       LEU 171  21.247  11.284   1.017
 1192   HD11  LEU 171          HD11      LEU 171  22.709   8.764   0.241
 1193   HD12  LEU 171          HD12      LEU 171  23.451  10.339   0.518
 1194   HD13  LEU 171          HD13      LEU 171  22.666   9.487   1.848
 1195   HD21  LEU 171          HD21      LEU 171  20.343  11.262  -1.232
 1196   HD22  LEU 171          HD22      LEU 171  22.107  11.337  -1.285
 1197   HD23  LEU 171          HD23      LEU 171  21.279   9.813  -1.611
 1198    H    ASN 172           H        ASN 172  17.362  10.565   2.395
 1199    HA   ASN 172           HA       ASN 172  15.850   9.540   3.727
 1200    HB2  ASN 172           HB2      ASN 172  14.928   8.536   1.036
 1201    HB3  ASN 172           HB3      ASN 172  13.999   8.370   2.510
 1202   HD21  ASN 172          HD21      ASN 172  14.817  10.326  -0.080
 1203   HD22  ASN 172          HD22      ASN 172  13.974  11.761   0.408
 1204    H    TRP 173           H        TRP 173  17.487   8.202   4.753
 1205    HA   TRP 173           HA       TRP 173  17.753   5.493   3.729
 1206    HB2  TRP 173           HB2      TRP 173  19.231   7.198   5.679
 1207    HB3  TRP 173           HB3      TRP 173  19.247   5.456   5.950
 1208    HD1  TRP 173           HD1      TRP 173  20.259   8.055   3.277
 1209    HE1  TRP 173           HE1      TRP 173  22.201   7.075   1.911
 1210    HE3  TRP 173           HE3      TRP 173  20.407   3.375   5.325
 1211    HZ2  TRP 173           HZ2      TRP 173  23.616   4.640   1.725
 1212    HZ3  TRP 173           HZ3      TRP 173  22.090   1.781   4.498
 1213    HH2  TRP 173           HH2      TRP 173  23.658   2.403   2.736
 1214    H    LEU 174           H        LEU 174  15.807   4.578   4.152
 1215    HA   LEU 174           HA       LEU 174  14.237   4.989   6.456
 1216    HB2  LEU 174           HB2      LEU 174  14.268   2.543   4.695
 1217    HB3  LEU 174           HB3      LEU 174  12.968   3.061   5.746
 1218    HG   LEU 174           HG       LEU 174  13.854   4.310   3.157
 1219   HD11  LEU 174          HD11      LEU 174  12.445   2.506   2.739
 1220   HD12  LEU 174          HD12      LEU 174  11.438   2.846   4.150
 1221   HD13  LEU 174          HD13      LEU 174  11.360   3.897   2.730
 1222   HD21  LEU 174          HD21      LEU 174  13.384   6.128   4.705
 1223   HD22  LEU 174          HD22      LEU 174  12.086   5.990   3.517
 1224   HD23  LEU 174          HD23      LEU 174  11.855   5.376   5.155
 1225    H    ASP 175           H        ASP 175  14.430   4.215   8.431
 1226    HA   ASP 175           HA       ASP 175  16.649   2.394   8.920
 1227    HB2  ASP 175           HB2      ASP 175  16.416   4.709  10.021
 1228    HB3  ASP 175           HB3      ASP 175  15.197   3.946  11.038
 1229    H    HIS 176           H        HIS 176  13.832   1.710   8.109
 1230    HA   HIS 176           HA       HIS 176  12.372  -0.002   8.438
 1231    HB2  HIS 176           HB2      HIS 176  14.574  -1.014  10.251
 1232    HB3  HIS 176           HB3      HIS 176  13.151  -1.950   9.804
 1233    HD1  HIS 176           HD1      HIS 176  12.970  -2.654   7.273
 1234    HD2  HIS 176           HD2      HIS 176  16.599  -1.001   8.404
 1235    HE1  HIS 176           HE1      HIS 176  14.542  -3.155   5.386
 1236    HE2  HIS 176           HE2      HIS 176  16.807  -2.466   6.281
 1237    H    GLY 177           H        GLY 177  11.698   2.213   9.758
 1238    HA2  GLY 177           HA2      GLY 177  10.502   1.120  12.206
 1239    HA3  GLY 177           HA3      GLY 177  11.495   2.560  12.365
 1240    H    ARG 178           H        ARG 178  10.606   3.574   9.730
 1241    HA   ARG 178           HA       ARG 178   8.050   4.651  10.706
 1242    HB2  ARG 178           HB2      ARG 178   9.819   6.281  10.317
 1243    HB3  ARG 178           HB3      ARG 178   9.989   5.728   8.657
 1244    HG2  ARG 178           HG2      ARG 178   7.776   6.509   8.125
 1245    HG3  ARG 178           HG3      ARG 178   7.503   6.975   9.805
 1246    HD2  ARG 178           HD2      ARG 178   9.561   8.135   7.932
 1247    HD3  ARG 178           HD3      ARG 178   8.075   8.914   8.468
 1248    HE   ARG 178           HE       ARG 178  10.255   8.188  10.314
 1249   HH11  ARG 178          HH11      ARG 178   7.862  10.459   9.114
 1250   HH12  ARG 178          HH12      ARG 178   8.201  11.648  10.337
 1251   HH21  ARG 178          HH21      ARG 178  10.683   9.765  11.934
 1252   HH22  ARG 178          HH22      ARG 178   9.791  11.260  11.920
 1253    H    THR 179           H        THR 179   6.206   4.639   9.491
 1254    HA   THR 179           HA       THR 179   6.092   2.786   7.291
 1255    HB   THR 179           HB       THR 179   4.254   2.816   8.859
 1256    HG1  THR 179           HG1      THR 179   3.014   2.305   7.244
 1257   HG21  THR 179          HG21      THR 179   3.730   5.632   7.932
 1258   HG22  THR 179          HG22      THR 179   4.329   5.163   9.524
 1259   HG23  THR 179          HG23      THR 179   2.704   4.695   9.019
 1260    H    LEU 180           H        LEU 180   4.953   3.419   5.263
 1261    HA   LEU 180           HA       LEU 180   6.854   5.088   4.029
 1262    HB2  LEU 180           HB2      LEU 180   4.356   3.947   2.802
 1263    HB3  LEU 180           HB3      LEU 180   5.846   4.387   1.981
 1264    HG   LEU 180           HG       LEU 180   5.530   2.149   3.981
 1265   HD11  LEU 180          HD11      LEU 180   5.814   2.154   0.994
 1266   HD12  LEU 180          HD12      LEU 180   6.100   0.733   2.002
 1267   HD13  LEU 180          HD13      LEU 180   4.505   1.484   1.971
 1268   HD21  LEU 180          HD21      LEU 180   7.826   1.564   3.411
 1269   HD22  LEU 180          HD22      LEU 180   7.940   2.994   2.383
 1270   HD23  LEU 180          HD23      LEU 180   7.730   3.176   4.124
 1271    H    ARG 181           H        ARG 181   3.307   5.486   4.306
 1272    HA   ARG 181           HA       ARG 181   3.178   7.990   3.047
 1273    HB2  ARG 181           HB2      ARG 181   1.456   6.533   4.992
 1274    HB3  ARG 181           HB3      ARG 181   1.130   8.233   4.692
 1275    HG2  ARG 181           HG2      ARG 181   0.561   7.863   2.473
 1276    HG3  ARG 181           HG3      ARG 181   1.374   6.293   2.428
 1277    HD2  ARG 181           HD2      ARG 181  -0.936   6.807   4.261
 1278    HD3  ARG 181           HD3      ARG 181  -1.196   6.329   2.575
 1279    HE   ARG 181           HE       ARG 181  -0.018   4.269   3.030
 1280   HH11  ARG 181          HH11      ARG 181  -0.978   6.142   5.853
 1281   HH12  ARG 181          HH12      ARG 181  -0.816   4.798   6.947
 1282   HH21  ARG 181          HH21      ARG 181   0.245   2.537   4.470
 1283   HH22  ARG 181          HH22      ARG 181  -0.115   2.743   6.161
 1284    H    GLU 182           H        GLU 182   3.963   7.080   6.315
 1285    HA   GLU 182           HA       GLU 182   3.738   9.707   7.424
 1286    HB2  GLU 182           HB2      GLU 182   3.372   7.869   8.875
 1287    HB3  GLU 182           HB3      GLU 182   4.860   7.082   8.385
 1288    HG2  GLU 182           HG2      GLU 182   6.172   8.609   9.606
 1289    HG3  GLU 182           HG3      GLU 182   4.791   9.667   9.912
 1290    H    GLN 183           H        GLN 183   6.063   8.091   5.557
 1291    HA   GLN 183           HA       GLN 183   8.331   9.670   6.402
 1292    HB2  GLN 183           HB2      GLN 183   8.006   8.056   3.868
 1293    HB3  GLN 183           HB3      GLN 183   9.512   8.629   4.576
 1294    HG2  GLN 183           HG2      GLN 183   9.356   7.116   6.369
 1295    HG3  GLN 183           HG3      GLN 183   7.673   6.744   6.008
 1296   HE21  GLN 183          HE21      GLN 183   9.748   4.866   6.348
 1297   HE22  GLN 183          HE22      GLN 183   9.933   4.027   4.853
 1298    H    GLY 184           H        GLY 184   5.594  10.127   4.463
 1299    HA2  GLY 184           HA2      GLY 184   4.968  11.798   3.013
 1300    HA3  GLY 184           HA3      GLY 184   6.375  12.697   3.565
 1301    H    VAL 185           H        VAL 185   6.449   9.517   2.089
 1302    HA   VAL 185           HA       VAL 185   8.122  10.587  -0.041
 1303    HB   VAL 185           HB       VAL 185   8.669   8.258  -0.553
 1304   HG11  VAL 185          HG11      VAL 185   9.854   7.724   1.521
 1305   HG12  VAL 185          HG12      VAL 185   9.984   9.438   1.120
 1306   HG13  VAL 185          HG13      VAL 185   8.873   8.910   2.385
 1307   HG21  VAL 185          HG21      VAL 185   6.534   7.221  -0.005
 1308   HG22  VAL 185          HG22      VAL 185   7.846   6.438   0.875
 1309   HG23  VAL 185          HG23      VAL 185   6.784   7.575   1.705
 1310    H    GLU 186           H        GLU 186   7.820   9.136  -2.145
 1311    HA   GLU 186           HA       GLU 186   5.017   9.491  -2.959
 1312    HB2  GLU 186           HB2      GLU 186   6.215   9.780  -5.287
 1313    HB3  GLU 186           HB3      GLU 186   6.152  11.118  -4.158
 1314    HG2  GLU 186           HG2      GLU 186   8.359  10.701  -5.298
 1315    HG3  GLU 186           HG3      GLU 186   8.398  10.848  -3.540
 1316    H    GLU 187           H        GLU 187   5.150   8.243  -5.450
 1317    HA   GLU 187           HA       GLU 187   5.914   5.468  -4.796
 1318    HB2  GLU 187           HB2      GLU 187   3.557   6.395  -6.444
 1319    HB3  GLU 187           HB3      GLU 187   3.957   4.732  -6.050
 1320    HG2  GLU 187           HG2      GLU 187   3.406   5.056  -3.765
 1321    HG3  GLU 187           HG3      GLU 187   3.275   6.802  -3.982
 1322    H    HIS 188           H        HIS 188   7.586   7.405  -6.333
 1323    HA   HIS 188           HA       HIS 188   7.568   5.998  -8.892
 1324    HB2  HIS 188           HB2      HIS 188   7.477   8.042 -10.235
 1325    HB3  HIS 188           HB3      HIS 188   6.013   7.798  -9.292
 1326    HD1  HIS 188           HD1      HIS 188   5.375   9.605  -7.627
 1327    HD2  HIS 188           HD2      HIS 188   9.108  10.208  -9.350
 1328    HE1  HIS 188           HE1      HIS 188   6.042  11.945  -7.006
 1329    HE2  HIS 188           HE2      HIS 188   8.148  12.374  -8.315
 1330    H    GLU 189           H        GLU 189   9.405   7.667  -6.529
 1331    HA   GLU 189           HA       GLU 189  11.590   8.299  -8.321
 1332    HB2  GLU 189           HB2      GLU 189  11.215   8.547  -5.349
 1333    HB3  GLU 189           HB3      GLU 189  12.761   8.869  -6.124
 1334    HG2  GLU 189           HG2      GLU 189  10.164  10.282  -6.681
 1335    HG3  GLU 189           HG3      GLU 189  11.531  10.920  -5.764
 1336    H    THR 190           H        THR 190  13.829   7.580  -7.772
 1337    HA   THR 190           HA       THR 190  13.927   4.735  -7.772
 1338    HB   THR 190           HB       THR 190  16.325   6.531  -7.506
 1339    HG1  THR 190           HG1      THR 190  15.290   7.497  -9.177
 1340   HG21  THR 190          HG21      THR 190  15.830   3.942  -8.988
 1341   HG22  THR 190          HG22      THR 190  16.704   4.111  -7.465
 1342   HG23  THR 190          HG23      THR 190  17.356   4.823  -8.940
 1343    H    LEU 191           H        LEU 191  14.076   3.435  -6.091
 1344    HA   LEU 191           HA       LEU 191  15.177   4.507  -3.574
 1345    HB2  LEU 191           HB2      LEU 191  13.478   2.020  -3.826
 1346    HB3  LEU 191           HB3      LEU 191  13.920   2.865  -2.361
 1347    HG   LEU 191           HG       LEU 191  11.731   3.482  -2.551
 1348   HD11  LEU 191          HD11      LEU 191  13.088   5.565  -4.239
 1349   HD12  LEU 191          HD12      LEU 191  11.539   5.750  -3.415
 1350   HD13  LEU 191          HD13      LEU 191  13.016   5.526  -2.478
 1351   HD21  LEU 191          HD21      LEU 191  10.544   3.904  -4.643
 1352   HD22  LEU 191          HD22      LEU 191  12.027   3.588  -5.544
 1353   HD23  LEU 191          HD23      LEU 191  11.270   2.298  -4.610
 1354    H    LEU 192           H        LEU 192  16.955   3.422  -2.686
 1355    HA   LEU 192           HA       LEU 192  18.087   1.380  -4.480
 1356    HB2  LEU 192           HB2      LEU 192  19.695   3.046  -2.578
 1357    HB3  LEU 192           HB3      LEU 192  20.215   2.241  -4.043
 1358    HG   LEU 192           HG       LEU 192  18.421   4.666  -3.988
 1359   HD11  LEU 192          HD11      LEU 192  20.386   5.909  -4.720
 1360   HD12  LEU 192          HD12      LEU 192  20.625   5.205  -3.121
 1361   HD13  LEU 192          HD13      LEU 192  21.374   4.458  -4.532
 1362   HD21  LEU 192          HD21      LEU 192  18.149   3.261  -5.967
 1363   HD22  LEU 192          HD22      LEU 192  18.927   4.794  -6.364
 1364   HD23  LEU 192          HD23      LEU 192  19.890   3.320  -6.249
 1365    H    LEU 193           H        LEU 193  18.651  -0.570  -3.621
 1366    HA   LEU 193           HA       LEU 193  18.314  -0.976  -0.774
 1367    HB2  LEU 193           HB2      LEU 193  17.492  -2.606  -2.488
 1368    HB3  LEU 193           HB3      LEU 193  19.155  -2.923  -2.935
 1369    HG   LEU 193           HG       LEU 193  18.269  -3.377  -0.104
 1370   HD11  LEU 193          HD11      LEU 193  16.630  -4.527  -1.509
 1371   HD12  LEU 193          HD12      LEU 193  17.942  -5.308  -2.393
 1372   HD13  LEU 193          HD13      LEU 193  17.691  -5.670  -0.687
 1373   HD21  LEU 193          HD21      LEU 193  20.012  -5.069  -0.172
 1374   HD22  LEU 193          HD22      LEU 193  20.297  -4.730  -1.880
 1375   HD23  LEU 193          HD23      LEU 193  20.657  -3.503  -0.666
 1376    H    ARG 194           H        ARG 194  19.930  -0.716   0.601
 1377    HA   ARG 194           HA       ARG 194  22.699  -1.050  -0.348
 1378    HB2  ARG 194           HB2      ARG 194  21.673   1.133   1.474
 1379    HB3  ARG 194           HB3      ARG 194  23.369   0.818   1.150
 1380    HG2  ARG 194           HG2      ARG 194  21.349   1.588  -0.940
 1381    HG3  ARG 194           HG3      ARG 194  22.433   2.713  -0.125
 1382    HD2  ARG 194           HD2      ARG 194  23.268   0.369  -1.822
 1383    HD3  ARG 194           HD3      ARG 194  23.278   2.064  -2.316
 1384    HE   ARG 194           HE       ARG 194  24.817   1.713   0.047
 1385   HH11  ARG 194          HH11      ARG 194  24.886   1.042  -3.399
 1386   HH12  ARG 194          HH12      ARG 194  26.618   1.193  -3.520
 1387   HH21  ARG 194          HH21      ARG 194  27.079   1.899  -0.110
 1388   HH22  ARG 194          HH22      ARG 194  27.867   1.673  -1.644
 1389    H    ARG 195           H        ARG 195  24.135  -1.938   1.172
 1390    HA   ARG 195           HA       ARG 195  22.819  -3.156   3.465
 1391    HB2  ARG 195           HB2      ARG 195  24.791  -4.520   3.714
 1392    HB3  ARG 195           HB3      ARG 195  24.239  -4.586   2.049
 1393    HG2  ARG 195           HG2      ARG 195  25.986  -2.893   1.488
 1394    HG3  ARG 195           HG3      ARG 195  26.597  -3.068   3.135
 1395    HD2  ARG 195           HD2      ARG 195  26.462  -5.167   0.981
 1396    HD3  ARG 195           HD3      ARG 195  27.903  -4.485   1.734
 1397    HE   ARG 195           HE       ARG 195  26.040  -5.933   3.459
 1398   HH11  ARG 195          HH11      ARG 195  29.098  -5.891   1.751
 1399   HH12  ARG 195          HH12      ARG 195  29.697  -7.302   2.560
 1400   HH21  ARG 195          HH21      ARG 195  26.790  -7.772   4.479
 1401   HH22  ARG 195          HH22      ARG 195  28.384  -8.389   4.121
 1402    H    LYS 196           H        LYS 196  23.092  -2.513   5.491
 1403    HA   LYS 196           HA       LYS 196  24.532  -0.034   5.894
 1404    HB2  LYS 196           HB2      LYS 196  22.352  -0.133   6.881
 1405    HB3  LYS 196           HB3      LYS 196  22.706  -1.668   7.663
 1406    HG2  LYS 196           HG2      LYS 196  24.392  -0.526   9.062
 1407    HG3  LYS 196           HG3      LYS 196  23.920   1.005   8.327
 1408    HD2  LYS 196           HD2      LYS 196  21.976  -0.798   9.750
 1409    HD3  LYS 196           HD3      LYS 196  22.879   0.474  10.571
 1410    HE2  LYS 196           HE2      LYS 196  21.015   0.878   8.234
 1411    HE3  LYS 196           HE3      LYS 196  20.619   1.195   9.924
 1412    HZ1  LYS 196           HZ1      LYS 196  22.597   2.750   9.894
 1413    HZ2  LYS 196           HZ2      LYS 196  21.225   3.252   9.034
 1414    HZ3  LYS 196           HZ3      LYS 196  22.562   2.619   8.201
 1415    H    PHE 197           H        PHE 197  24.582  -3.354   7.158
 1416    HA   PHE 197           HA       PHE 197  26.954  -2.708   8.733
 1417    HB2  PHE 197           HB2      PHE 197  25.657  -5.413   8.665
 1418    HB3  PHE 197           HB3      PHE 197  26.598  -4.674   9.952
 1419    HD1  PHE 197           HD1      PHE 197  25.580  -2.727  11.174
 1420    HD2  PHE 197           HD2      PHE 197  23.310  -5.322   8.696
 1421    HE1  PHE 197           HE1      PHE 197  23.532  -1.986  12.315
 1422    HE2  PHE 197           HE2      PHE 197  21.244  -4.595   9.822
 1423    HZ   PHE 197           HZ       PHE 197  21.278  -3.057  11.579
 1424    H    PHE 198           H        PHE 198  28.880  -3.748   8.507
 1425    HA   PHE 198           HA       PHE 198  29.142  -5.711   6.333
 1426    HB2  PHE 198           HB2      PHE 198  31.144  -3.553   7.068
 1427    HB3  PHE 198           HB3      PHE 198  31.446  -4.862   5.934
 1428    HD1  PHE 198           HD1      PHE 198  29.438  -1.825   6.516
 1429    HD2  PHE 198           HD2      PHE 198  30.737  -4.728   3.689
 1430    HE1  PHE 198           HE1      PHE 198  28.540  -0.443   4.690
 1431    HE2  PHE 198           HE2      PHE 198  29.844  -3.350   1.859
 1432    HZ   PHE 198           HZ       PHE 198  28.776  -1.200   2.347
 1433    H    TYR 199           H        TYR 199  28.668  -7.095   8.200
 1434    HA   TYR 199           HA       TYR 199  30.504  -7.119  10.408
 1435    HB2  TYR 199           HB2      TYR 199  29.139  -9.086  11.161
 1436    HB3  TYR 199           HB3      TYR 199  28.237  -7.599  10.921
 1437    HD1  TYR 199           HD1      TYR 199  28.830 -11.001   9.676
 1438    HD2  TYR 199           HD2      TYR 199  26.552  -7.433   9.158
 1439    HE1  TYR 199           HE1      TYR 199  27.293 -12.198   8.186
 1440    HE2  TYR 199           HE2      TYR 199  25.018  -8.631   7.664
 1441    HH   TYR 199           HH       TYR 199  24.971 -12.022   7.395
 1442    H    SER 200           H        SER 200  31.577  -7.728   7.737
 1443    HA   SER 200           HA       SER 200  33.060  -9.109   6.737
 1444    HB2  SER 200           HB2      SER 200  33.419 -10.113   9.568
 1445    HB3  SER 200           HB3      SER 200  34.514 -10.454   8.228
 1446    HG   SER 200           HG       SER 200  35.445  -8.688   8.951
 1447    H    ASP 201           H        ASP 201  30.424  -9.866   6.554
 1448    HA   ASP 201           HA       ASP 201  29.952 -12.599   7.076
 1449    HB2  ASP 201           HB2      ASP 201  28.123 -12.391   5.504
 1450    HB3  ASP 201           HB3      ASP 201  28.193 -10.926   6.473
 1451    H    GLN 202           H        GLN 202  31.803 -10.892   4.787
 1452    HA   GLN 202           HA       GLN 202  32.179 -13.241   3.071
 1453    HB2  GLN 202           HB2      GLN 202  33.015 -10.367   2.626
 1454    HB3  GLN 202           HB3      GLN 202  33.127 -11.678   1.459
 1455    HG2  GLN 202           HG2      GLN 202  30.859 -11.706   1.067
 1456    HG3  GLN 202           HG3      GLN 202  30.476 -10.939   2.609
 1457   HE21  GLN 202          HE21      GLN 202  32.507  -8.899   2.318
 1458   HE22  GLN 202          HE22      GLN 202  31.923  -7.779   1.127
  Start of MODEL    9
    1    H1   GLY  -5           H1       GLY  -5 -30.735 -11.866  -4.347
    2    H2   GLY  -5           H2       GLY  -5 -31.936 -11.920  -5.546
    3    H3   GLY  -5           H3       GLY  -5 -32.230 -11.108  -4.085
    4    HA2  GLY  -5           HA2      GLY  -5 -30.263 -10.324  -6.160
    5    HA3  GLY  -5           HA3      GLY  -5 -31.796  -9.526  -5.833
    6    H    ILE  -4           H        ILE  -4 -30.729  -7.557  -5.396
    7    HA   ILE  -4           HA       ILE  -4 -28.970  -7.562  -3.053
    8    HB   ILE  -4           HB       ILE  -4 -28.029  -6.429  -4.957
    9   HG12  ILE  -4          HG12      ILE  -4 -27.717  -4.123  -4.001
   10   HG13  ILE  -4          HG13      ILE  -4 -28.934  -4.526  -2.795
   11   HG21  ILE  -4          HG21      ILE  -4 -30.040  -5.880  -6.177
   12   HG22  ILE  -4          HG22      ILE  -4 -30.482  -4.685  -4.958
   13   HG23  ILE  -4          HG23      ILE  -4 -29.048  -4.439  -5.954
   14   HD11  ILE  -4          HD11      ILE  -4 -26.309  -5.942  -3.195
   15   HD12  ILE  -4          HD12      ILE  -4 -26.693  -4.797  -1.910
   16   HD13  ILE  -4          HD13      ILE  -4 -27.529  -6.348  -1.987
   17    H    ASP  -3           H        ASP  -3 -29.911  -7.286  -1.173
   18    HA   ASP  -3           HA       ASP  -3 -32.401  -5.723  -1.034
   19    HB2  ASP  -3           HB2      ASP  -3 -31.246  -7.826   0.800
   20    HB3  ASP  -3           HB3      ASP  -3 -32.623  -6.825   1.246
   21    HA   PRO  -2           HA       PRO  -2 -29.979  -2.542   0.878
   22    HB2  PRO  -2           HB2      PRO  -2 -32.036  -0.863   1.441
   23    HB3  PRO  -2           HB3      PRO  -2 -31.364  -1.051  -0.182
   24    HG2  PRO  -2           HG2      PRO  -2 -33.836  -2.244   0.999
   25    HG3  PRO  -2           HG3      PRO  -2 -33.575  -1.584  -0.626
   26    HD2  PRO  -2           HD2      PRO  -2 -33.571  -4.252  -0.068
   27    HD3  PRO  -2           HD3      PRO  -2 -32.644  -3.534  -1.400
   28    H    PHE  -1           H        PHE  -1 -29.201  -2.588   2.857
   29    HA   PHE  -1           HA       PHE  -1 -30.651  -3.670   5.090
   30    HB2  PHE  -1           HB2      PHE  -1 -28.110  -3.814   4.525
   31    HB3  PHE  -1           HB3      PHE  -1 -28.025  -2.228   5.282
   32    HD1  PHE  -1           HD1      PHE  -1 -29.281  -5.662   5.910
   33    HD2  PHE  -1           HD2      PHE  -1 -27.680  -2.088   7.553
   34    HE1  PHE  -1           HE1      PHE  -1 -29.121  -6.755   8.111
   35    HE2  PHE  -1           HE2      PHE  -1 -27.513  -3.168   9.760
   36    HZ   PHE  -1           HZ       PHE  -1 -28.237  -5.506  10.041
   37    H    THR   0           H        THR   0 -32.273  -1.842   4.508
   38    HA   THR   0           HA       THR   0 -33.270   0.157   4.884
   39    HB   THR   0           HB       THR   0 -33.285   0.921   7.247
   40    HG1  THR   0           HG1      THR   0 -31.056  -0.714   7.345
   41   HG21  THR   0          HG21      THR   0 -33.587  -2.057   6.865
   42   HG22  THR   0          HG22      THR   0 -34.811  -0.834   6.522
   43   HG23  THR   0          HG23      THR   0 -34.285  -1.114   8.182
   44    H    MET   1           H        MET   1 -32.206   2.197   6.871
   45    HA   MET   1           HA       MET   1 -30.324   3.379   4.989
   46    HB2  MET   1           HB2      MET   1 -32.369   4.635   5.849
   47    HB3  MET   1           HB3      MET   1 -31.531   4.743   7.389
   48    HG2  MET   1           HG2      MET   1 -31.236   6.791   6.183
   49    HG3  MET   1           HG3      MET   1 -29.692   5.949   6.276
   50    HE1  MET   1           HE1      MET   1 -28.794   5.104   2.684
   51    HE2  MET   1           HE2      MET   1 -28.200   5.542   4.285
   52    HE3  MET   1           HE3      MET   1 -29.155   4.076   4.069
   53    H    VAL   2           H        VAL   2 -29.384   1.274   6.426
   54    HA   VAL   2           HA       VAL   2 -27.160   2.576   7.775
   55    HB   VAL   2           HB       VAL   2 -26.997   0.589   9.354
   56   HG11  VAL   2          HG11      VAL   2 -29.339   2.459   9.678
   57   HG12  VAL   2          HG12      VAL   2 -28.560   1.550  10.974
   58   HG13  VAL   2          HG13      VAL   2 -27.665   2.802  10.111
   59   HG21  VAL   2          HG21      VAL   2 -29.024  -0.631   9.877
   60   HG22  VAL   2          HG22      VAL   2 -29.904   0.245   8.625
   61   HG23  VAL   2          HG23      VAL   2 -28.608  -0.865   8.177
   62    H    ALA   3           H        ALA   3 -27.109   2.038   5.267
   63    HA   ALA   3           HA       ALA   3 -25.063  -0.024   5.105
   64    HB1  ALA   3           HB1      ALA   3 -27.310   0.202   3.101
   65    HB2  ALA   3           HB2      ALA   3 -25.890  -0.831   2.951
   66    HB3  ALA   3           HB3      ALA   3 -27.066  -1.131   4.232
   67    H    LEU   4           H        LEU   4 -23.707   1.715   5.171
   68    HA   LEU   4           HA       LEU   4 -23.651   4.057   3.951
   69    HB2  LEU   4           HB2      LEU   4 -21.229   2.290   3.949
   70    HB3  LEU   4           HB3      LEU   4 -21.290   4.034   4.109
   71    HG   LEU   4           HG       LEU   4 -22.144   1.996   6.158
   72   HD11  LEU   4          HD11      LEU   4 -20.370   2.969   7.486
   73   HD12  LEU   4          HD12      LEU   4 -19.746   2.344   5.960
   74   HD13  LEU   4          HD13      LEU   4 -19.979   4.080   6.174
   75   HD21  LEU   4          HD21      LEU   4 -23.698   3.868   6.197
   76   HD22  LEU   4          HD22      LEU   4 -22.648   3.893   7.614
   77   HD23  LEU   4          HD23      LEU   4 -22.348   5.001   6.275
   78    H    SER   5           H        SER   5 -23.299   4.957   2.097
   79    HA   SER   5           HA       SER   5 -23.034   3.266  -0.291
   80    HB2  SER   5           HB2      SER   5 -23.922   6.160  -0.105
   81    HB3  SER   5           HB3      SER   5 -23.884   5.182  -1.564
   82    HG   SER   5           HG       SER   5 -25.534   4.852   0.716
   83    H    LEU   6           H        LEU   6 -20.949   3.032  -0.801
   84    HA   LEU   6           HA       LEU   6 -19.128   5.252  -0.151
   85    HB2  LEU   6           HB2      LEU   6 -18.431   2.326  -0.404
   86    HB3  LEU   6           HB3      LEU   6 -17.410   3.613   0.221
   87    HG   LEU   6           HG       LEU   6 -19.919   2.551   1.530
   88   HD11  LEU   6          HD11      LEU   6 -18.412   1.691   3.239
   89   HD12  LEU   6          HD12      LEU   6 -18.049   0.993   1.662
   90   HD13  LEU   6          HD13      LEU   6 -17.023   2.270   2.317
   91   HD21  LEU   6          HD21      LEU   6 -19.646   4.916   1.965
   92   HD22  LEU   6          HD22      LEU   6 -19.285   3.979   3.415
   93   HD23  LEU   6          HD23      LEU   6 -17.970   4.656   2.453
   94    H    LYS   7           H        LYS   7 -17.887   6.084  -1.721
   95    HA   LYS   7           HA       LYS   7 -18.206   5.132  -4.425
   96    HB2  LYS   7           HB2      LYS   7 -16.861   7.459  -3.145
   97    HB3  LYS   7           HB3      LYS   7 -16.278   6.942  -4.721
   98    HG2  LYS   7           HG2      LYS   7 -18.732   7.058  -5.446
   99    HG3  LYS   7           HG3      LYS   7 -18.970   7.998  -3.969
  100    HD2  LYS   7           HD2      LYS   7 -17.393   9.645  -4.680
  101    HD3  LYS   7           HD3      LYS   7 -16.897   8.653  -6.054
  102    HE2  LYS   7           HE2      LYS   7 -18.356  10.383  -6.844
  103    HE3  LYS   7           HE3      LYS   7 -19.195   8.834  -6.946
  104    HZ1  LYS   7           HZ1      LYS   7 -19.530  10.808  -4.749
  105    HZ2  LYS   7           HZ2      LYS   7 -20.386   9.359  -4.930
  106    HZ3  LYS   7           HZ3      LYS   7 -20.605  10.612  -6.046
  107    H    ILE   8           H        ILE   8 -17.186   3.327  -4.966
  108    HA   ILE   8           HA       ILE   8 -14.576   2.761  -3.798
  109    HB   ILE   8           HB       ILE   8 -16.200   1.039  -5.676
  110   HG12  ILE   8          HG12      ILE   8 -17.460   1.418  -3.615
  111   HG13  ILE   8          HG13      ILE   8 -16.854  -0.234  -3.660
  112   HG21  ILE   8          HG21      ILE   8 -14.749  -0.758  -4.840
  113   HG22  ILE   8          HG22      ILE   8 -13.836   0.515  -5.650
  114   HG23  ILE   8          HG23      ILE   8 -13.852   0.425  -3.890
  115   HD11  ILE   8          HD11      ILE   8 -15.048   0.398  -2.140
  116   HD12  ILE   8          HD12      ILE   8 -15.675   2.045  -2.089
  117   HD13  ILE   8          HD13      ILE   8 -16.637   0.716  -1.445
  118    H    SER   9           H        SER   9 -13.062   3.932  -4.814
  119    HA   SER   9           HA       SER   9 -13.141   4.103  -7.731
  120    HB2  SER   9           HB2      SER   9 -11.331   5.523  -5.768
  121    HB3  SER   9           HB3      SER   9 -11.376   5.800  -7.502
  122    HG   SER   9           HG       SER   9 -12.829   7.234  -7.017
  123    H    ILE  10           H        ILE  10 -11.806   2.967  -8.977
  124    HA   ILE  10           HA       ILE  10  -9.610   1.486  -7.687
  125    HB   ILE  10           HB       ILE  10 -11.403   0.422  -9.884
  126   HG12  ILE  10          HG12      ILE  10 -11.269  -0.402  -6.974
  127   HG13  ILE  10          HG13      ILE  10 -12.531   0.612  -7.665
  128   HG21  ILE  10          HG21      ILE  10 -10.243  -1.704  -9.477
  129   HG22  ILE  10          HG22      ILE  10  -9.131  -0.439 -10.002
  130   HG23  ILE  10          HG23      ILE  10  -9.202  -0.901  -8.301
  131   HD11  ILE  10          HD11      ILE  10 -13.270  -1.686  -7.415
  132   HD12  ILE  10          HD12      ILE  10 -13.211  -1.224  -9.116
  133   HD13  ILE  10          HD13      ILE  10 -11.939  -2.236  -8.433
  134    H    GLY  11           H        GLY  11  -8.029   2.877  -8.391
  135    HA2  GLY  11           HA2      GLY  11  -6.465   3.694  -9.871
  136    HA3  GLY  11           HA3      GLY  11  -7.205   2.700 -11.120
  137    H    ASN  12           H        ASN  12  -8.579   3.613 -12.561
  138    HA   ASN  12           HA       ASN  12  -8.965   6.515 -12.312
  139    HB2  ASN  12           HB2      ASN  12  -9.360   6.445 -14.792
  140    HB3  ASN  12           HB3      ASN  12  -7.739   5.971 -14.298
  141   HD21  ASN  12          HD21      ASN  12 -10.737   4.929 -15.703
  142   HD22  ASN  12          HD22      ASN  12 -10.177   3.365 -16.208
  143    H    VAL  13           H        VAL  13 -10.646   3.539 -12.307
  144    HA   VAL  13           HA       VAL  13 -13.176   4.780 -13.080
  145    HB   VAL  13           HB       VAL  13 -12.522   2.488 -13.919
  146   HG11  VAL  13          HG11      VAL  13 -13.111   1.672 -11.081
  147   HG12  VAL  13          HG12      VAL  13 -12.868   0.575 -12.439
  148   HG13  VAL  13          HG13      VAL  13 -11.543   1.599 -11.886
  149   HG21  VAL  13          HG21      VAL  13 -15.107   2.691 -12.379
  150   HG22  VAL  13          HG22      VAL  13 -14.825   3.241 -14.031
  151   HG23  VAL  13          HG23      VAL  13 -14.761   1.520 -13.653
  152    H    VAL  14           H        VAL  14 -15.067   4.544 -11.682
  153    HA   VAL  14           HA       VAL  14 -14.571   3.888  -8.899
  154    HB   VAL  14           HB       VAL  14 -14.101   6.189  -8.695
  155   HG11  VAL  14          HG11      VAL  14 -16.541   6.760 -10.362
  156   HG12  VAL  14          HG12      VAL  14 -15.513   7.968  -9.587
  157   HG13  VAL  14          HG13      VAL  14 -14.859   6.940 -10.862
  158   HG21  VAL  14          HG21      VAL  14 -16.997   5.741  -7.984
  159   HG22  VAL  14          HG22      VAL  14 -15.590   5.460  -6.959
  160   HG23  VAL  14          HG23      VAL  14 -16.032   7.106  -7.420
  161    H    LYS  15           H        LYS  15 -16.200   2.853  -8.036
  162    HA   LYS  15           HA       LYS  15 -18.790   2.856  -9.438
  163    HB2  LYS  15           HB2      LYS  15 -17.220   0.538  -8.319
  164    HB3  LYS  15           HB3      LYS  15 -18.947   0.432  -8.626
  165    HG2  LYS  15           HG2      LYS  15 -16.845   1.057 -10.691
  166    HG3  LYS  15           HG3      LYS  15 -17.627  -0.508 -10.457
  167    HD2  LYS  15           HD2      LYS  15 -19.807   0.534 -10.935
  168    HD3  LYS  15           HD3      LYS  15 -18.995   2.073 -11.218
  169    HE2  LYS  15           HE2      LYS  15 -19.448   1.027 -13.334
  170    HE3  LYS  15           HE3      LYS  15 -17.708   1.009 -13.047
  171    HZ1  LYS  15           HZ1      LYS  15 -18.834  -1.104 -13.920
  172    HZ2  LYS  15           HZ2      LYS  15 -19.368  -1.325 -12.323
  173    HZ3  LYS  15           HZ3      LYS  15 -17.706  -1.257 -12.664
  174    H    THR  16           H        THR  16 -20.635   2.561  -8.108
  175    HA   THR  16           HA       THR  16 -20.140   3.515  -5.375
  176    HB   THR  16           HB       THR  16 -22.791   3.383  -6.830
  177    HG1  THR  16           HG1      THR  16 -21.220   4.777  -7.868
  178   HG21  THR  16          HG21      THR  16 -22.964   3.531  -4.394
  179   HG22  THR  16          HG22      THR  16 -23.484   5.036  -5.150
  180   HG23  THR  16          HG23      THR  16 -21.893   4.932  -4.394
  181    H    MET  17           H        MET  17 -20.337   2.158  -3.715
  182    HA   MET  17           HA       MET  17 -21.892  -0.312  -4.076
  183    HB2  MET  17           HB2      MET  17 -19.042   0.004  -3.206
  184    HB3  MET  17           HB3      MET  17 -20.006  -1.296  -2.526
  185    HG2  MET  17           HG2      MET  17 -19.745  -0.900  -5.481
  186    HG3  MET  17           HG3      MET  17 -18.562  -1.816  -4.551
  187    HE1  MET  17           HE1      MET  17 -20.692  -4.786  -3.161
  188    HE2  MET  17           HE2      MET  17 -19.084  -4.075  -3.282
  189    HE3  MET  17           HE3      MET  17 -20.337  -3.259  -2.351
  190    H    GLN  18           H        GLN  18 -22.971  -1.002  -2.263
  191    HA   GLN  18           HA       GLN  18 -22.725   0.739   0.087
  192    HB2  GLN  18           HB2      GLN  18 -25.081  -0.479  -1.255
  193    HB3  GLN  18           HB3      GLN  18 -25.125  -0.327   0.498
  194    HG2  GLN  18           HG2      GLN  18 -25.072   1.963   0.448
  195    HG3  GLN  18           HG3      GLN  18 -24.333   2.016  -1.153
  196   HE21  GLN  18          HE21      GLN  18 -25.606   1.855  -2.960
  197   HE22  GLN  18          HE22      GLN  18 -27.325   2.016  -2.914
  198    H    PHE  19           H        PHE  19 -22.423  -0.146   2.068
  199    HA   PHE  19           HA       PHE  19 -22.299  -3.061   2.267
  200    HB2  PHE  19           HB2      PHE  19 -20.162  -1.195   3.337
  201    HB3  PHE  19           HB3      PHE  19 -20.166  -2.949   3.423
  202    HD1  PHE  19           HD1      PHE  19 -19.686  -4.287   1.430
  203    HD2  PHE  19           HD2      PHE  19 -19.446  -0.043   1.374
  204    HE1  PHE  19           HE1      PHE  19 -18.418  -4.392  -0.675
  205    HE2  PHE  19           HE2      PHE  19 -18.183  -0.138  -0.735
  206    HZ   PHE  19           HZ       PHE  19 -17.554  -2.305  -1.692
  207    H    GLU  20           H        GLU  20 -22.525  -3.750   4.497
  208    HA   GLU  20           HA       GLU  20 -24.137  -1.989   6.078
  209    HB2  GLU  20           HB2      GLU  20 -22.852  -4.624   6.837
  210    HB3  GLU  20           HB3      GLU  20 -24.028  -3.751   7.807
  211    HG2  GLU  20           HG2      GLU  20 -25.367  -5.297   6.804
  212    HG3  GLU  20           HG3      GLU  20 -25.510  -3.959   5.666
  213    HA   PRO  21           HA       PRO  21 -21.167   0.297   8.311
  214    HB2  PRO  21           HB2      PRO  21 -22.411  -0.427  10.877
  215    HB3  PRO  21           HB3      PRO  21 -22.239   1.157  10.122
  216    HG2  PRO  21           HG2      PRO  21 -24.598  -0.192  10.296
  217    HG3  PRO  21           HG3      PRO  21 -24.245   0.991   9.022
  218    HD2  PRO  21           HD2      PRO  21 -24.380  -1.954   8.885
  219    HD3  PRO  21           HD3      PRO  21 -24.613  -0.743   7.613
  220    H    SER  22           H        SER  22 -21.948  -2.888   9.573
  221    HA   SER  22           HA       SER  22 -19.310  -3.083  10.827
  222    HB2  SER  22           HB2      SER  22 -20.378  -5.152  11.899
  223    HB3  SER  22           HB3      SER  22 -21.011  -3.580  12.393
  224    HG   SER  22           HG       SER  22 -22.142  -5.368  10.482
  225    H    THR  23           H        THR  23 -20.224  -3.540   7.877
  226    HA   THR  23           HA       THR  23 -20.089  -6.207   7.183
  227    HB   THR  23           HB       THR  23 -19.381  -3.691   5.728
  228    HG1  THR  23           HG1      THR  23 -21.399  -5.665   5.673
  229   HG21  THR  23          HG21      THR  23 -19.121  -6.466   4.567
  230   HG22  THR  23          HG22      THR  23 -17.794  -5.342   4.862
  231   HG23  THR  23          HG23      THR  23 -19.030  -4.954   3.664
  232    H    MET  24           H        MET  24 -17.429  -3.981   7.768
  233    HA   MET  24           HA       MET  24 -15.222  -4.352   8.241
  234    HB2  MET  24           HB2      MET  24 -16.267  -7.006   8.523
  235    HB3  MET  24           HB3      MET  24 -14.743  -7.071   7.661
  236    HG2  MET  24           HG2      MET  24 -14.072  -7.291   9.816
  237    HG3  MET  24           HG3      MET  24 -13.884  -5.556   9.561
  238    HE1  MET  24           HE1      MET  24 -15.085  -5.936  13.327
  239    HE2  MET  24           HE2      MET  24 -14.105  -7.100  12.432
  240    HE3  MET  24           HE3      MET  24 -13.782  -5.372  12.282
  241    H    VAL  25           H        VAL  25 -13.381  -4.404   7.102
  242    HA   VAL  25           HA       VAL  25 -13.206  -4.198   4.400
  243    HB   VAL  25           HB       VAL  25 -11.144  -5.315   6.295
  244   HG11  VAL  25          HG11      VAL  25 -10.588  -6.006   4.021
  245   HG12  VAL  25          HG12      VAL  25 -10.770  -4.343   3.461
  246   HG13  VAL  25          HG13      VAL  25  -9.476  -4.759   4.585
  247   HG21  VAL  25          HG21      VAL  25 -10.239  -3.045   6.182
  248   HG22  VAL  25          HG22      VAL  25 -11.570  -2.573   5.124
  249   HG23  VAL  25          HG23      VAL  25 -11.896  -3.060   6.789
  250    H    TYR  26           H        TYR  26 -13.005  -7.230   6.273
  251    HA   TYR  26           HA       TYR  26 -12.133  -8.733   4.061
  252    HB2  TYR  26           HB2      TYR  26 -12.362 -10.716   5.363
  253    HB3  TYR  26           HB3      TYR  26 -11.699  -9.445   6.372
  254    HD1  TYR  26           HD1      TYR  26 -14.736 -11.431   5.664
  255    HD2  TYR  26           HD2      TYR  26 -12.801  -8.771   8.361
  256    HE1  TYR  26           HE1      TYR  26 -16.415 -11.958   7.378
  257    HE2  TYR  26           HE2      TYR  26 -14.480  -9.286  10.079
  258    HH   TYR  26           HH       TYR  26 -16.527 -11.916   9.901
  259    H    ASP  27           H        ASP  27 -15.336  -8.120   5.317
  260    HA   ASP  27           HA       ASP  27 -16.609  -9.958   3.498
  261    HB2  ASP  27           HB2      ASP  27 -17.645  -9.412   5.659
  262    HB3  ASP  27           HB3      ASP  27 -17.800  -7.732   5.166
  263    H    ALA  28           H        ALA  28 -16.065  -6.464   3.658
  264    HA   ALA  28           HA       ALA  28 -17.478  -5.665   1.413
  265    HB1  ALA  28           HB1      ALA  28 -15.998  -3.737   1.337
  266    HB2  ALA  28           HB2      ALA  28 -16.436  -4.117   3.003
  267    HB3  ALA  28           HB3      ALA  28 -14.844  -4.562   2.385
  268    H    CYS  29           H        CYS  29 -14.096  -6.723   1.616
  269    HA   CYS  29           HA       CYS  29 -13.426  -6.434  -1.067
  270    HB2  CYS  29           HB2      CYS  29 -11.752  -6.792   0.652
  271    HB3  CYS  29           HB3      CYS  29 -12.373  -8.408   0.967
  272    HG   CYS  29           HG       CYS  29 -10.796  -7.382  -1.900
  273    H    ARG  30           H        ARG  30 -15.149  -9.065   0.517
  274    HA   ARG  30           HA       ARG  30 -14.713 -10.847  -1.704
  275    HB2  ARG  30           HB2      ARG  30 -15.935 -12.489  -0.500
  276    HB3  ARG  30           HB3      ARG  30 -14.906 -11.651   0.646
  277    HG2  ARG  30           HG2      ARG  30 -16.916 -10.295   1.323
  278    HG3  ARG  30           HG3      ARG  30 -17.876 -11.375   0.300
  279    HD2  ARG  30           HD2      ARG  30 -17.163 -13.301   1.583
  280    HD3  ARG  30           HD3      ARG  30 -16.111 -12.287   2.569
  281    HE   ARG  30           HE       ARG  30 -18.643 -11.224   2.832
  282   HH11  ARG  30          HH11      ARG  30 -17.032 -14.260   3.561
  283   HH12  ARG  30          HH12      ARG  30 -18.125 -14.669   4.844
  284   HH21  ARG  30          HH21      ARG  30 -20.061 -11.762   4.534
  285   HH22  ARG  30          HH22      ARG  30 -19.850 -13.255   5.403
  286    H    MET  31           H        MET  31 -17.266  -8.697  -0.651
  287    HA   MET  31           HA       MET  31 -19.156  -9.650  -2.588
  288    HB2  MET  31           HB2      MET  31 -19.158  -7.067  -1.024
  289    HB3  MET  31           HB3      MET  31 -20.517  -7.760  -1.897
  290    HG2  MET  31           HG2      MET  31 -20.553  -9.659  -0.411
  291    HG3  MET  31           HG3      MET  31 -19.139  -9.049   0.438
  292    HE1  MET  31           HE1      MET  31 -19.025  -7.095   1.909
  293    HE2  MET  31           HE2      MET  31 -19.621  -5.969   0.681
  294    HE3  MET  31           HE3      MET  31 -20.342  -5.974   2.297
  295    H    ILE  32           H        ILE  32 -16.911  -6.912  -2.373
  296    HA   ILE  32           HA       ILE  32 -17.867  -5.578  -4.662
  297    HB   ILE  32           HB       ILE  32 -16.449  -4.428  -3.057
  298   HG12  ILE  32          HG12      ILE  32 -15.299  -4.622  -5.846
  299   HG13  ILE  32          HG13      ILE  32 -16.551  -3.516  -5.292
  300   HG21  ILE  32          HG21      ILE  32 -14.194  -6.159  -4.063
  301   HG22  ILE  32          HG22      ILE  32 -14.049  -4.816  -2.927
  302   HG23  ILE  32          HG23      ILE  32 -14.948  -6.265  -2.472
  303   HD11  ILE  32          HD11      ILE  32 -13.684  -3.527  -4.399
  304   HD12  ILE  32          HD12      ILE  32 -14.421  -2.394  -5.531
  305   HD13  ILE  32          HD13      ILE  32 -14.935  -2.416  -3.844
  306    H    ARG  33           H        ARG  33 -15.266  -7.950  -4.263
  307    HA   ARG  33           HA       ARG  33 -14.504  -8.071  -6.963
  308    HB2  ARG  33           HB2      ARG  33 -14.260  -9.988  -4.670
  309    HB3  ARG  33           HB3      ARG  33 -13.749 -10.455  -6.287
  310    HG2  ARG  33           HG2      ARG  33 -12.250  -8.485  -6.330
  311    HG3  ARG  33           HG3      ARG  33 -12.700  -8.153  -4.657
  312    HD2  ARG  33           HD2      ARG  33 -11.594 -10.810  -5.502
  313    HD3  ARG  33           HD3      ARG  33 -10.540  -9.460  -5.088
  314    HE   ARG  33           HE       ARG  33 -11.599  -9.482  -2.868
  315   HH11  ARG  33          HH11      ARG  33 -11.908 -12.348  -4.862
  316   HH12  ARG  33          HH12      ARG  33 -12.023 -13.432  -3.503
  317   HH21  ARG  33          HH21      ARG  33 -11.737 -10.894  -1.094
  318   HH22  ARG  33          HH22      ARG  33 -11.954 -12.597  -1.354
  319    H    GLU  34           H        GLU  34 -17.205  -9.376  -5.295
  320    HA   GLU  34           HA       GLU  34 -17.806 -11.524  -7.062
  321    HB2  GLU  34           HB2      GLU  34 -18.724 -11.357  -4.770
  322    HB3  GLU  34           HB3      GLU  34 -19.661  -9.948  -5.256
  323    HG2  GLU  34           HG2      GLU  34 -21.052 -11.920  -5.185
  324    HG3  GLU  34           HG3      GLU  34 -20.908 -11.320  -6.837
  325    H    ARG  35           H        ARG  35 -19.381  -8.368  -6.666
  326    HA   ARG  35           HA       ARG  35 -20.747  -8.687  -9.180
  327    HB2  ARG  35           HB2      ARG  35 -21.740  -6.434  -8.561
  328    HB3  ARG  35           HB3      ARG  35 -22.097  -7.792  -7.503
  329    HG2  ARG  35           HG2      ARG  35 -19.986  -6.881  -6.206
  330    HG3  ARG  35           HG3      ARG  35 -20.446  -5.379  -7.009
  331    HD2  ARG  35           HD2      ARG  35 -22.295  -7.086  -5.354
  332    HD3  ARG  35           HD3      ARG  35 -21.456  -5.656  -4.762
  333    HE   ARG  35           HE       ARG  35 -23.109  -5.249  -7.112
  334   HH11  ARG  35          HH11      ARG  35 -22.959  -5.171  -3.614
  335   HH12  ARG  35          HH12      ARG  35 -24.235  -3.996  -3.461
  336   HH21  ARG  35          HH21      ARG  35 -24.809  -3.745  -6.919
  337   HH22  ARG  35          HH22      ARG  35 -25.314  -3.210  -5.339
  338    H    ILE  36           H        ILE  36 -18.044  -6.724  -8.026
  339    HA   ILE  36           HA       ILE  36 -18.092  -5.244 -10.565
  340    HB   ILE  36           HB       ILE  36 -16.472  -4.645  -8.083
  341   HG12  ILE  36          HG12      ILE  36 -19.022  -3.384  -9.118
  342   HG13  ILE  36          HG13      ILE  36 -18.878  -4.387  -7.678
  343   HG21  ILE  36          HG21      ILE  36 -15.431  -3.780 -10.100
  344   HG22  ILE  36          HG22      ILE  36 -16.952  -3.031 -10.589
  345   HG23  ILE  36          HG23      ILE  36 -16.108  -2.455  -9.151
  346   HD11  ILE  36          HD11      ILE  36 -19.005  -2.037  -7.105
  347   HD12  ILE  36          HD12      ILE  36 -17.436  -2.706  -6.658
  348   HD13  ILE  36          HD13      ILE  36 -17.587  -1.702  -8.099
  349    HA   PRO  37           HA       PRO  37 -14.721  -7.916 -11.825
  350    HB2  PRO  37           HB2      PRO  37 -14.814  -6.401 -14.320
  351    HB3  PRO  37           HB3      PRO  37 -15.175  -8.105 -14.034
  352    HG2  PRO  37           HG2      PRO  37 -17.090  -6.299 -14.656
  353    HG3  PRO  37           HG3      PRO  37 -17.399  -7.700 -13.614
  354    HD2  PRO  37           HD2      PRO  37 -16.900  -4.844 -12.853
  355    HD3  PRO  37           HD3      PRO  37 -18.087  -5.994 -12.197
  356    H    GLU  38           H        GLU  38 -14.761  -4.420 -11.933
  357    HA   GLU  38           HA       GLU  38 -12.097  -4.013 -12.772
  358    HB2  GLU  38           HB2      GLU  38 -13.909  -2.260 -11.106
  359    HB3  GLU  38           HB3      GLU  38 -12.338  -1.752 -11.706
  360    HG2  GLU  38           HG2      GLU  38 -13.867  -0.852 -13.209
  361    HG3  GLU  38           HG3      GLU  38 -13.232  -2.277 -14.026
  362    H    ALA  39           H        ALA  39 -13.431  -4.993  -9.765
  363    HA   ALA  39           HA       ALA  39 -11.541  -3.985  -7.970
  364    HB1  ALA  39           HB1      ALA  39 -12.360  -5.665  -6.419
  365    HB2  ALA  39           HB2      ALA  39 -13.700  -4.925  -7.296
  366    HB3  ALA  39           HB3      ALA  39 -13.133  -6.533  -7.745
  367    H    LEU  40           H        LEU  40 -11.595  -7.071  -9.735
  368    HA   LEU  40           HA       LEU  40  -8.977  -7.639  -8.593
  369    HB2  LEU  40           HB2      LEU  40  -9.387  -9.974  -9.632
  370    HB3  LEU  40           HB3      LEU  40 -10.157  -9.521  -8.131
  371    HG   LEU  40           HG       LEU  40 -11.601 -10.824  -9.685
  372   HD11  LEU  40          HD11      LEU  40 -13.597  -9.407  -9.474
  373   HD12  LEU  40          HD12      LEU  40 -12.648  -9.482  -7.988
  374   HD13  LEU  40          HD13      LEU  40 -12.562  -8.054  -9.019
  375   HD21  LEU  40          HD21      LEU  40 -11.375  -8.363 -11.386
  376   HD22  LEU  40          HD22      LEU  40 -10.914 -10.011 -11.809
  377   HD23  LEU  40          HD23      LEU  40 -12.618  -9.601 -11.595
  378    H    ALA  41           H        ALA  41  -8.241  -5.899 -10.064
  379    HA   ALA  41           HA       ALA  41  -7.985  -6.368 -12.836
  380    HB1  ALA  41           HB1      ALA  41  -6.227  -4.722 -11.018
  381    HB2  ALA  41           HB2      ALA  41  -6.263  -4.631 -12.779
  382    HB3  ALA  41           HB3      ALA  41  -7.681  -4.156 -11.842
  383    H    GLY  42           H        GLY  42  -6.383  -7.623 -10.099
  384    HA2  GLY  42           HA2      GLY  42  -4.789  -9.368 -11.805
  385    HA3  GLY  42           HA3      GLY  42  -3.923  -8.410 -10.605
  386    HA   PRO  43           HA       PRO  43  -4.969 -12.145  -8.214
  387    HB2  PRO  43           HB2      PRO  43  -2.861 -11.235  -6.420
  388    HB3  PRO  43           HB3      PRO  43  -2.953 -12.725  -7.361
  389    HG2  PRO  43           HG2      PRO  43  -1.194 -10.734  -7.921
  390    HG3  PRO  43           HG3      PRO  43  -1.857 -11.817  -9.158
  391    HD2  PRO  43           HD2      PRO  43  -2.634  -9.009  -8.481
  392    HD3  PRO  43           HD3      PRO  43  -2.494  -9.791 -10.071
  393    HA   PRO  44           HA       PRO  44  -7.742  -9.611  -5.847
  394    HB2  PRO  44           HB2      PRO  44  -8.834 -11.688  -4.386
  395    HB3  PRO  44           HB3      PRO  44  -9.346 -11.204  -6.005
  396    HG2  PRO  44           HG2      PRO  44  -7.498 -13.403  -5.177
  397    HG3  PRO  44           HG3      PRO  44  -8.749 -13.399  -6.436
  398    HD2  PRO  44           HD2      PRO  44  -6.159 -13.157  -7.057
  399    HD3  PRO  44           HD3      PRO  44  -7.404 -12.247  -7.940
  400    H    ASN  45           H        ASN  45  -5.425 -11.770  -4.335
  401    HA   ASN  45           HA       ASN  45  -6.081 -10.936  -1.655
  402    HB2  ASN  45           HB2      ASN  45  -3.596 -12.405  -2.558
  403    HB3  ASN  45           HB3      ASN  45  -4.260 -12.336  -0.928
  404   HD21  ASN  45          HD21      ASN  45  -4.387 -13.836  -4.002
  405   HD22  ASN  45          HD22      ASN  45  -5.592 -15.030  -3.623
  406    H    ASP  46           H        ASP  46  -4.145  -9.771  -4.191
  407    HA   ASP  46           HA       ASP  46  -2.312  -8.317  -2.478
  408    HB2  ASP  46           HB2      ASP  46  -2.649  -8.469  -5.475
  409    HB3  ASP  46           HB3      ASP  46  -1.489  -7.394  -4.694
  410    H    PHE  47           H        PHE  47  -5.430  -7.888  -3.365
  411    HA   PHE  47           HA       PHE  47  -5.193  -4.971  -3.580
  412    HB2  PHE  47           HB2      PHE  47  -7.465  -6.842  -4.258
  413    HB3  PHE  47           HB3      PHE  47  -7.621  -5.088  -4.260
  414    HD1  PHE  47           HD1      PHE  47  -6.238  -3.743  -5.859
  415    HD2  PHE  47           HD2      PHE  47  -6.500  -7.981  -6.058
  416    HE1  PHE  47           HE1      PHE  47  -5.421  -3.682  -8.172
  417    HE2  PHE  47           HE2      PHE  47  -5.684  -7.927  -8.375
  418    HZ   PHE  47           HZ       PHE  47  -5.084  -5.740  -9.413
  419    H    GLY  48           H        GLY  48  -5.994  -3.642  -2.051
  420    HA2  GLY  48           HA2      GLY  48  -7.590  -4.852   0.115
  421    HA3  GLY  48           HA3      GLY  48  -6.173  -3.887   0.490
  422    H    LEU  49           H        LEU  49  -8.127  -2.911   1.735
  423    HA   LEU  49           HA       LEU  49  -9.579  -1.012   0.037
  424    HB2  LEU  49           HB2      LEU  49 -10.037  -1.803   2.913
  425    HB3  LEU  49           HB3      LEU  49 -10.994  -0.628   2.031
  426    HG   LEU  49           HG       LEU  49 -10.805  -3.588   1.462
  427   HD11  LEU  49          HD11      LEU  49 -13.186  -3.567   2.028
  428   HD12  LEU  49          HD12      LEU  49 -12.188  -3.030   3.380
  429   HD13  LEU  49          HD13      LEU  49 -13.075  -1.850   2.416
  430   HD21  LEU  49          HD21      LEU  49 -10.953  -2.322  -0.621
  431   HD22  LEU  49          HD22      LEU  49 -12.456  -3.185  -0.291
  432   HD23  LEU  49          HD23      LEU  49 -12.352  -1.450   0.004
  433    H    PHE  50           H        PHE  50  -8.346   0.665  -0.295
  434    HA   PHE  50           HA       PHE  50  -6.942   1.955   1.924
  435    HB2  PHE  50           HB2      PHE  50  -5.662   1.656  -0.129
  436    HB3  PHE  50           HB3      PHE  50  -6.894   2.506  -1.053
  437    HD1  PHE  50           HD1      PHE  50  -4.356   2.918   1.606
  438    HD2  PHE  50           HD2      PHE  50  -6.850   4.854  -1.255
  439    HE1  PHE  50           HE1      PHE  50  -3.168   5.035   2.005
  440    HE2  PHE  50           HE2      PHE  50  -5.659   6.961  -0.863
  441    HZ   PHE  50           HZ       PHE  50  -3.847   7.075   0.764
  442    H    LEU  51           H        LEU  51  -7.717   3.731   2.903
  443    HA   LEU  51           HA       LEU  51 -10.217   4.817   1.861
  444    HB2  LEU  51           HB2      LEU  51  -9.753   4.116   4.334
  445    HB3  LEU  51           HB3      LEU  51  -8.958   5.674   4.445
  446    HG   LEU  51           HG       LEU  51 -11.358   5.591   5.238
  447   HD11  LEU  51          HD11      LEU  51 -11.980   7.729   4.222
  448   HD12  LEU  51          HD12      LEU  51 -10.289   7.712   4.726
  449   HD13  LEU  51          HD13      LEU  51 -10.702   7.525   3.022
  450   HD21  LEU  51          HD21      LEU  51 -13.113   5.634   3.573
  451   HD22  LEU  51          HD22      LEU  51 -11.928   5.434   2.283
  452   HD23  LEU  51          HD23      LEU  51 -12.194   4.134   3.443
  453    H    SER  52           H        SER  52 -10.054   6.403   0.487
  454    HA   SER  52           HA       SER  52  -7.723   8.141   0.525
  455    HB2  SER  52           HB2      SER  52  -8.338   7.165  -1.604
  456    HB3  SER  52           HB3      SER  52  -9.959   7.840  -1.493
  457    HG   SER  52           HG       SER  52  -8.556   9.078  -2.834
  458    H    ASP  53           H        ASP  53  -7.892   9.713   1.908
  459    HA   ASP  53           HA       ASP  53 -10.419  11.069   2.391
  460    HB2  ASP  53           HB2      ASP  53  -8.858  10.521   4.273
  461    HB3  ASP  53           HB3      ASP  53  -7.694  11.648   3.584
  462    H    ASP  54           H        ASP  54  -7.103  12.094   1.615
  463    HA   ASP  54           HA       ASP  54  -7.709  13.490  -0.713
  464    HB2  ASP  54           HB2      ASP  54  -8.970  15.020   0.768
  465    HB3  ASP  54           HB3      ASP  54  -7.497  15.327   1.686
  466    H    ASP  55           H        ASP  55  -5.732  14.016   2.210
  467    HA   ASP  55           HA       ASP  55  -3.341  14.331   0.585
  468    HB2  ASP  55           HB2      ASP  55  -3.713  14.317   3.592
  469    HB3  ASP  55           HB3      ASP  55  -2.185  14.615   2.776
  470    HA   PRO  56           HA       PRO  56  -2.032  10.098   0.742
  471    HB2  PRO  56           HB2      PRO  56   0.684  10.502   0.967
  472    HB3  PRO  56           HB3      PRO  56  -0.213  10.583  -0.552
  473    HG2  PRO  56           HG2      PRO  56   0.665  12.802   1.251
  474    HG3  PRO  56           HG3      PRO  56   0.702  12.718  -0.521
  475    HD2  PRO  56           HD2      PRO  56  -1.197  14.093   0.771
  476    HD3  PRO  56           HD3      PRO  56  -1.566  13.179  -0.708
  477    H    LYS  57           H        LYS  57  -1.227  12.391   3.218
  478    HA   LYS  57           HA       LYS  57  -0.071  10.481   5.029
  479    HB2  LYS  57           HB2      LYS  57  -1.176  13.211   5.696
  480    HB3  LYS  57           HB3      LYS  57  -0.015  12.270   6.626
  481    HG2  LYS  57           HG2      LYS  57   0.501  13.378   3.877
  482    HG3  LYS  57           HG3      LYS  57   0.989  14.154   5.383
  483    HD2  LYS  57           HD2      LYS  57   1.836  11.388   4.536
  484    HD3  LYS  57           HD3      LYS  57   2.796  12.847   4.280
  485    HE2  LYS  57           HE2      LYS  57   1.905  11.750   6.946
  486    HE3  LYS  57           HE3      LYS  57   3.529  11.634   6.271
  487    HZ1  LYS  57           HZ1      LYS  57   3.513  13.421   7.803
  488    HZ2  LYS  57           HZ2      LYS  57   2.105  14.088   7.138
  489    HZ3  LYS  57           HZ3      LYS  57   3.554  14.120   6.256
  490    H    LYS  58           H        LYS  58  -3.228  11.997   4.577
  491    HA   LYS  58           HA       LYS  58  -4.351  10.792   6.935
  492    HB2  LYS  58           HB2      LYS  58  -5.566  12.326   4.650
  493    HB3  LYS  58           HB3      LYS  58  -6.542  11.595   5.914
  494    HG2  LYS  58           HG2      LYS  58  -6.313  13.758   6.651
  495    HG3  LYS  58           HG3      LYS  58  -5.030  12.930   7.527
  496    HD2  LYS  58           HD2      LYS  58  -3.373  13.747   6.007
  497    HD3  LYS  58           HD3      LYS  58  -4.611  14.401   4.930
  498    HE2  LYS  58           HE2      LYS  58  -5.334  15.883   6.808
  499    HE3  LYS  58           HE3      LYS  58  -3.927  15.326   7.711
  500    HZ1  LYS  58           HZ1      LYS  58  -2.489  16.236   6.033
  501    HZ2  LYS  58           HZ2      LYS  58  -3.554  17.447   6.559
  502    HZ3  LYS  58           HZ3      LYS  58  -3.814  16.680   5.069
  503    H    GLY  59           H        GLY  59  -3.890   9.924   3.661
  504    HA2  GLY  59           HA2      GLY  59  -5.880   7.951   3.364
  505    HA3  GLY  59           HA3      GLY  59  -4.340   7.987   2.512
  506    H    ILE  60           H        ILE  60  -5.991   5.837   3.953
  507    HA   ILE  60           HA       ILE  60  -3.786   4.704   5.500
  508    HB   ILE  60           HB       ILE  60  -5.383   3.967   7.285
  509   HG12  ILE  60          HG12      ILE  60  -7.187   6.091   6.105
  510   HG13  ILE  60          HG13      ILE  60  -7.449   4.357   5.945
  511   HG21  ILE  60          HG21      ILE  60  -3.835   5.794   7.681
  512   HG22  ILE  60          HG22      ILE  60  -4.988   6.943   7.000
  513   HG23  ILE  60          HG23      ILE  60  -5.367   6.095   8.499
  514   HD11  ILE  60          HD11      ILE  60  -7.702   4.165   8.355
  515   HD12  ILE  60          HD12      ILE  60  -7.409   5.896   8.530
  516   HD13  ILE  60          HD13      ILE  60  -8.846   5.326   7.681
  517    H    TRP  61           H        TRP  61  -3.974   2.421   5.834
  518    HA   TRP  61           HA       TRP  61  -5.667   1.125   3.827
  519    HB2  TRP  61           HB2      TRP  61  -3.263   0.142   5.369
  520    HB3  TRP  61           HB3      TRP  61  -4.263  -0.918   4.378
  521    HD1  TRP  61           HD1      TRP  61  -1.518   1.644   4.143
  522    HE1  TRP  61           HE1      TRP  61  -0.790   1.929   1.691
  523    HE3  TRP  61           HE3      TRP  61  -5.212  -1.061   1.913
  524    HZ2  TRP  61           HZ2      TRP  61  -1.682   1.100  -0.857
  525    HZ3  TRP  61           HZ3      TRP  61  -5.215  -1.270  -0.537
  526    HH2  TRP  61           HH2      TRP  61  -3.481  -0.214  -1.892
  527    H    LEU  62           H        LEU  62  -7.405   0.053   4.363
  528    HA   LEU  62           HA       LEU  62  -8.206  -0.013   7.139
  529    HB2  LEU  62           HB2      LEU  62  -9.667  -1.005   4.689
  530    HB3  LEU  62           HB3      LEU  62 -10.363  -0.699   6.268
  531    HG   LEU  62           HG       LEU  62  -9.175   1.435   4.492
  532   HD11  LEU  62          HD11      LEU  62 -11.169   0.464   3.481
  533   HD12  LEU  62          HD12      LEU  62 -12.059   0.714   4.982
  534   HD13  LEU  62          HD13      LEU  62 -11.480   2.101   4.060
  535   HD21  LEU  62          HD21      LEU  62 -10.298   2.968   6.020
  536   HD22  LEU  62          HD22      LEU  62 -10.827   1.601   7.004
  537   HD23  LEU  62          HD23      LEU  62  -9.108   1.976   6.864
  538    H    GLU  63           H        GLU  63  -7.676  -1.705   8.420
  539    HA   GLU  63           HA       GLU  63  -7.019  -4.261   7.244
  540    HB2  GLU  63           HB2      GLU  63  -6.456  -4.922   9.530
  541    HB3  GLU  63           HB3      GLU  63  -5.698  -3.393   9.113
  542    HG2  GLU  63           HG2      GLU  63  -7.520  -2.223  10.329
  543    HG3  GLU  63           HG3      GLU  63  -8.129  -3.798  10.837
  544    H    ALA  64           H        ALA  64  -7.999  -6.268   8.064
  545    HA   ALA  64           HA       ALA  64 -10.858  -6.049   7.784
  546    HB1  ALA  64           HB1      ALA  64  -9.148  -8.496   8.195
  547    HB2  ALA  64           HB2      ALA  64 -10.838  -8.476   7.693
  548    HB3  ALA  64           HB3      ALA  64  -9.596  -7.803   6.637
  549    H    GLY  65           H        GLY  65  -8.892  -5.764  10.400
  550    HA2  GLY  65           HA2      GLY  65 -10.382  -7.362  12.280
  551    HA3  GLY  65           HA3      GLY  65  -9.066  -6.259  12.656
  552    H    LYS  66           H        LYS  66 -10.768  -4.219  10.981
  553    HA   LYS  66           HA       LYS  66 -12.705  -3.659  13.124
  554    HB2  LYS  66           HB2      LYS  66 -12.043  -1.495  13.392
  555    HB3  LYS  66           HB3      LYS  66 -10.499  -2.160  12.881
  556    HG2  LYS  66           HG2      LYS  66 -12.457  -0.911  10.977
  557    HG3  LYS  66           HG3      LYS  66 -11.205   0.004  11.812
  558    HD2  LYS  66           HD2      LYS  66  -9.489  -1.065  10.656
  559    HD3  LYS  66           HD3      LYS  66 -10.518  -2.426  10.201
  560    HE2  LYS  66           HE2      LYS  66 -10.871   0.396   9.187
  561    HE3  LYS  66           HE3      LYS  66 -10.019  -0.878   8.313
  562    HZ1  LYS  66           HZ1      LYS  66 -12.235  -0.760   7.510
  563    HZ2  LYS  66           HZ2      LYS  66 -12.882  -0.827   9.073
  564    HZ3  LYS  66           HZ3      LYS  66 -12.104  -2.182   8.420
  565    H    ALA  67           H        ALA  67 -14.460  -2.136  12.413
  566    HA   ALA  67           HA       ALA  67 -15.446  -3.106   9.859
  567    HB1  ALA  67           HB1      ALA  67 -16.915  -3.108  11.817
  568    HB2  ALA  67           HB2      ALA  67 -16.773  -1.352  11.924
  569    HB3  ALA  67           HB3      ALA  67 -17.558  -2.089  10.526
  570    H    LEU  68           H        LEU  68 -16.805  -1.269   8.648
  571    HA   LEU  68           HA       LEU  68 -14.734   0.550   7.755
  572    HB2  LEU  68           HB2      LEU  68 -17.540   0.162   6.731
  573    HB3  LEU  68           HB3      LEU  68 -16.270   1.080   5.959
  574    HG   LEU  68           HG       LEU  68 -16.206  -1.898   6.419
  575   HD11  LEU  68          HD11      LEU  68 -17.889  -1.286   4.772
  576   HD12  LEU  68          HD12      LEU  68 -16.700  -0.319   3.899
  577   HD13  LEU  68          HD13      LEU  68 -16.511  -2.069   3.999
  578   HD21  LEU  68          HD21      LEU  68 -13.993  -0.877   6.412
  579   HD22  LEU  68          HD22      LEU  68 -14.249  -1.846   4.960
  580   HD23  LEU  68          HD23      LEU  68 -14.356  -0.088   4.878
  581    H    ASP  69           H        ASP  69 -18.047   0.767   8.874
  582    HA   ASP  69           HA       ASP  69 -18.230   3.586   8.937
  583    HB2  ASP  69           HB2      ASP  69 -20.244   2.290   8.790
  584    HB3  ASP  69           HB3      ASP  69 -19.846   1.383  10.242
  585    H    TYR  70           H        TYR  70 -16.906   1.261  11.092
  586    HA   TYR  70           HA       TYR  70 -16.917   2.633  13.503
  587    HB2  TYR  70           HB2      TYR  70 -16.196   0.398  13.550
  588    HB3  TYR  70           HB3      TYR  70 -15.038   0.633  12.246
  589    HD1  TYR  70           HD1      TYR  70 -15.731   1.352  15.795
  590    HD2  TYR  70           HD2      TYR  70 -12.806   1.255  12.715
  591    HE1  TYR  70           HE1      TYR  70 -13.969   1.676  17.471
  592    HE2  TYR  70           HE2      TYR  70 -11.029   1.581  14.381
  593    HH   TYR  70           HH       TYR  70 -10.839   2.575  16.697
  594    H    TYR  71           H        TYR  71 -14.852   2.939  10.675
  595    HA   TYR  71           HA       TYR  71 -13.259   5.040  11.842
  596    HB2  TYR  71           HB2      TYR  71 -13.287   3.565   9.276
  597    HB3  TYR  71           HB3      TYR  71 -12.664   5.213   9.227
  598    HD1  TYR  71           HD1      TYR  71 -10.654   5.821  10.439
  599    HD2  TYR  71           HD2      TYR  71 -12.123   1.829  10.491
  600    HE1  TYR  71           HE1      TYR  71  -8.504   5.057  11.351
  601    HE2  TYR  71           HE2      TYR  71  -9.964   1.053  11.402
  602    HH   TYR  71           HH       TYR  71  -7.662   1.734  11.543
  603    H    MET  72           H        MET  72 -13.104   6.662   9.489
  604    HA   MET  72           HA       MET  72 -15.326   8.426  10.097
  605    HB2  MET  72           HB2      MET  72 -12.874   8.817   8.368
  606    HB3  MET  72           HB3      MET  72 -14.044  10.068   8.759
  607    HG2  MET  72           HG2      MET  72 -13.449   9.962  11.087
  608    HG3  MET  72           HG3      MET  72 -12.371   8.601  10.781
  609    HE1  MET  72           HE1      MET  72 -11.626  12.846   9.127
  610    HE2  MET  72           HE2      MET  72 -12.856  11.755   8.487
  611    HE3  MET  72           HE3      MET  72 -13.025  12.419  10.113
  612    H    LEU  73           H        LEU  73 -16.065   6.088   8.562
  613    HA   LEU  73           HA       LEU  73 -16.520   7.286   5.900
  614    HB2  LEU  73           HB2      LEU  73 -17.120   4.435   6.143
  615    HB3  LEU  73           HB3      LEU  73 -16.304   5.305   4.871
  616    HG   LEU  73           HG       LEU  73 -15.067   4.262   7.413
  617   HD11  LEU  73          HD11      LEU  73 -14.705   3.542   4.511
  618   HD12  LEU  73          HD12      LEU  73 -13.766   2.884   5.852
  619   HD13  LEU  73          HD13      LEU  73 -15.497   2.562   5.744
  620   HD21  LEU  73          HD21      LEU  73 -14.071   6.393   6.844
  621   HD22  LEU  73          HD22      LEU  73 -12.948   5.077   6.504
  622   HD23  LEU  73          HD23      LEU  73 -13.822   5.856   5.183
  623    H    ARG  74           H        ARG  74 -18.440   7.203   4.958
  624    HA   ARG  74           HA       ARG  74 -20.705   5.917   6.058
  625    HB2  ARG  74           HB2      ARG  74 -21.982   7.907   6.709
  626    HB3  ARG  74           HB3      ARG  74 -20.537   7.746   7.690
  627    HG2  ARG  74           HG2      ARG  74 -19.448   9.425   6.225
  628    HG3  ARG  74           HG3      ARG  74 -21.000   9.641   5.409
  629    HD2  ARG  74           HD2      ARG  74 -21.176  11.282   6.962
  630    HD3  ARG  74           HD3      ARG  74 -21.843   9.948   7.891
  631    HE   ARG  74           HE       ARG  74 -18.994  10.271   8.185
  632   HH11  ARG  74          HH11      ARG  74 -22.142  11.261   9.354
  633   HH12  ARG  74          HH12      ARG  74 -21.563  11.709  10.931
  634   HH21  ARG  74          HH21      ARG  74 -18.215  10.868  10.264
  635   HH22  ARG  74          HH22      ARG  74 -19.330  11.507  11.440
  636    H    ASN  75           H        ASN  75 -22.680   7.438   4.980
  637    HA   ASN  75           HA       ASN  75 -22.559   6.722   2.269
  638    HB2  ASN  75           HB2      ASN  75 -24.445   8.356   3.916
  639    HB3  ASN  75           HB3      ASN  75 -24.612   8.364   2.163
  640   HD21  ASN  75          HD21      ASN  75 -24.661   6.347   5.032
  641   HD22  ASN  75          HD22      ASN  75 -25.555   5.048   4.308
  642    H    GLY  76           H        GLY  76 -21.186   7.589   0.872
  643    HA2  GLY  76           HA2      GLY  76 -21.122   9.541  -0.661
  644    HA3  GLY  76           HA3      GLY  76 -21.025  10.538   0.781
  645    H    ASP  77           H        ASP  77 -19.179   8.383   1.976
  646    HA   ASP  77           HA       ASP  77 -16.809   9.802   1.271
  647    HB2  ASP  77           HB2      ASP  77 -17.299   7.395   3.021
  648    HB3  ASP  77           HB3      ASP  77 -15.698   8.089   2.778
  649    H    THR  78           H        THR  78 -14.986   9.111   0.218
  650    HA   THR  78           HA       THR  78 -15.442   7.036  -1.768
  651    HB   THR  78           HB       THR  78 -13.102   8.934  -1.480
  652    HG1  THR  78           HG1      THR  78 -15.534   9.594  -1.998
  653   HG21  THR  78          HG21      THR  78 -12.616   6.977  -2.869
  654   HG22  THR  78          HG22      THR  78 -12.722   8.436  -3.855
  655   HG23  THR  78          HG23      THR  78 -14.062   7.291  -3.829
  656    H    MET  79           H        MET  79 -14.591   5.054  -1.630
  657    HA   MET  79           HA       MET  79 -12.295   4.642   0.161
  658    HB2  MET  79           HB2      MET  79 -14.534   3.707   1.022
  659    HB3  MET  79           HB3      MET  79 -14.419   2.550  -0.298
  660    HG2  MET  79           HG2      MET  79 -12.234   1.814   0.588
  661    HG3  MET  79           HG3      MET  79 -12.451   2.910   1.950
  662    HE1  MET  79           HE1      MET  79 -14.956   0.469   0.059
  663    HE2  MET  79           HE2      MET  79 -13.424  -0.390   0.242
  664    HE3  MET  79           HE3      MET  79 -14.851  -0.925   1.135
  665    H    GLU  80           H        GLU  80 -10.632   4.099  -1.015
  666    HA   GLU  80           HA       GLU  80 -11.010   3.378  -3.793
  667    HB2  GLU  80           HB2      GLU  80  -9.299   5.044  -2.753
  668    HB3  GLU  80           HB3      GLU  80  -8.365   3.604  -2.378
  669    HG2  GLU  80           HG2      GLU  80  -8.161   3.053  -4.688
  670    HG3  GLU  80           HG3      GLU  80  -9.279   4.338  -5.144
  671    H    TYR  81           H        TYR  81 -11.009   1.283  -4.525
  672    HA   TYR  81           HA       TYR  81  -9.815  -0.753  -2.806
  673    HB2  TYR  81           HB2      TYR  81 -12.140  -1.101  -3.742
  674    HB3  TYR  81           HB3      TYR  81 -11.422  -1.139  -5.347
  675    HD1  TYR  81           HD1      TYR  81 -10.061  -3.059  -6.056
  676    HD2  TYR  81           HD2      TYR  81 -11.864  -2.947  -2.206
  677    HE1  TYR  81           HE1      TYR  81  -9.657  -5.475  -5.799
  678    HE2  TYR  81           HE2      TYR  81 -11.458  -5.355  -1.937
  679    HH   TYR  81           HH       TYR  81  -9.393  -7.107  -3.946
  680    H    ARG  82           H        ARG  82  -7.731  -0.923  -3.156
  681    HA   ARG  82           HA       ARG  82  -6.768  -0.830  -5.914
  682    HB2  ARG  82           HB2      ARG  82  -4.890   0.648  -5.271
  683    HB3  ARG  82           HB3      ARG  82  -6.457   1.438  -5.153
  684    HG2  ARG  82           HG2      ARG  82  -6.452   1.155  -2.749
  685    HG3  ARG  82           HG3      ARG  82  -4.921   0.279  -2.836
  686    HD2  ARG  82           HD2      ARG  82  -5.341   3.128  -3.719
  687    HD3  ARG  82           HD3      ARG  82  -4.657   2.643  -2.170
  688    HE   ARG  82           HE       ARG  82  -2.944   1.449  -3.714
  689   HH11  ARG  82          HH11      ARG  82  -4.514   4.501  -4.408
  690   HH12  ARG  82          HH12      ARG  82  -3.115   5.181  -5.190
  691   HH21  ARG  82          HH21      ARG  82  -1.108   2.344  -4.780
  692   HH22  ARG  82          HH22      ARG  82  -1.193   3.965  -5.404
  693    H    LYS  83           H        LYS  83  -4.469  -1.496  -6.061
  694    HA   LYS  83           HA       LYS  83  -4.013  -3.911  -4.659
  695    HB2  LYS  83           HB2      LYS  83  -3.154  -3.288  -6.953
  696    HB3  LYS  83           HB3      LYS  83  -1.996  -2.230  -6.163
  697    HG2  LYS  83           HG2      LYS  83  -0.868  -4.053  -5.170
  698    HG3  LYS  83           HG3      LYS  83  -2.163  -5.175  -5.614
  699    HD2  LYS  83           HD2      LYS  83  -1.650  -4.850  -7.968
  700    HD3  LYS  83           HD3      LYS  83  -0.393  -3.686  -7.548
  701    HE2  LYS  83           HE2      LYS  83   0.868  -5.405  -6.415
  702    HE3  LYS  83           HE3      LYS  83  -0.416  -6.579  -6.707
  703    HZ1  LYS  83           HZ1      LYS  83   1.357  -6.861  -8.300
  704    HZ2  LYS  83           HZ2      LYS  83   1.232  -5.242  -8.788
  705    HZ3  LYS  83           HZ3      LYS  83  -0.040  -6.318  -9.094
  706    H    LYS  84           H        LYS  84  -2.982  -4.266  -2.755
  707    HA   LYS  84           HA       LYS  84  -2.549  -2.113  -0.990
  708    HB2  LYS  84           HB2      LYS  84  -1.632  -4.985  -0.823
  709    HB3  LYS  84           HB3      LYS  84  -1.386  -3.815   0.462
  710    HG2  LYS  84           HG2      LYS  84  -3.987  -3.519   0.252
  711    HG3  LYS  84           HG3      LYS  84  -3.884  -5.138  -0.448
  712    HD2  LYS  84           HD2      LYS  84  -2.528  -5.795   1.580
  713    HD3  LYS  84           HD3      LYS  84  -2.971  -4.236   2.281
  714    HE2  LYS  84           HE2      LYS  84  -4.472  -5.915   3.114
  715    HE3  LYS  84           HE3      LYS  84  -5.358  -4.859   2.018
  716    HZ1  LYS  84           HZ1      LYS  84  -5.088  -6.546   0.280
  717    HZ2  LYS  84           HZ2      LYS  84  -5.930  -7.150   1.617
  718    HZ3  LYS  84           HZ3      LYS  84  -4.303  -7.565   1.382
  719    H    GLN  85           H        GLN  85  -0.531  -3.628  -3.334
  720    HA   GLN  85           HA       GLN  85   1.888  -2.566  -2.137
  721    HB2  GLN  85           HB2      GLN  85   2.138  -3.784  -4.776
  722    HB3  GLN  85           HB3      GLN  85   2.993  -4.151  -3.286
  723    HG2  GLN  85           HG2      GLN  85   0.886  -5.366  -2.572
  724    HG3  GLN  85           HG3      GLN  85   0.379  -5.232  -4.254
  725   HE21  GLN  85          HE21      GLN  85   2.490  -6.772  -2.004
  726   HE22  GLN  85          HE22      GLN  85   3.143  -7.936  -3.107
  727    H    ARG  86           H        ARG  86   3.218  -1.131  -3.192
  728    HA   ARG  86           HA       ARG  86   2.048   0.284  -5.496
  729    HB2  ARG  86           HB2      ARG  86   3.326   2.275  -4.683
  730    HB3  ARG  86           HB3      ARG  86   2.068   1.748  -3.568
  731    HG2  ARG  86           HG2      ARG  86   3.576   0.925  -2.041
  732    HG3  ARG  86           HG3      ARG  86   4.854   0.746  -3.242
  733    HD2  ARG  86           HD2      ARG  86   5.604   2.566  -2.156
  734    HD3  ARG  86           HD3      ARG  86   4.619   3.360  -3.377
  735    HE   ARG  86           HE       ARG  86   3.499   2.803  -0.713
  736   HH11  ARG  86          HH11      ARG  86   4.436   5.117  -3.177
  737   HH12  ARG  86          HH12      ARG  86   3.710   6.469  -2.357
  738   HH21  ARG  86          HH21      ARG  86   2.589   4.563   0.368
  739   HH22  ARG  86          HH22      ARG  86   2.667   6.154  -0.349
  740    HA   PRO  87           HA       PRO  87   5.691  -0.888  -7.707
  741    HB2  PRO  87           HB2      PRO  87   5.992   1.201  -9.423
  742    HB3  PRO  87           HB3      PRO  87   4.736  -0.029  -9.608
  743    HG2  PRO  87           HG2      PRO  87   4.541   2.725  -8.461
  744    HG3  PRO  87           HG3      PRO  87   3.407   1.869  -9.522
  745    HD2  PRO  87           HD2      PRO  87   3.035   2.103  -6.842
  746    HD3  PRO  87           HD3      PRO  87   2.456   0.712  -7.778
  747    H    LEU  88           H        LEU  88   7.526  -0.906  -6.576
  748    HA   LEU  88           HA       LEU  88   8.768   1.660  -5.863
  749    HB2  LEU  88           HB2      LEU  88   8.640  -0.896  -4.469
  750    HB3  LEU  88           HB3      LEU  88  10.255  -0.211  -4.552
  751    HG   LEU  88           HG       LEU  88   8.985   1.980  -3.793
  752   HD11  LEU  88          HD11      LEU  88   7.221   1.483  -2.193
  753   HD12  LEU  88          HD12      LEU  88   6.768   1.012  -3.831
  754   HD13  LEU  88          HD13      LEU  88   7.267  -0.215  -2.668
  755   HD21  LEU  88          HD21      LEU  88   9.768  -0.269  -1.964
  756   HD22  LEU  88          HD22      LEU  88  10.830   0.963  -2.650
  757   HD23  LEU  88          HD23      LEU  88   9.579   1.422  -1.495
  758    H    LYS  89           H        LYS  89  10.566   2.258  -6.851
  759    HA   LYS  89           HA       LYS  89  11.908   0.324  -8.585
  760    HB2  LYS  89           HB2      LYS  89  11.903   3.322  -8.452
  761    HB3  LYS  89           HB3      LYS  89  13.238   2.484  -9.231
  762    HG2  LYS  89           HG2      LYS  89  11.728   3.044 -10.943
  763    HG3  LYS  89           HG3      LYS  89  11.523   1.317 -10.659
  764    HD2  LYS  89           HD2      LYS  89   9.339   2.105 -10.831
  765    HD3  LYS  89           HD3      LYS  89   9.607   2.020  -9.090
  766    HE2  LYS  89           HE2      LYS  89   8.491   4.100  -9.723
  767    HE3  LYS  89           HE3      LYS  89  10.086   4.407  -9.035
  768    HZ1  LYS  89           HZ1      LYS  89   9.454   5.671 -11.132
  769    HZ2  LYS  89           HZ2      LYS  89   9.672   4.207 -11.956
  770    HZ3  LYS  89           HZ3      LYS  89  10.970   4.911 -11.117
  771    H    ILE  90           H        ILE  90  13.693  -0.642  -7.931
  772    HA   ILE  90           HA       ILE  90  15.050   0.451  -5.549
  773    HB   ILE  90           HB       ILE  90  14.416  -2.466  -6.064
  774   HG12  ILE  90          HG12      ILE  90  12.431  -1.161  -5.375
  775   HG13  ILE  90          HG13      ILE  90  12.916  -2.327  -4.148
  776   HG21  ILE  90          HG21      ILE  90  15.315  -2.818  -3.789
  777   HG22  ILE  90          HG22      ILE  90  16.525  -2.239  -4.933
  778   HG23  ILE  90          HG23      ILE  90  15.820  -1.128  -3.757
  779   HD11  ILE  90          HD11      ILE  90  12.267  -0.218  -3.150
  780   HD12  ILE  90          HD12      ILE  90  13.979  -0.538  -2.873
  781   HD13  ILE  90          HD13      ILE  90  13.487   0.627  -4.102
  782    H    ARG  91           H        ARG  91  17.258   0.542  -5.736
  783    HA   ARG  91           HA       ARG  91  18.443  -0.877  -8.020
  784    HB2  ARG  91           HB2      ARG  91  18.677   1.672  -7.786
  785    HB3  ARG  91           HB3      ARG  91  19.728   1.324  -6.418
  786    HG2  ARG  91           HG2      ARG  91  21.242   0.090  -7.854
  787    HG3  ARG  91           HG3      ARG  91  20.185   0.387  -9.238
  788    HD2  ARG  91           HD2      ARG  91  21.588   2.494  -7.596
  789    HD3  ARG  91           HD3      ARG  91  22.077   1.939  -9.199
  790    HE   ARG  91           HE       ARG  91  19.660   2.753  -9.774
  791   HH11  ARG  91          HH11      ARG  91  22.063   4.280  -7.753
  792   HH12  ARG  91          HH12      ARG  91  21.379   5.875  -7.914
  793   HH21  ARG  91          HH21      ARG  91  18.770   4.827 -10.033
  794   HH22  ARG  91          HH22      ARG  91  19.481   6.181  -9.205
  795    H    MET  92           H        MET  92  19.598  -2.623  -7.562
  796    HA   MET  92           HA       MET  92  20.055  -3.382  -4.828
  797    HB2  MET  92           HB2      MET  92  20.032  -4.657  -7.472
  798    HB3  MET  92           HB3      MET  92  21.227  -5.320  -6.366
  799    HG2  MET  92           HG2      MET  92  18.912  -6.372  -6.463
  800    HG3  MET  92           HG3      MET  92  19.620  -6.067  -4.881
  801    HE1  MET  92           HE1      MET  92  16.207  -3.666  -6.817
  802    HE2  MET  92           HE2      MET  92  17.825  -3.774  -7.512
  803    HE3  MET  92           HE3      MET  92  16.807  -5.213  -7.422
  804    H    LEU  93           H        LEU  93  22.214  -4.718  -4.574
  805    HA   LEU  93           HA       LEU  93  24.093  -2.820  -3.896
  806    HB2  LEU  93           HB2      LEU  93  24.529  -5.771  -4.355
  807    HB3  LEU  93           HB3      LEU  93  25.664  -4.712  -3.549
  808    HG   LEU  93           HG       LEU  93  24.618  -5.813  -1.801
  809   HD11  LEU  93          HD11      LEU  93  24.633  -3.426  -1.407
  810   HD12  LEU  93          HD12      LEU  93  23.043  -3.274  -2.157
  811   HD13  LEU  93          HD13      LEU  93  23.225  -4.174  -0.652
  812   HD21  LEU  93          HD21      LEU  93  22.282  -6.307  -1.613
  813   HD22  LEU  93          HD22      LEU  93  21.918  -5.366  -3.059
  814   HD23  LEU  93          HD23      LEU  93  22.850  -6.857  -3.189
  815    H    ASP  94           H        ASP  94  24.114  -4.992  -6.704
  816    HA   ASP  94           HA       ASP  94  26.651  -4.004  -7.630
  817    HB2  ASP  94           HB2      ASP  94  24.590  -5.788  -8.937
  818    HB3  ASP  94           HB3      ASP  94  26.137  -5.378  -9.671
  819    H    GLY  95           H        GLY  95  23.635  -2.685  -7.639
  820    HA2  GLY  95           HA2      GLY  95  23.294  -0.496  -8.517
  821    HA3  GLY  95           HA3      GLY  95  24.414  -0.873  -9.821
  822    H    THR  96           H        THR  96  22.336  -3.428  -9.215
  823    HA   THR  96           HA       THR  96  21.049  -3.004 -11.762
  824    HB   THR  96           HB       THR  96  20.728  -5.303  -9.818
  825    HG1  THR  96           HG1      THR  96  22.201  -6.134 -11.754
  826   HG21  THR  96          HG21      THR  96  19.984  -6.554 -11.794
  827   HG22  THR  96          HG22      THR  96  20.143  -5.099 -12.777
  828   HG23  THR  96          HG23      THR  96  18.939  -5.165 -11.490
  829    H    VAL  97           H        VAL  97  19.018  -2.258 -12.042
  830    HA   VAL  97           HA       VAL  97  17.524  -1.734  -9.565
  831    HB   VAL  97           HB       VAL  97  18.230   0.335 -10.593
  832   HG11  VAL  97          HG11      VAL  97  17.508   1.014 -12.818
  833   HG12  VAL  97          HG12      VAL  97  18.532  -0.422 -12.879
  834   HG13  VAL  97          HG13      VAL  97  16.785  -0.576 -13.072
  835   HG21  VAL  97          HG21      VAL  97  16.056   0.342  -9.514
  836   HG22  VAL  97          HG22      VAL  97  16.066   1.442 -10.893
  837   HG23  VAL  97          HG23      VAL  97  15.285  -0.134 -11.027
  838    H    LYS  98           H        LYS  98  15.461  -2.258  -9.400
  839    HA   LYS  98           HA       LYS  98  14.052  -3.362 -11.717
  840    HB2  LYS  98           HB2      LYS  98  13.390  -5.383 -10.687
  841    HB3  LYS  98           HB3      LYS  98  15.121  -5.271 -10.411
  842    HG2  LYS  98           HG2      LYS  98  14.826  -4.703  -8.144
  843    HG3  LYS  98           HG3      LYS  98  13.107  -4.382  -8.370
  844    HD2  LYS  98           HD2      LYS  98  14.400  -7.090  -8.686
  845    HD3  LYS  98           HD3      LYS  98  13.590  -6.545  -7.219
  846    HE2  LYS  98           HE2      LYS  98  11.932  -7.752  -8.271
  847    HE3  LYS  98           HE3      LYS  98  11.575  -6.107  -8.801
  848    HZ1  LYS  98           HZ1      LYS  98  12.604  -6.553 -10.903
  849    HZ2  LYS  98           HZ2      LYS  98  11.485  -7.784 -10.595
  850    HZ3  LYS  98           HZ3      LYS  98  13.144  -8.077 -10.388
  851    H    THR  99           H        THR  99  11.715  -3.446 -11.402
  852    HA   THR  99           HA       THR  99  10.822  -1.697  -9.215
  853    HB   THR  99           HB       THR  99   9.470  -2.233 -11.871
  854    HG1  THR  99           HG1      THR  99  11.219  -0.939 -12.298
  855   HG21  THR  99          HG21      THR  99   7.920  -1.703 -10.044
  856   HG22  THR  99          HG22      THR  99   7.986  -0.403 -11.236
  857   HG23  THR  99          HG23      THR  99   8.833  -0.235  -9.698
  858    H    ILE 100           H        ILE 100   9.794  -2.785  -7.626
  859    HA   ILE 100           HA       ILE 100   8.210  -5.144  -8.363
  860    HB   ILE 100           HB       ILE 100  10.417  -5.813  -7.380
  861   HG12  ILE 100          HG12      ILE 100   8.076  -7.015  -7.071
  862   HG13  ILE 100          HG13      ILE 100   9.524  -7.619  -6.284
  863   HG21  ILE 100          HG21      ILE 100   9.366  -4.446  -4.911
  864   HG22  ILE 100          HG22      ILE 100  10.775  -5.506  -4.965
  865   HG23  ILE 100          HG23      ILE 100  10.781  -3.983  -5.858
  866   HD11  ILE 100          HD11      ILE 100   7.409  -5.904  -5.007
  867   HD12  ILE 100          HD12      ILE 100   7.623  -7.640  -4.783
  868   HD13  ILE 100          HD13      ILE 100   8.857  -6.520  -4.212
  869    H    MET 101           H        MET 101   6.331  -5.423  -7.145
  870    HA   MET 101           HA       MET 101   5.461  -2.980  -5.825
  871    HB2  MET 101           HB2      MET 101   3.907  -5.431  -6.635
  872    HB3  MET 101           HB3      MET 101   3.209  -3.949  -5.987
  873    HG2  MET 101           HG2      MET 101   4.546  -2.891  -8.008
  874    HG3  MET 101           HG3      MET 101   4.336  -4.511  -8.669
  875    HE1  MET 101           HE1      MET 101   2.630  -1.250  -7.418
  876    HE2  MET 101           HE2      MET 101   0.921  -1.698  -7.412
  877    HE3  MET 101           HE3      MET 101   2.037  -2.448  -6.268
  878    H    VAL 102           H        VAL 102   5.745  -2.756  -3.824
  879    HA   VAL 102           HA       VAL 102   5.452  -5.052  -2.002
  880    HB   VAL 102           HB       VAL 102   6.466  -3.023  -0.442
  881   HG11  VAL 102          HG11      VAL 102   8.548  -4.334  -0.521
  882   HG12  VAL 102          HG12      VAL 102   7.106  -5.334  -0.334
  883   HG13  VAL 102          HG13      VAL 102   7.906  -5.226  -1.903
  884   HG21  VAL 102          HG21      VAL 102   7.802  -2.917  -3.144
  885   HG22  VAL 102          HG22      VAL 102   6.935  -1.604  -2.343
  886   HG23  VAL 102          HG23      VAL 102   8.450  -2.206  -1.665
  887    H    ASP 103           H        ASP 103   3.920  -5.094  -0.522
  888    HA   ASP 103           HA       ASP 103   1.709  -3.416  -0.632
  889    HB2  ASP 103           HB2      ASP 103   2.587  -5.145   1.689
  890    HB3  ASP 103           HB3      ASP 103   0.963  -4.525   1.412
  891    H    ASP 104           H        ASP 104   1.532  -1.409  -0.095
  892    HA   ASP 104           HA       ASP 104   3.392   0.043   1.470
  893    HB2  ASP 104           HB2      ASP 104   2.097   1.061  -0.338
  894    HB3  ASP 104           HB3      ASP 104   0.598   0.736   0.523
  895    H    SER 105           H        SER 105   0.807  -1.958   2.302
  896    HA   SER 105           HA       SER 105   0.082  -0.620   4.736
  897    HB2  SER 105           HB2      SER 105  -1.206  -2.848   5.046
  898    HB3  SER 105           HB3      SER 105  -1.697  -1.761   3.745
  899    HG   SER 105           HG       SER 105  -0.541  -4.274   3.632
  900    H    LYS 106           H        LYS 106   2.775  -2.404   3.920
  901    HA   LYS 106           HA       LYS 106   3.071  -3.221   6.728
  902    HB2  LYS 106           HB2      LYS 106   4.613  -5.040   5.904
  903    HB3  LYS 106           HB3      LYS 106   2.906  -5.268   5.587
  904    HG2  LYS 106           HG2      LYS 106   3.906  -5.944   3.622
  905    HG3  LYS 106           HG3      LYS 106   3.436  -4.285   3.266
  906    HD2  LYS 106           HD2      LYS 106   5.652  -3.505   3.496
  907    HD3  LYS 106           HD3      LYS 106   6.177  -5.006   4.265
  908    HE2  LYS 106           HE2      LYS 106   5.219  -4.770   1.413
  909    HE3  LYS 106           HE3      LYS 106   6.911  -4.800   1.904
  910    HZ1  LYS 106           HZ1      LYS 106   6.541  -6.997   1.391
  911    HZ2  LYS 106           HZ2      LYS 106   4.934  -6.981   1.919
  912    HZ3  LYS 106           HZ3      LYS 106   6.192  -7.018   3.052
  913    H    THR 107           H        THR 107   5.343  -3.342   7.487
  914    HA   THR 107           HA       THR 107   6.527  -0.795   6.940
  915    HB   THR 107           HB       THR 107   8.201  -1.487   8.676
  916    HG1  THR 107           HG1      THR 107   7.994  -3.431   9.668
  917   HG21  THR 107          HG21      THR 107   5.278  -1.725   9.399
  918   HG22  THR 107          HG22      THR 107   6.216  -0.233   9.296
  919   HG23  THR 107          HG23      THR 107   6.590  -1.425  10.539
  920    H    VAL 108           H        VAL 108   9.169  -0.995   7.185
  921    HA   VAL 108           HA       VAL 108   9.811  -1.635   4.468
  922    HB   VAL 108           HB       VAL 108  11.794  -0.732   6.519
  923   HG11  VAL 108          HG11      VAL 108  12.682  -1.371   4.365
  924   HG12  VAL 108          HG12      VAL 108  11.569  -0.264   3.561
  925   HG13  VAL 108          HG13      VAL 108  12.840   0.368   4.609
  926   HG21  VAL 108          HG21      VAL 108   9.853   1.013   5.014
  927   HG22  VAL 108          HG22      VAL 108   9.856   0.722   6.754
  928   HG23  VAL 108          HG23      VAL 108  11.197   1.588   6.001
  929    H    THR 109           H        THR 109  10.830  -2.883   7.642
  930    HA   THR 109           HA       THR 109  12.696  -4.736   6.886
  931    HB   THR 109           HB       THR 109  10.511  -5.241   8.913
  932    HG1  THR 109           HG1      THR 109  12.721  -4.406  10.085
  933   HG21  THR 109          HG21      THR 109  11.861  -7.221   8.390
  934   HG22  THR 109          HG22      THR 109  12.205  -6.635  10.017
  935   HG23  THR 109          HG23      THR 109  13.335  -6.304   8.703
  936    H    ASP 110           H        ASP 110   9.168  -5.160   6.865
  937    HA   ASP 110           HA       ASP 110   9.272  -7.790   5.772
  938    HB2  ASP 110           HB2      ASP 110   7.358  -6.786   7.104
  939    HB3  ASP 110           HB3      ASP 110   6.945  -5.861   5.664
  940    H    MET 111           H        MET 111   8.917  -4.541   4.484
  941    HA   MET 111           HA       MET 111   8.389  -5.081   1.804
  942    HB2  MET 111           HB2      MET 111   8.333  -2.837   2.749
  943    HB3  MET 111           HB3      MET 111  10.067  -2.888   3.032
  944    HG2  MET 111           HG2      MET 111  10.330  -3.148   0.532
  945    HG3  MET 111           HG3      MET 111   8.618  -2.743   0.409
  946    HE1  MET 111           HE1      MET 111   8.890  -0.833   3.212
  947    HE2  MET 111           HE2      MET 111   8.833   0.746   2.434
  948    HE3  MET 111           HE3      MET 111   7.727  -0.529   1.923
  949    H    LEU 112           H        LEU 112  11.521  -4.693   3.423
  950    HA   LEU 112           HA       LEU 112  13.078  -5.055   1.097
  951    HB2  LEU 112           HB2      LEU 112  13.580  -4.209   3.616
  952    HB3  LEU 112           HB3      LEU 112  14.251  -5.828   3.693
  953    HG   LEU 112           HG       LEU 112  15.643  -5.281   1.691
  954   HD11  LEU 112          HD11      LEU 112  14.587  -2.504   2.201
  955   HD12  LEU 112          HD12      LEU 112  15.910  -2.914   1.107
  956   HD13  LEU 112          HD13      LEU 112  14.279  -3.497   0.774
  957   HD21  LEU 112          HD21      LEU 112  15.979  -3.514   4.107
  958   HD22  LEU 112          HD22      LEU 112  16.573  -5.164   3.930
  959   HD23  LEU 112          HD23      LEU 112  17.231  -3.876   2.920
  960    H    MET 113           H        MET 113  11.863  -7.249   3.548
  961    HA   MET 113           HA       MET 113  13.220  -9.585   2.814
  962    HB2  MET 113           HB2      MET 113  11.760  -9.305   4.827
  963    HB3  MET 113           HB3      MET 113  10.359  -9.364   3.769
  964    HG2  MET 113           HG2      MET 113  10.944 -11.622   3.086
  965    HG3  MET 113           HG3      MET 113  12.374 -11.573   4.116
  966    HE1  MET 113           HE1      MET 113   8.044 -11.472   5.701
  967    HE2  MET 113           HE2      MET 113   8.803 -10.102   4.890
  968    HE3  MET 113           HE3      MET 113   8.462 -11.582   3.991
  969    H    THR 114           H        THR 114  10.299  -8.086   1.610
  970    HA   THR 114           HA       THR 114   9.610 -10.030  -0.312
  971    HB   THR 114           HB       THR 114   9.026  -7.069  -0.216
  972    HG1  THR 114           HG1      THR 114   7.919  -9.307   1.033
  973   HG21  THR 114          HG21      THR 114   8.648  -7.916  -2.462
  974   HG22  THR 114          HG22      THR 114   7.099  -7.611  -1.676
  975   HG23  THR 114          HG23      THR 114   7.703  -9.262  -1.822
  976    H    ILE 115           H        ILE 115  11.647  -7.105  -0.457
  977    HA   ILE 115           HA       ILE 115  11.828  -7.126  -3.308
  978    HB   ILE 115           HB       ILE 115  13.466  -5.606  -1.276
  979   HG12  ILE 115          HG12      ILE 115  11.097  -4.716  -2.940
  980   HG13  ILE 115          HG13      ILE 115  11.019  -5.140  -1.233
  981   HG21  ILE 115          HG21      ILE 115  14.054  -4.132  -3.145
  982   HG22  ILE 115          HG22      ILE 115  14.621  -5.779  -3.414
  983   HG23  ILE 115          HG23      ILE 115  13.184  -5.194  -4.253
  984   HD11  ILE 115          HD11      ILE 115  12.603  -2.874  -2.420
  985   HD12  ILE 115          HD12      ILE 115  11.080  -2.738  -1.539
  986   HD13  ILE 115          HD13      ILE 115  12.532  -3.299  -0.709
  987    H    CYS 116           H        CYS 116  14.120  -7.936  -0.686
  988    HA   CYS 116           HA       CYS 116  16.286  -8.505  -2.406
  989    HB2  CYS 116           HB2      CYS 116  15.782  -9.588   0.381
  990    HB3  CYS 116           HB3      CYS 116  17.323  -9.583  -0.467
  991    HG   CYS 116           HG       CYS 116  18.088  -7.306   0.393
  992    H    ALA 117           H        ALA 117  13.554 -10.370  -1.359
  993    HA   ALA 117           HA       ALA 117  14.559 -12.930  -2.084
  994    HB1  ALA 117           HB1      ALA 117  12.730 -12.655  -0.487
  995    HB2  ALA 117           HB2      ALA 117  11.705 -12.017  -1.772
  996    HB3  ALA 117           HB3      ALA 117  12.262 -13.689  -1.835
  997    H    ARG 118           H        ARG 118  13.059 -10.324  -3.845
  998    HA   ARG 118           HA       ARG 118  12.192 -11.853  -6.084
  999    HB2  ARG 118           HB2      ARG 118  13.030  -8.943  -6.154
 1000    HB3  ARG 118           HB3      ARG 118  11.954  -9.775  -7.267
 1001    HG2  ARG 118           HG2      ARG 118  11.395  -9.136  -4.382
 1002    HG3  ARG 118           HG3      ARG 118  10.692  -8.350  -5.793
 1003    HD2  ARG 118           HD2      ARG 118  10.334 -11.243  -5.027
 1004    HD3  ARG 118           HD3      ARG 118   9.163  -9.952  -4.769
 1005    HE   ARG 118           HE       ARG 118   9.658  -9.911  -7.464
 1006   HH11  ARG 118          HH11      ARG 118   8.587 -12.350  -5.188
 1007   HH12  ARG 118          HH12      ARG 118   7.552 -13.148  -6.335
 1008   HH21  ARG 118          HH21      ARG 118   8.319 -10.972  -8.975
 1009   HH22  ARG 118          HH22      ARG 118   7.428 -12.384  -8.496
 1010    H    ILE 119           H        ILE 119  15.192 -10.258  -5.200
 1011    HA   ILE 119           HA       ILE 119  16.484 -10.741  -7.714
 1012    HB   ILE 119           HB       ILE 119  17.986 -10.292  -5.159
 1013   HG12  ILE 119          HG12      ILE 119  16.084  -8.729  -5.110
 1014   HG13  ILE 119          HG13      ILE 119  17.617  -7.888  -5.318
 1015   HG21  ILE 119          HG21      ILE 119  19.248 -10.635  -7.203
 1016   HG22  ILE 119          HG22      ILE 119  18.365  -9.327  -7.989
 1017   HG23  ILE 119          HG23      ILE 119  19.441  -8.977  -6.637
 1018   HD11  ILE 119          HD11      ILE 119  15.600  -8.490  -7.468
 1019   HD12  ILE 119          HD12      ILE 119  15.923  -6.918  -6.735
 1020   HD13  ILE 119          HD13      ILE 119  17.157  -7.701  -7.724
 1021    H    GLY 120           H        GLY 120  16.381 -12.246  -4.539
 1022    HA2  GLY 120           HA2      GLY 120  16.614 -14.698  -4.490
 1023    HA3  GLY 120           HA3      GLY 120  17.934 -14.499  -5.633
 1024    H    ILE 121           H        ILE 121  17.789 -12.077  -3.280
 1025    HA   ILE 121           HA       ILE 121  20.247 -12.944  -2.075
 1026    HB   ILE 121           HB       ILE 121  18.466 -10.672  -1.183
 1027   HG12  ILE 121          HG12      ILE 121  20.732 -10.577  -3.186
 1028   HG13  ILE 121          HG13      ILE 121  19.023 -10.475  -3.598
 1029   HG21  ILE 121          HG21      ILE 121  20.561  -9.728  -0.316
 1030   HG22  ILE 121          HG22      ILE 121  20.176 -11.283   0.417
 1031   HG23  ILE 121          HG23      ILE 121  21.414 -11.182  -0.833
 1032   HD11  ILE 121          HD11      ILE 121  20.560  -8.503  -1.915
 1033   HD12  ILE 121          HD12      ILE 121  20.054  -8.278  -3.589
 1034   HD13  ILE 121          HD13      ILE 121  18.845  -8.401  -2.311
 1035    H    THR 122           H        THR 122  20.487 -14.037  -0.202
 1036    HA   THR 122           HA       THR 122  18.061 -15.119   0.989
 1037    HB   THR 122           HB       THR 122  19.937 -16.610   0.312
 1038    HG1  THR 122           HG1      THR 122  19.587 -16.729   3.128
 1039   HG21  THR 122          HG21      THR 122  21.817 -15.182   0.923
 1040   HG22  THR 122          HG22      THR 122  21.931 -16.740   1.744
 1041   HG23  THR 122          HG23      THR 122  21.383 -15.314   2.626
 1042    H    ASN 123           H        ASN 123  19.292 -12.342   1.509
 1043    HA   ASN 123           HA       ASN 123  18.859 -12.370   4.384
 1044    HB2  ASN 123           HB2      ASN 123  21.336 -12.659   4.001
 1045    HB3  ASN 123           HB3      ASN 123  21.337 -11.109   3.174
 1046   HD21  ASN 123          HD21      ASN 123  22.767 -11.961   5.554
 1047   HD22  ASN 123          HD22      ASN 123  22.321 -10.855   6.801
 1048    H    HIS 124           H        HIS 124  17.853 -10.517   5.061
 1049    HA   HIS 124           HA       HIS 124  17.787  -8.246   3.195
 1050    HB2  HIS 124           HB2      HIS 124  15.407  -7.975   3.415
 1051    HB3  HIS 124           HB3      HIS 124  15.721  -9.627   2.901
 1052    HD1  HIS 124           HD1      HIS 124  14.176  -7.635   5.594
 1053    HD2  HIS 124           HD2      HIS 124  15.284 -11.592   4.951
 1054    HE1  HIS 124           HE1      HIS 124  12.968  -8.968   7.337
 1055    HE2  HIS 124           HE2      HIS 124  13.795 -11.334   7.050
 1056    H    ASP 125           H        ASP 125  18.589  -9.275   6.158
 1057    HA   ASP 125           HA       ASP 125  17.518  -6.983   7.616
 1058    HB2  ASP 125           HB2      ASP 125  18.847  -9.542   8.469
 1059    HB3  ASP 125           HB3      ASP 125  18.679  -8.186   9.581
 1060    H    GLU 126           H        GLU 126  20.332  -8.156   6.069
 1061    HA   GLU 126           HA       GLU 126  22.168  -6.522   7.547
 1062    HB2  GLU 126           HB2      GLU 126  23.844  -7.209   5.925
 1063    HB3  GLU 126           HB3      GLU 126  22.956  -8.593   6.545
 1064    HG2  GLU 126           HG2      GLU 126  21.777  -8.872   4.548
 1065    HG3  GLU 126           HG3      GLU 126  22.226  -7.275   3.964
 1066    H    TYR 127           H        TYR 127  19.769  -5.624   5.676
 1067    HA   TYR 127           HA       TYR 127  21.284  -3.511   4.299
 1068    HB2  TYR 127           HB2      TYR 127  18.709  -4.805   3.399
 1069    HB3  TYR 127           HB3      TYR 127  19.570  -3.521   2.556
 1070    HD1  TYR 127           HD1      TYR 127  22.113  -4.119   2.045
 1071    HD2  TYR 127           HD2      TYR 127  19.004  -6.942   2.670
 1072    HE1  TYR 127           HE1      TYR 127  23.408  -5.797   0.815
 1073    HE2  TYR 127           HE2      TYR 127  20.278  -8.635   1.455
 1074    HH   TYR 127           HH       TYR 127  22.041  -8.742  -0.240
 1075    H    SER 128           H        SER 128  20.510  -1.454   4.349
 1076    HA   SER 128           HA       SER 128  17.993  -0.968   5.786
 1077    HB2  SER 128           HB2      SER 128  18.955   1.421   5.896
 1078    HB3  SER 128           HB3      SER 128  19.721   0.206   6.920
 1079    HG   SER 128           HG       SER 128  21.374   1.239   5.905
 1080    H    LEU 129           H        LEU 129  17.022   1.277   4.782
 1081    HA   LEU 129           HA       LEU 129  17.242   0.954   1.861
 1082    HB2  LEU 129           HB2      LEU 129  15.044   0.213   3.181
 1083    HB3  LEU 129           HB3      LEU 129  14.679   1.920   3.036
 1084    HG   LEU 129           HG       LEU 129  15.375   0.246   0.628
 1085   HD11  LEU 129          HD11      LEU 129  13.480  -0.814   1.729
 1086   HD12  LEU 129          HD12      LEU 129  12.639   0.735   1.790
 1087   HD13  LEU 129          HD13      LEU 129  12.982  -0.022   0.234
 1088   HD21  LEU 129          HD21      LEU 129  15.470   2.655   0.319
 1089   HD22  LEU 129          HD22      LEU 129  14.103   1.972  -0.556
 1090   HD23  LEU 129          HD23      LEU 129  13.841   2.819   0.969
 1091    H    VAL 130           H        VAL 130  17.201   2.848   0.636
 1092    HA   VAL 130           HA       VAL 130  16.974   5.366   2.102
 1093    HB   VAL 130           HB       VAL 130  19.344   5.012   2.083
 1094   HG11  VAL 130          HG11      VAL 130  19.466   3.316   0.374
 1095   HG12  VAL 130          HG12      VAL 130  19.105   4.517  -0.866
 1096   HG13  VAL 130          HG13      VAL 130  20.611   4.617   0.042
 1097   HG21  VAL 130          HG21      VAL 130  20.162   6.877   0.729
 1098   HG22  VAL 130          HG22      VAL 130  18.626   6.916  -0.137
 1099   HG23  VAL 130          HG23      VAL 130  18.677   7.287   1.586
 1100    H    ARG 131           H        ARG 131  15.485   6.537   1.138
 1101    HA   ARG 131           HA       ARG 131  14.801   5.932  -1.655
 1102    HB2  ARG 131           HB2      ARG 131  13.226   7.570   0.326
 1103    HB3  ARG 131           HB3      ARG 131  12.662   6.911  -1.200
 1104    HG2  ARG 131           HG2      ARG 131  12.919   4.643  -0.276
 1105    HG3  ARG 131           HG3      ARG 131  13.374   5.361   1.274
 1106    HD2  ARG 131           HD2      ARG 131  11.057   4.884   1.415
 1107    HD3  ARG 131           HD3      ARG 131  11.215   6.633   1.198
 1108    HE   ARG 131           HE       ARG 131  10.511   6.358  -1.081
 1109   HH11  ARG 131          HH11      ARG 131  10.154   3.513   0.921
 1110   HH12  ARG 131          HH12      ARG 131   8.962   2.777  -0.096
 1111   HH21  ARG 131          HH21      ARG 131   8.915   5.401  -2.438
 1112   HH22  ARG 131          HH22      ARG 131   8.261   3.853  -2.013
 1113    H    GLU 132           H        GLU 132  16.128   7.223  -2.884
 1114    HA   GLU 132           HA       GLU 132  16.429   9.997  -2.329
 1115    HB2  GLU 132           HB2      GLU 132  16.899   8.413  -4.872
 1116    HB3  GLU 132           HB3      GLU 132  17.267  10.127  -4.710
 1117    HG2  GLU 132           HG2      GLU 132  18.786   9.496  -2.804
 1118    HG3  GLU 132           HG3      GLU 132  18.539   7.814  -3.280
 1119    H    LEU 133           H        LEU 133  14.668  11.248  -2.276
 1120    HA   LEU 133           HA       LEU 133  12.589  10.770  -4.277
 1121    HB2  LEU 133           HB2      LEU 133  12.351  12.658  -1.959
 1122    HB3  LEU 133           HB3      LEU 133  11.075  11.983  -2.936
 1123    HG   LEU 133           HG       LEU 133  12.687  10.571  -0.826
 1124   HD11  LEU 133          HD11      LEU 133  10.434  10.250   0.168
 1125   HD12  LEU 133          HD12      LEU 133  10.906  11.946   0.040
 1126   HD13  LEU 133          HD13      LEU 133   9.767  11.260  -1.119
 1127   HD21  LEU 133          HD21      LEU 133  10.632   9.409  -2.702
 1128   HD22  LEU 133          HD22      LEU 133  12.360   9.051  -2.706
 1129   HD23  LEU 133          HD23      LEU 133  11.365   8.582  -1.327
 1130    H    MET 134           H        MET 134  11.360  12.863  -4.711
 1131    HA   MET 134           HA       MET 134  13.239  14.919  -5.686
 1132    HB2  MET 134           HB2      MET 134  11.356  15.528  -7.207
 1133    HB3  MET 134           HB3      MET 134  11.888  13.864  -7.430
 1134    HG2  MET 134           HG2      MET 134   9.618  13.583  -7.396
 1135    HG3  MET 134           HG3      MET 134  10.020  13.333  -5.700
 1136    HE1  MET 134           HE1      MET 134   7.734  13.799  -4.645
 1137    HE2  MET 134           HE2      MET 134   6.647  15.086  -5.169
 1138    HE3  MET 134           HE3      MET 134   7.087  13.795  -6.286
 1139    H    GLU 135           H        GLU 135  11.680  14.287  -3.078
 1140    HA   GLU 135           HA       GLU 135   9.531  15.712  -2.479
 1141    HB2  GLU 135           HB2      GLU 135  11.657  14.565  -1.002
 1142    HB3  GLU 135           HB3      GLU 135  11.291  16.128  -0.285
 1143    HG2  GLU 135           HG2      GLU 135   9.228  14.023  -0.860
 1144    HG3  GLU 135           HG3      GLU 135  10.041  14.216   0.692
 1145    H    GLU 136           H        GLU 136   8.884  17.648  -2.728
 1146    HA   GLU 136           HA       GLU 136  10.565  19.857  -3.293
 1147    HB2  GLU 136           HB2      GLU 136   8.448  21.128  -3.296
 1148    HB3  GLU 136           HB3      GLU 136   8.323  19.639  -4.228
 1149    HG2  GLU 136           HG2      GLU 136   7.221  18.555  -2.320
 1150    HG3  GLU 136           HG3      GLU 136   7.299  20.075  -1.434
 1151    H    LYS 137           H        LYS 137   9.472  18.438  -0.410
 1152    HA   LYS 137           HA       LYS 137   9.873  20.893   1.138
 1153    HB2  LYS 137           HB2      LYS 137   8.762  18.214   1.990
 1154    HB3  LYS 137           HB3      LYS 137   8.830  19.661   2.987
 1155    HG2  LYS 137           HG2      LYS 137   7.190  20.749   1.724
 1156    HG3  LYS 137           HG3      LYS 137   7.360  19.622   0.378
 1157    HD2  LYS 137           HD2      LYS 137   6.475  17.823   1.834
 1158    HD3  LYS 137           HD3      LYS 137   6.201  19.028   3.096
 1159    HE2  LYS 137           HE2      LYS 137   4.573  20.148   1.810
 1160    HE3  LYS 137           HE3      LYS 137   5.035  19.293   0.338
 1161    HZ1  LYS 137           HZ1      LYS 137   3.820  18.000   2.721
 1162    HZ2  LYS 137           HZ2      LYS 137   4.155  17.271   1.227
 1163    HZ3  LYS 137           HZ3      LYS 137   2.960  18.466   1.335
 1164    H    LYS 138           H        LYS 138  10.629  17.438   1.541
 1165    HA   LYS 138           HA       LYS 138  12.722  17.875   3.382
 1166    HB2  LYS 138           HB2      LYS 138  12.333  15.452   1.634
 1167    HB3  LYS 138           HB3      LYS 138  13.159  15.526   3.184
 1168    HG2  LYS 138           HG2      LYS 138  11.065  16.005   4.298
 1169    HG3  LYS 138           HG3      LYS 138  10.221  15.988   2.750
 1170    HD2  LYS 138           HD2      LYS 138  10.919  13.644   2.433
 1171    HD3  LYS 138           HD3      LYS 138  11.658  13.677   4.038
 1172    HE2  LYS 138           HE2      LYS 138   9.559  12.758   4.420
 1173    HE3  LYS 138           HE3      LYS 138   9.383  14.461   4.851
 1174    HZ1  LYS 138           HZ1      LYS 138   8.398  13.099   2.423
 1175    HZ2  LYS 138           HZ2      LYS 138   8.519  14.787   2.525
 1176    HZ3  LYS 138           HZ3      LYS 138   7.509  13.943   3.591
 1177    H    ASP 169           H        ASP 169  12.932  16.662   0.028
 1178    HA   ASP 169           HA       ASP 169  14.730  16.118  -1.236
 1179    HB2  ASP 169           HB2      ASP 169  14.894  18.564  -1.508
 1180    HB3  ASP 169           HB3      ASP 169  15.898  18.658  -0.063
 1181    H    GLU 170           H        GLU 170  14.759  14.386   0.426
 1182    HA   GLU 170           HA       GLU 170  17.388  14.361   1.737
 1183    HB2  GLU 170           HB2      GLU 170  14.801  13.175   2.753
 1184    HB3  GLU 170           HB3      GLU 170  16.378  12.859   3.459
 1185    HG2  GLU 170           HG2      GLU 170  16.612  15.253   3.954
 1186    HG3  GLU 170           HG3      GLU 170  14.996  15.525   3.302
 1187    H    LEU 171           H        LEU 171  18.212  12.193   2.138
 1188    HA   LEU 171           HA       LEU 171  17.947  10.457  -0.136
 1189    HB2  LEU 171           HB2      LEU 171  19.343   9.914   2.487
 1190    HB3  LEU 171           HB3      LEU 171  19.613   9.097   0.959
 1191    HG   LEU 171           HG       LEU 171  20.282  11.961   1.577
 1192   HD11  LEU 171          HD11      LEU 171  22.605  11.220   1.376
 1193   HD12  LEU 171          HD12      LEU 171  21.770  10.377   2.681
 1194   HD13  LEU 171          HD13      LEU 171  22.055   9.560   1.144
 1195   HD21  LEU 171          HD21      LEU 171  21.375  11.935  -0.630
 1196   HD22  LEU 171          HD22      LEU 171  20.723  10.319  -0.914
 1197   HD23  LEU 171          HD23      LEU 171  19.629  11.696  -0.745
 1198    H    ASN 172           H        ASN 172  16.487  10.847   2.895
 1199    HA   ASN 172           HA       ASN 172  15.027   9.646   4.147
 1200    HB2  ASN 172           HB2      ASN 172  14.252   8.730   1.379
 1201    HB3  ASN 172           HB3      ASN 172  13.302   8.396   2.810
 1202   HD21  ASN 172          HD21      ASN 172  14.016  10.561   0.377
 1203   HD22  ASN 172          HD22      ASN 172  13.067  11.903   0.925
 1204    H    TRP 173           H        TRP 173  16.763   8.357   5.142
 1205    HA   TRP 173           HA       TRP 173  17.202   5.708   4.042
 1206    HB2  TRP 173           HB2      TRP 173  18.286   7.210   6.424
 1207    HB3  TRP 173           HB3      TRP 173  18.564   5.485   6.218
 1208    HD1  TRP 173           HD1      TRP 173  19.340   8.837   4.450
 1209    HE1  TRP 173           HE1      TRP 173  21.515   8.547   3.125
 1210    HE3  TRP 173           HE3      TRP 173  20.108   3.844   5.236
 1211    HZ2  TRP 173           HZ2      TRP 173  23.330   6.478   2.490
 1212    HZ3  TRP 173           HZ3      TRP 173  22.093   2.788   4.236
 1213    HH2  TRP 173           HH2      TRP 173  23.669   4.079   2.893
 1214    H    LEU 174           H        LEU 174  15.545   4.336   4.355
 1215    HA   LEU 174           HA       LEU 174  13.559   4.770   6.326
 1216    HB2  LEU 174           HB2      LEU 174  14.079   2.346   4.614
 1217    HB3  LEU 174           HB3      LEU 174  12.663   2.580   5.618
 1218    HG   LEU 174           HG       LEU 174  13.393   3.908   3.049
 1219   HD11  LEU 174          HD11      LEU 174  10.968   3.449   2.648
 1220   HD12  LEU 174          HD12      LEU 174  11.956   2.012   2.921
 1221   HD13  LEU 174          HD13      LEU 174  10.929   2.631   4.215
 1222   HD21  LEU 174          HD21      LEU 174  11.458   5.501   3.564
 1223   HD22  LEU 174          HD22      LEU 174  11.737   5.084   5.256
 1224   HD23  LEU 174          HD23      LEU 174  13.018   5.846   4.316
 1225    H    ASP 175           H        ASP 175  13.279   4.021   8.248
 1226    HA   ASP 175           HA       ASP 175  15.559   2.931   9.635
 1227    HB2  ASP 175           HB2      ASP 175  14.384   3.521  11.628
 1228    HB3  ASP 175           HB3      ASP 175  14.070   4.810  10.469
 1229    H    HIS 176           H        HIS 176  12.911   1.604   8.108
 1230    HA   HIS 176           HA       HIS 176  12.017  -0.475   8.016
 1231    HB2  HIS 176           HB2      HIS 176  14.296  -1.130   9.874
 1232    HB3  HIS 176           HB3      HIS 176  13.132  -2.338   9.338
 1233    HD1  HIS 176           HD1      HIS 176  13.059  -2.752   6.698
 1234    HD2  HIS 176           HD2      HIS 176  16.338  -0.651   8.123
 1235    HE1  HIS 176           HE1      HIS 176  14.703  -2.731   4.810
 1236    HE2  HIS 176           HE2      HIS 176  16.802  -1.785   5.845
 1237    H    GLY 177           H        GLY 177  10.907   1.471   9.639
 1238    HA2  GLY 177           HA2      GLY 177   9.345  -0.273  11.380
 1239    HA3  GLY 177           HA3      GLY 177  10.200   1.034  12.186
 1240    H    ARG 178           H        ARG 178   9.928   2.970  10.150
 1241    HA   ARG 178           HA       ARG 178   7.213   3.809  10.685
 1242    HB2  ARG 178           HB2      ARG 178   9.042   5.397  10.911
 1243    HB3  ARG 178           HB3      ARG 178   9.511   5.140   9.238
 1244    HG2  ARG 178           HG2      ARG 178   7.611   6.254   8.421
 1245    HG3  ARG 178           HG3      ARG 178   6.821   6.223  10.006
 1246    HD2  ARG 178           HD2      ARG 178   7.700   8.445   9.538
 1247    HD3  ARG 178           HD3      ARG 178   8.551   7.714  10.897
 1248    HE   ARG 178           HE       ARG 178   9.867   7.296   8.379
 1249   HH11  ARG 178          HH11      ARG 178   9.514   9.463  11.104
 1250   HH12  ARG 178          HH12      ARG 178  10.986  10.325  10.777
 1251   HH21  ARG 178          HH21      ARG 178  11.796   8.416   7.935
 1252   HH22  ARG 178          HH22      ARG 178  12.299   9.719   8.968
 1253    H    THR 179           H        THR 179   5.575   4.105   9.174
 1254    HA   THR 179           HA       THR 179   5.818   2.481   6.804
 1255    HB   THR 179           HB       THR 179   3.721   2.442   8.075
 1256    HG1  THR 179           HG1      THR 179   3.209   1.867   6.076
 1257   HG21  THR 179          HG21      THR 179   3.637   4.768   8.807
 1258   HG22  THR 179          HG22      THR 179   2.154   4.326   7.961
 1259   HG23  THR 179          HG23      THR 179   3.382   5.292   7.143
 1260    H    LEU 180           H        LEU 180   4.613   3.531   4.782
 1261    HA   LEU 180           HA       LEU 180   6.683   5.375   3.946
 1262    HB2  LEU 180           HB2      LEU 180   4.557   4.157   2.213
 1263    HB3  LEU 180           HB3      LEU 180   6.168   4.690   1.756
 1264    HG   LEU 180           HG       LEU 180   5.505   2.288   3.458
 1265   HD11  LEU 180          HD11      LEU 180   5.009   1.965   1.108
 1266   HD12  LEU 180          HD12      LEU 180   6.636   2.492   0.679
 1267   HD13  LEU 180          HD13      LEU 180   6.404   1.005   1.600
 1268   HD21  LEU 180          HD21      LEU 180   8.199   3.283   2.533
 1269   HD22  LEU 180          HD22      LEU 180   7.579   3.390   4.185
 1270   HD23  LEU 180          HD23      LEU 180   7.881   1.809   3.451
 1271    H    ARG 181           H        ARG 181   3.139   5.250   3.959
 1272    HA   ARG 181           HA       ARG 181   2.663   7.746   2.788
 1273    HB2  ARG 181           HB2      ARG 181   1.123   5.996   4.659
 1274    HB3  ARG 181           HB3      ARG 181   0.529   7.611   4.298
 1275    HG2  ARG 181           HG2      ARG 181   0.269   7.109   2.009
 1276    HG3  ARG 181           HG3      ARG 181   1.196   5.613   2.159
 1277    HD2  ARG 181           HD2      ARG 181  -1.403   6.122   3.590
 1278    HD3  ARG 181           HD3      ARG 181  -1.282   5.309   2.027
 1279    HE   ARG 181           HE       ARG 181  -0.023   3.557   3.087
 1280   HH11  ARG 181          HH11      ARG 181  -1.783   5.715   5.230
 1281   HH12  ARG 181          HH12      ARG 181  -1.638   4.663   6.602
 1282   HH21  ARG 181          HH21      ARG 181   0.182   2.198   4.889
 1283   HH22  ARG 181          HH22      ARG 181  -0.497   2.664   6.420
 1284    H    GLU 182           H        GLU 182   3.546   6.862   6.041
 1285    HA   GLU 182           HA       GLU 182   2.877   9.354   7.259
 1286    HB2  GLU 182           HB2      GLU 182   3.171   7.100   8.406
 1287    HB3  GLU 182           HB3      GLU 182   4.903   7.331   8.227
 1288    HG2  GLU 182           HG2      GLU 182   4.294   7.961  10.431
 1289    HG3  GLU 182           HG3      GLU 182   4.698   9.428   9.539
 1290    H    GLN 183           H        GLN 183   5.434   8.271   5.283
 1291    HA   GLN 183           HA       GLN 183   7.243  10.390   6.195
 1292    HB2  GLN 183           HB2      GLN 183   7.758   8.099   4.291
 1293    HB3  GLN 183           HB3      GLN 183   8.958   9.241   4.879
 1294    HG2  GLN 183           HG2      GLN 183   8.580   8.453   7.160
 1295    HG3  GLN 183           HG3      GLN 183   7.404   7.291   6.553
 1296   HE21  GLN 183          HE21      GLN 183   8.114   5.515   5.391
 1297   HE22  GLN 183          HE22      GLN 183   9.758   4.987   5.445
 1298    H    GLY 184           H        GLY 184   4.890   9.837   3.896
 1299    HA2  GLY 184           HA2      GLY 184   4.237  10.995   2.024
 1300    HA3  GLY 184           HA3      GLY 184   5.353  12.256   2.527
 1301    H    VAL 185           H        VAL 185   6.061   8.903   1.659
 1302    HA   VAL 185           HA       VAL 185   7.862   9.890  -0.427
 1303    HB   VAL 185           HB       VAL 185   8.852   7.648  -0.408
 1304   HG11  VAL 185          HG11      VAL 185   9.729   9.333   1.118
 1305   HG12  VAL 185          HG12      VAL 185   8.574   8.831   2.352
 1306   HG13  VAL 185          HG13      VAL 185   9.840   7.723   1.828
 1307   HG21  VAL 185          HG21      VAL 185   6.864   6.350   0.147
 1308   HG22  VAL 185          HG22      VAL 185   8.176   5.994   1.269
 1309   HG23  VAL 185          HG23      VAL 185   6.849   7.044   1.768
 1310    H    GLU 186           H        GLU 186   7.717   9.153  -2.570
 1311    HA   GLU 186           HA       GLU 186   5.052   8.205  -3.263
 1312    HB2  GLU 186           HB2      GLU 186   7.125   9.748  -4.816
 1313    HB3  GLU 186           HB3      GLU 186   5.722   9.022  -5.582
 1314    HG2  GLU 186           HG2      GLU 186   5.646  11.061  -3.377
 1315    HG3  GLU 186           HG3      GLU 186   5.390  11.387  -5.090
 1316    H    GLU 187           H        GLU 187   5.238   7.204  -5.633
 1317    HA   GLU 187           HA       GLU 187   6.638   4.678  -5.193
 1318    HB2  GLU 187           HB2      GLU 187   4.643   5.463  -7.309
 1319    HB3  GLU 187           HB3      GLU 187   5.142   3.832  -6.888
 1320    HG2  GLU 187           HG2      GLU 187   3.778   3.730  -5.102
 1321    HG3  GLU 187           HG3      GLU 187   4.001   5.434  -4.703
 1322    H    HIS 188           H        HIS 188   6.352   7.318  -7.488
 1323    HA   HIS 188           HA       HIS 188   7.969   6.183  -9.528
 1324    HB2  HIS 188           HB2      HIS 188   7.968   8.488 -10.479
 1325    HB3  HIS 188           HB3      HIS 188   6.361   7.880 -10.099
 1326    HD1  HIS 188           HD1      HIS 188   4.920   9.388  -8.757
 1327    HD2  HIS 188           HD2      HIS 188   8.952  10.344  -8.387
 1328    HE1  HIS 188           HE1      HIS 188   5.011  11.459  -7.328
 1329    HE2  HIS 188           HE2      HIS 188   7.427  12.156  -7.361
 1330    H    GLU 189           H        GLU 189   8.893   7.115  -6.558
 1331    HA   GLU 189           HA       GLU 189  11.296   8.580  -7.219
 1332    HB2  GLU 189           HB2      GLU 189  10.421   7.384  -4.586
 1333    HB3  GLU 189           HB3      GLU 189  11.663   8.606  -4.822
 1334    HG2  GLU 189           HG2      GLU 189   8.790   9.039  -5.573
 1335    HG3  GLU 189           HG3      GLU 189   9.433   9.416  -3.977
 1336    H    THR 190           H        THR 190  13.360   7.722  -7.336
 1337    HA   THR 190           HA       THR 190  13.636   4.877  -7.408
 1338    HB   THR 190           HB       THR 190  15.837   6.950  -7.483
 1339    HG1  THR 190           HG1      THR 190  14.738   7.463  -9.263
 1340   HG21  THR 190          HG21      THR 190  15.728   4.091  -8.472
 1341   HG22  THR 190          HG22      THR 190  16.630   4.666  -7.072
 1342   HG23  THR 190          HG23      THR 190  17.080   5.201  -8.690
 1343    H    LEU 191           H        LEU 191  14.051   3.578  -5.794
 1344    HA   LEU 191           HA       LEU 191  15.118   4.716  -3.289
 1345    HB2  LEU 191           HB2      LEU 191  13.638   2.098  -3.513
 1346    HB3  LEU 191           HB3      LEU 191  14.002   3.003  -2.062
 1347    HG   LEU 191           HG       LEU 191  11.767   3.411  -2.248
 1348   HD11  LEU 191          HD11      LEU 191  12.849   5.574  -2.230
 1349   HD12  LEU 191          HD12      LEU 191  12.897   5.584  -3.992
 1350   HD13  LEU 191          HD13      LEU 191  11.347   5.633  -3.152
 1351   HD21  LEU 191          HD21      LEU 191  10.535   3.674  -4.341
 1352   HD22  LEU 191          HD22      LEU 191  12.038   3.476  -5.243
 1353   HD23  LEU 191          HD23      LEU 191  11.411   2.143  -4.275
 1354    H    LEU 192           H        LEU 192  16.979   3.739  -2.411
 1355    HA   LEU 192           HA       LEU 192  18.224   1.794  -4.236
 1356    HB2  LEU 192           HB2      LEU 192  19.791   3.482  -2.335
 1357    HB3  LEU 192           HB3      LEU 192  20.275   2.809  -3.877
 1358    HG   LEU 192           HG       LEU 192  18.307   5.078  -3.608
 1359   HD11  LEU 192          HD11      LEU 192  20.127   6.554  -4.224
 1360   HD12  LEU 192          HD12      LEU 192  20.478   5.728  -2.706
 1361   HD13  LEU 192          HD13      LEU 192  21.255   5.197  -4.198
 1362   HD21  LEU 192          HD21      LEU 192  19.883   4.064  -5.974
 1363   HD22  LEU 192          HD22      LEU 192  18.162   3.793  -5.692
 1364   HD23  LEU 192          HD23      LEU 192  18.760   5.430  -5.966
 1365    H    LEU 193           H        LEU 193  18.858  -0.130  -3.406
 1366    HA   LEU 193           HA       LEU 193  18.429  -0.641  -0.600
 1367    HB2  LEU 193           HB2      LEU 193  17.790  -2.236  -2.413
 1368    HB3  LEU 193           HB3      LEU 193  19.489  -2.460  -2.771
 1369    HG   LEU 193           HG       LEU 193  18.558  -3.024   0.006
 1370   HD11  LEU 193          HD11      LEU 193  16.880  -4.107  -1.403
 1371   HD12  LEU 193          HD12      LEU 193  18.162  -4.882  -2.336
 1372   HD13  LEU 193          HD13      LEU 193  17.936  -5.294  -0.637
 1373   HD21  LEU 193          HD21      LEU 193  20.932  -3.168  -0.579
 1374   HD22  LEU 193          HD22      LEU 193  20.273  -4.745  -0.143
 1375   HD23  LEU 193          HD23      LEU 193  20.547  -4.345  -1.837
 1376    H    ARG 194           H        ARG 194  19.934  -0.465   0.907
 1377    HA   ARG 194           HA       ARG 194  22.771  -0.379   0.111
 1378    HB2  ARG 194           HB2      ARG 194  21.359   1.207   2.269
 1379    HB3  ARG 194           HB3      ARG 194  23.098   1.172   2.039
 1380    HG2  ARG 194           HG2      ARG 194  21.122   2.170   0.005
 1381    HG3  ARG 194           HG3      ARG 194  22.009   3.190   1.137
 1382    HD2  ARG 194           HD2      ARG 194  23.125   1.493  -1.083
 1383    HD3  ARG 194           HD3      ARG 194  23.148   3.255  -0.950
 1384    HE   ARG 194           HE       ARG 194  24.495   1.963   1.232
 1385   HH11  ARG 194          HH11      ARG 194  24.839   3.072  -2.077
 1386   HH12  ARG 194          HH12      ARG 194  26.574   3.155  -1.998
 1387   HH21  ARG 194          HH21      ARG 194  26.765   2.081   1.339
 1388   HH22  ARG 194          HH22      ARG 194  27.675   2.602  -0.050
 1389    H    ARG 195           H        ARG 195  24.219  -1.432   1.525
 1390    HA   ARG 195           HA       ARG 195  22.862  -3.195   3.409
 1391    HB2  ARG 195           HB2      ARG 195  24.775  -4.573   3.415
 1392    HB3  ARG 195           HB3      ARG 195  24.477  -4.133   1.744
 1393    HG2  ARG 195           HG2      ARG 195  26.251  -2.352   2.043
 1394    HG3  ARG 195           HG3      ARG 195  26.647  -3.153   3.567
 1395    HD2  ARG 195           HD2      ARG 195  27.016  -4.089   0.769
 1396    HD3  ARG 195           HD3      ARG 195  28.095  -4.227   2.155
 1397    HE   ARG 195           HE       ARG 195  26.144  -5.880   2.900
 1398   HH11  ARG 195          HH11      ARG 195  27.727  -5.506  -0.208
 1399   HH12  ARG 195          HH12      ARG 195  27.497  -7.167  -0.676
 1400   HH21  ARG 195          HH21      ARG 195  25.774  -8.050   2.271
 1401   HH22  ARG 195          HH22      ARG 195  26.391  -8.620   0.736
 1402    H    LYS 196           H        LYS 196  22.943  -3.012   5.483
 1403    HA   LYS 196           HA       LYS 196  24.300  -0.711   6.645
 1404    HB2  LYS 196           HB2      LYS 196  21.915  -1.050   7.111
 1405    HB3  LYS 196           HB3      LYS 196  22.254  -2.641   7.769
 1406    HG2  LYS 196           HG2      LYS 196  23.447  -1.673   9.621
 1407    HG3  LYS 196           HG3      LYS 196  23.269  -0.058   8.933
 1408    HD2  LYS 196           HD2      LYS 196  21.646  -0.518  10.743
 1409    HD3  LYS 196           HD3      LYS 196  20.871  -0.163   9.198
 1410    HE2  LYS 196           HE2      LYS 196  20.515  -2.538   8.811
 1411    HE3  LYS 196           HE3      LYS 196  21.341  -2.922  10.320
 1412    HZ1  LYS 196           HZ1      LYS 196  18.919  -2.975  10.538
 1413    HZ2  LYS 196           HZ2      LYS 196  18.836  -1.336  10.104
 1414    HZ3  LYS 196           HZ3      LYS 196  19.614  -1.798  11.540
 1415    H    PHE 197           H        PHE 197  24.509  -4.105   6.405
 1416    HA   PHE 197           HA       PHE 197  26.746  -4.143   8.327
 1417    HB2  PHE 197           HB2      PHE 197  25.011  -6.467   7.466
 1418    HB3  PHE 197           HB3      PHE 197  26.346  -6.541   8.604
 1419    HD1  PHE 197           HD1      PHE 197  22.937  -5.333   8.067
 1420    HD2  PHE 197           HD2      PHE 197  26.046  -5.928  10.886
 1421    HE1  PHE 197           HE1      PHE 197  21.314  -5.021   9.878
 1422    HE2  PHE 197           HE2      PHE 197  24.445  -5.580  12.728
 1423    HZ   PHE 197           HZ       PHE 197  22.076  -5.127  12.228
 1424    H    PHE 198           H        PHE 198  28.462  -5.696   7.692
 1425    HA   PHE 198           HA       PHE 198  28.654  -5.943   4.768
 1426    HB2  PHE 198           HB2      PHE 198  30.783  -5.669   6.884
 1427    HB3  PHE 198           HB3      PHE 198  31.154  -6.274   5.272
 1428    HD1  PHE 198           HD1      PHE 198  29.819  -3.359   7.125
 1429    HD2  PHE 198           HD2      PHE 198  31.425  -4.810   3.461
 1430    HE1  PHE 198           HE1      PHE 198  30.022  -1.049   6.304
 1431    HE2  PHE 198           HE2      PHE 198  31.631  -2.502   2.632
 1432    HZ   PHE 198           HZ       PHE 198  30.929  -0.619   4.055
 1433    H    TYR 199           H        TYR 199  27.143  -7.750   5.280
 1434    HA   TYR 199           HA       TYR 199  28.184 -10.102   6.519
 1435    HB2  TYR 199           HB2      TYR 199  25.679  -9.292   5.237
 1436    HB3  TYR 199           HB3      TYR 199  26.098 -10.983   4.992
 1437    HD1  TYR 199           HD1      TYR 199  26.262 -12.501   6.888
 1438    HD2  TYR 199           HD2      TYR 199  25.074  -8.450   7.373
 1439    HE1  TYR 199           HE1      TYR 199  25.411 -13.037   9.134
 1440    HE2  TYR 199           HE2      TYR 199  24.216  -8.969   9.629
 1441    HH   TYR 199           HH       TYR 199  23.347 -11.089  10.824
 1442    H    SER 200           H        SER 200  26.756 -10.145   3.323
 1443    HA   SER 200           HA       SER 200  27.362 -11.174   1.388
 1444    HB2  SER 200           HB2      SER 200  29.271  -9.462   1.736
 1445    HB3  SER 200           HB3      SER 200  30.238 -10.853   2.215
 1446    HG   SER 200           HG       SER 200  30.235 -11.598   0.200
 1447    H    ASP 201           H        ASP 201  26.896 -12.671   3.758
 1448    HA   ASP 201           HA       ASP 201  27.064 -14.715   4.710
 1449    HB2  ASP 201           HB2      ASP 201  26.475 -15.369   2.390
 1450    HB3  ASP 201           HB3      ASP 201  28.186 -15.488   2.005
 1451    H    GLN 202           H        GLN 202  29.366 -12.867   4.899
 1452    HA   GLN 202           HA       GLN 202  31.573 -14.761   5.231
 1453    HB2  GLN 202           HB2      GLN 202  31.517 -11.744   5.450
 1454    HB3  GLN 202           HB3      GLN 202  32.947 -12.738   5.676
 1455    HG2  GLN 202           HG2      GLN 202  31.348 -12.495   3.137
 1456    HG3  GLN 202           HG3      GLN 202  32.902 -11.729   3.465
 1457   HE21  GLN 202          HE21      GLN 202  31.265 -14.676   2.694
 1458   HE22  GLN 202          HE22      GLN 202  32.677 -15.619   2.341
  Start of MODEL   10
    1    H1   GLY  -5           H1       GLY  -5 -19.829 -13.407  12.280
    2    H2   GLY  -5           H2       GLY  -5 -21.292 -14.135  12.733
    3    H3   GLY  -5           H3       GLY  -5 -20.147 -13.730  13.912
    4    HA2  GLY  -5           HA2      GLY  -5 -22.024 -12.169  13.845
    5    HA3  GLY  -5           HA3      GLY  -5 -20.464 -11.411  13.557
    6    H    ILE  -4           H        ILE  -4 -23.545 -12.265  12.191
    7    HA   ILE  -4           HA       ILE  -4 -22.948 -10.512   9.938
    8    HB   ILE  -4           HB       ILE  -4 -22.443 -12.628   8.965
    9   HG12  ILE  -4          HG12      ILE  -4 -24.174 -12.799   7.195
   10   HG13  ILE  -4          HG13      ILE  -4 -25.227 -11.762   8.153
   11   HG21  ILE  -4          HG21      ILE  -4 -23.520 -14.091  10.570
   12   HG22  ILE  -4          HG22      ILE  -4 -25.108 -13.603   9.980
   13   HG23  ILE  -4          HG23      ILE  -4 -24.016 -14.506   8.929
   14   HD11  ILE  -4          HD11      ILE  -4 -24.124 -10.531   6.368
   15   HD12  ILE  -4          HD12      ILE  -4 -23.627  -9.941   7.955
   16   HD13  ILE  -4          HD13      ILE  -4 -22.550 -10.980   7.023
   17    H    ASP  -3           H        ASP  -3 -24.419  -9.018   9.961
   18    HA   ASP  -3           HA       ASP  -3 -27.238  -9.808  10.264
   19    HB2  ASP  -3           HB2      ASP  -3 -25.906  -7.285  11.274
   20    HB3  ASP  -3           HB3      ASP  -3 -27.650  -7.495  11.172
   21    HA   PRO  -2           HA       PRO  -2 -27.134  -8.648   5.940
   22    HB2  PRO  -2           HB2      PRO  -2 -30.056  -8.513   6.569
   23    HB3  PRO  -2           HB3      PRO  -2 -29.236  -9.252   5.187
   24    HG2  PRO  -2           HG2      PRO  -2 -30.121 -10.766   7.175
   25    HG3  PRO  -2           HG3      PRO  -2 -28.555 -11.104   6.414
   26    HD2  PRO  -2           HD2      PRO  -2 -29.150  -9.886   9.064
   27    HD3  PRO  -2           HD3      PRO  -2 -27.787 -10.908   8.570
   28    H    PHE  -1           H        PHE  -1 -27.474  -6.834   4.704
   29    HA   PHE  -1           HA       PHE  -1 -27.470  -4.387   6.113
   30    HB2  PHE  -1           HB2      PHE  -1 -27.249  -3.341   3.836
   31    HB3  PHE  -1           HB3      PHE  -1 -25.997  -4.497   4.259
   32    HD1  PHE  -1           HD1      PHE  -1 -26.244  -6.874   3.340
   33    HD2  PHE  -1           HD2      PHE  -1 -28.421  -3.543   1.846
   34    HE1  PHE  -1           HE1      PHE  -1 -26.651  -8.088   1.235
   35    HE2  PHE  -1           HE2      PHE  -1 -28.826  -4.744  -0.262
   36    HZ   PHE  -1           HZ       PHE  -1 -27.943  -7.022  -0.569
   37    H    THR   0           H        THR   0 -29.529  -4.715   7.046
   38    HA   THR   0           HA       THR   0 -31.945  -4.188   5.690
   39    HB   THR   0           HB       THR   0 -32.702  -3.333   7.952
   40    HG1  THR   0           HG1      THR   0 -30.380  -4.344   9.126
   41   HG21  THR   0          HG21      THR   0 -31.326  -6.023   7.889
   42   HG22  THR   0          HG22      THR   0 -32.961  -5.681   7.325
   43   HG23  THR   0          HG23      THR   0 -32.569  -5.531   9.038
   44    H    MET   1           H        MET   1 -32.370  -1.749   7.639
   45    HA   MET   1           HA       MET   1 -31.670   0.230   5.640
   46    HB2  MET   1           HB2      MET   1 -33.868   0.234   6.865
   47    HB3  MET   1           HB3      MET   1 -32.991   0.690   8.317
   48    HG2  MET   1           HG2      MET   1 -34.013   2.624   7.295
   49    HG3  MET   1           HG3      MET   1 -32.259   2.750   7.240
   50    HE1  MET   1           HE1      MET   1 -30.982   1.615   4.917
   51    HE2  MET   1           HE2      MET   1 -31.355   2.673   3.556
   52    HE3  MET   1           HE3      MET   1 -30.974   3.365   5.132
   53    H    VAL   2           H        VAL   2 -29.478  -0.892   6.530
   54    HA   VAL   2           HA       VAL   2 -28.058   1.295   7.783
   55    HB   VAL   2           HB       VAL   2 -26.703  -0.324   9.182
   56   HG11  VAL   2          HG11      VAL   2 -28.301  -0.377  11.036
   57   HG12  VAL   2          HG12      VAL   2 -28.321   1.178  10.201
   58   HG13  VAL   2          HG13      VAL   2 -29.608   0.006   9.917
   59   HG21  VAL   2          HG21      VAL   2 -27.390  -2.400   8.104
   60   HG22  VAL   2          HG22      VAL   2 -27.751  -2.440   9.831
   61   HG23  VAL   2          HG23      VAL   2 -29.045  -2.157   8.665
   62    H    ALA   3           H        ALA   3 -27.330   1.601   5.675
   63    HA   ALA   3           HA       ALA   3 -25.161  -0.189   4.926
   64    HB1  ALA   3           HB1      ALA   3 -26.935  -0.939   3.492
   65    HB2  ALA   3           HB2      ALA   3 -27.355   0.721   3.061
   66    HB3  ALA   3           HB3      ALA   3 -25.824   0.032   2.520
   67    H    LEU   4           H        LEU   4 -23.555   0.805   3.742
   68    HA   LEU   4           HA       LEU   4 -23.594   3.746   3.965
   69    HB2  LEU   4           HB2      LEU   4 -21.316   1.800   4.215
   70    HB3  LEU   4           HB3      LEU   4 -21.096   3.537   4.126
   71    HG   LEU   4           HG       LEU   4 -22.453   1.976   6.322
   72   HD11  LEU   4          HD11      LEU   4 -19.952   3.650   6.255
   73   HD12  LEU   4          HD12      LEU   4 -20.641   2.888   7.691
   74   HD13  LEU   4          HD13      LEU   4 -20.035   1.890   6.369
   75   HD21  LEU   4          HD21      LEU   4 -22.772   4.105   7.458
   76   HD22  LEU   4          HD22      LEU   4 -22.120   4.964   6.062
   77   HD23  LEU   4          HD23      LEU   4 -23.642   4.082   5.924
   78    H    SER   5           H        SER   5 -23.004   4.906   2.209
   79    HA   SER   5           HA       SER   5 -22.766   3.376  -0.285
   80    HB2  SER   5           HB2      SER   5 -23.622   6.253   0.123
   81    HB3  SER   5           HB3      SER   5 -23.580   5.403  -1.415
   82    HG   SER   5           HG       SER   5 -25.334   5.116   0.744
   83    H    LEU   6           H        LEU   6 -20.710   3.103  -0.820
   84    HA   LEU   6           HA       LEU   6 -18.820   5.302  -0.283
   85    HB2  LEU   6           HB2      LEU   6 -18.120   2.376  -0.506
   86    HB3  LEU   6           HB3      LEU   6 -17.115   3.681   0.107
   87    HG   LEU   6           HG       LEU   6 -19.566   2.534   1.451
   88   HD11  LEU   6          HD11      LEU   6 -17.607   1.082   1.563
   89   HD12  LEU   6          HD12      LEU   6 -16.655   2.416   2.215
   90   HD13  LEU   6          HD13      LEU   6 -18.004   1.761   3.144
   91   HD21  LEU   6          HD21      LEU   6 -17.717   4.740   2.341
   92   HD22  LEU   6          HD22      LEU   6 -19.413   4.911   1.879
   93   HD23  LEU   6          HD23      LEU   6 -18.981   3.998   3.325
   94    H    LYS   7           H        LYS   7 -17.683   6.081  -1.959
   95    HA   LYS   7           HA       LYS   7 -18.119   4.998  -4.596
   96    HB2  LYS   7           HB2      LYS   7 -16.726   7.392  -3.492
   97    HB3  LYS   7           HB3      LYS   7 -16.251   6.821  -5.085
   98    HG2  LYS   7           HG2      LYS   7 -18.641   6.965  -5.771
   99    HG3  LYS   7           HG3      LYS   7 -18.984   7.719  -4.213
  100    HD2  LYS   7           HD2      LYS   7 -17.634   9.596  -4.716
  101    HD3  LYS   7           HD3      LYS   7 -16.910   8.790  -6.109
  102    HE2  LYS   7           HE2      LYS   7 -19.089   8.802  -7.233
  103    HE3  LYS   7           HE3      LYS   7 -19.791   9.642  -5.849
  104    HZ1  LYS   7           HZ1      LYS   7 -17.540  10.718  -7.456
  105    HZ2  LYS   7           HZ2      LYS   7 -18.444  11.539  -6.281
  106    HZ3  LYS   7           HZ3      LYS   7 -19.164  11.096  -7.749
  107    H    ILE   8           H        ILE   8 -17.078   3.226  -5.200
  108    HA   ILE   8           HA       ILE   8 -14.482   2.585  -4.066
  109    HB   ILE   8           HB       ILE   8 -16.158   1.053  -6.067
  110   HG12  ILE   8          HG12      ILE   8 -17.265   1.123  -3.912
  111   HG13  ILE   8          HG13      ILE   8 -16.586  -0.484  -4.167
  112   HG21  ILE   8          HG21      ILE   8 -13.678   0.226  -4.566
  113   HG22  ILE   8          HG22      ILE   8 -14.659  -0.824  -5.588
  114   HG23  ILE   8          HG23      ILE   8 -13.798   0.541  -6.298
  115   HD11  ILE   8          HD11      ILE   8 -14.714   0.073  -2.713
  116   HD12  ILE   8          HD12      ILE   8 -15.379   1.688  -2.466
  117   HD13  ILE   8          HD13      ILE   8 -16.257   0.274  -1.882
  118    H    SER   9           H        SER   9 -12.941   3.848  -4.946
  119    HA   SER   9           HA       SER   9 -12.857   4.119  -7.857
  120    HB2  SER   9           HB2      SER   9 -12.521   6.162  -6.491
  121    HB3  SER   9           HB3      SER   9 -11.113   5.417  -5.745
  122    HG   SER   9           HG       SER   9 -11.465   6.321  -8.395
  123    H    ILE  10           H        ILE  10 -11.668   2.752  -9.003
  124    HA   ILE  10           HA       ILE  10  -9.682   1.123  -7.555
  125    HB   ILE  10           HB       ILE  10 -11.149   0.337 -10.079
  126   HG12  ILE  10          HG12      ILE  10 -11.700  -0.564  -7.242
  127   HG13  ILE  10          HG13      ILE  10 -12.666   0.629  -8.104
  128   HG21  ILE  10          HG21      ILE  10 -10.335  -1.913  -9.528
  129   HG22  ILE  10          HG22      ILE  10  -9.005  -0.777  -9.757
  130   HG23  ILE  10          HG23      ILE  10  -9.484  -1.257  -8.129
  131   HD11  ILE  10          HD11      ILE  10 -13.250  -1.054  -9.769
  132   HD12  ILE  10          HD12      ILE  10 -12.287  -2.247  -8.897
  133   HD13  ILE  10          HD13      ILE  10 -13.721  -1.549  -8.143
  134    H    GLY  11           H        GLY  11  -7.992   2.573  -7.925
  135    HA2  GLY  11           HA2      GLY  11  -6.092   3.203  -9.080
  136    HA3  GLY  11           HA3      GLY  11  -6.685   2.302 -10.467
  137    H    ASN  12           H        ASN  12  -8.745   3.360 -11.429
  138    HA   ASN  12           HA       ASN  12  -8.513   6.281 -11.465
  139    HB2  ASN  12           HB2      ASN  12  -7.125   5.524 -13.316
  140    HB3  ASN  12           HB3      ASN  12  -8.430   4.503 -13.914
  141   HD21  ASN  12          HD21      ASN  12 -10.104   5.406 -15.051
  142   HD22  ASN  12          HD22      ASN  12 -10.088   7.052 -15.600
  143    H    VAL  13           H        VAL  13 -10.298   3.418 -12.519
  144    HA   VAL  13           HA       VAL  13 -12.702   4.776 -13.173
  145    HB   VAL  13           HB       VAL  13 -12.032   2.485 -13.971
  146   HG11  VAL  13          HG11      VAL  13 -11.284   1.542 -11.869
  147   HG12  VAL  13          HG12      VAL  13 -12.921   1.645 -11.219
  148   HG13  VAL  13          HG13      VAL  13 -12.573   0.558 -12.564
  149   HG21  VAL  13          HG21      VAL  13 -14.291   3.308 -14.298
  150   HG22  VAL  13          HG22      VAL  13 -14.300   1.574 -13.973
  151   HG23  VAL  13          HG23      VAL  13 -14.754   2.713 -12.704
  152    H    VAL  14           H        VAL  14 -14.753   4.641 -11.998
  153    HA   VAL  14           HA       VAL  14 -14.463   4.197  -9.118
  154    HB   VAL  14           HB       VAL  14 -14.192   6.576  -9.305
  155   HG11  VAL  14          HG11      VAL  14 -16.766   6.607 -10.867
  156   HG12  VAL  14          HG12      VAL  14 -15.880   8.029 -10.311
  157   HG13  VAL  14          HG13      VAL  14 -15.152   6.942 -11.495
  158   HG21  VAL  14          HG21      VAL  14 -16.114   7.374  -7.983
  159   HG22  VAL  14          HG22      VAL  14 -16.976   5.885  -8.371
  160   HG23  VAL  14          HG23      VAL  14 -15.497   5.823  -7.412
  161    H    LYS  15           H        LYS  15 -15.987   3.001  -8.323
  162    HA   LYS  15           HA       LYS  15 -18.525   2.690  -9.793
  163    HB2  LYS  15           HB2      LYS  15 -17.081   0.620  -8.123
  164    HB3  LYS  15           HB3      LYS  15 -18.572   0.374  -9.020
  165    HG2  LYS  15           HG2      LYS  15 -15.904   1.027 -10.253
  166    HG3  LYS  15           HG3      LYS  15 -16.599  -0.589 -10.129
  167    HD2  LYS  15           HD2      LYS  15 -18.509   0.139 -11.484
  168    HD3  LYS  15           HD3      LYS  15 -17.793   1.747 -11.620
  169    HE2  LYS  15           HE2      LYS  15 -15.834   0.761 -12.727
  170    HE3  LYS  15           HE3      LYS  15 -16.584  -0.831 -12.618
  171    HZ1  LYS  15           HZ1      LYS  15 -17.671   1.497 -14.110
  172    HZ2  LYS  15           HZ2      LYS  15 -18.386  -0.040 -14.018
  173    HZ3  LYS  15           HZ3      LYS  15 -16.894   0.157 -14.801
  174    H    THR  16           H        THR  16 -20.421   2.493  -8.519
  175    HA   THR  16           HA       THR  16 -20.095   3.598  -5.816
  176    HB   THR  16           HB       THR  16 -22.611   3.360  -7.485
  177    HG1  THR  16           HG1      THR  16 -20.892   4.863  -8.217
  178   HG21  THR  16          HG21      THR  16 -23.053   3.418  -5.069
  179   HG22  THR  16          HG22      THR  16 -23.575   4.910  -5.850
  180   HG23  THR  16          HG23      THR  16 -22.074   4.879  -4.925
  181    H    MET  17           H        MET  17 -20.205   2.247  -4.136
  182    HA   MET  17           HA       MET  17 -21.829  -0.180  -4.385
  183    HB2  MET  17           HB2      MET  17 -18.920   0.014  -3.936
  184    HB3  MET  17           HB3      MET  17 -19.771  -1.049  -2.826
  185    HG2  MET  17           HG2      MET  17 -20.073  -1.246  -5.801
  186    HG3  MET  17           HG3      MET  17 -18.813  -2.098  -4.914
  187    HE1  MET  17           HE1      MET  17 -20.917  -4.480  -2.594
  188    HE2  MET  17           HE2      MET  17 -19.298  -3.974  -3.077
  189    HE3  MET  17           HE3      MET  17 -20.336  -2.866  -2.180
  190    H    GLN  18           H        GLN  18 -22.704  -0.937  -2.476
  191    HA   GLN  18           HA       GLN  18 -22.326   0.819  -0.146
  192    HB2  GLN  18           HB2      GLN  18 -24.795  -0.562  -1.168
  193    HB3  GLN  18           HB3      GLN  18 -24.669   0.020   0.491
  194    HG2  GLN  18           HG2      GLN  18 -24.728   2.203  -0.112
  195    HG3  GLN  18           HG3      GLN  18 -23.980   1.905  -1.683
  196   HE21  GLN  18          HE21      GLN  18 -25.496   3.073  -2.802
  197   HE22  GLN  18          HE22      GLN  18 -27.111   2.508  -3.049
  198    H    PHE  19           H        PHE  19 -21.991  -0.088   1.823
  199    HA   PHE  19           HA       PHE  19 -21.738  -3.005   1.921
  200    HB2  PHE  19           HB2      PHE  19 -19.757  -0.978   2.999
  201    HB3  PHE  19           HB3      PHE  19 -19.673  -2.715   3.261
  202    HD1  PHE  19           HD1      PHE  19 -19.106  -4.219   1.421
  203    HD2  PHE  19           HD2      PHE  19 -19.059   0.006   0.946
  204    HE1  PHE  19           HE1      PHE  19 -17.768  -4.467  -0.631
  205    HE2  PHE  19           HE2      PHE  19 -17.721  -0.233  -1.104
  206    HZ   PHE  19           HZ       PHE  19 -17.074  -2.471  -1.896
  207    H    GLU  20           H        GLU  20 -21.804  -3.804   4.163
  208    HA   GLU  20           HA       GLU  20 -23.756  -2.345   5.702
  209    HB2  GLU  20           HB2      GLU  20 -22.315  -4.847   6.573
  210    HB3  GLU  20           HB3      GLU  20 -23.918  -4.290   7.033
  211    HG2  GLU  20           HG2      GLU  20 -24.816  -4.830   4.900
  212    HG3  GLU  20           HG3      GLU  20 -23.211  -5.128   4.235
  213    HA   PRO  21           HA       PRO  21 -21.015  -0.116   8.373
  214    HB2  PRO  21           HB2      PRO  21 -22.356  -0.580  10.785
  215    HB3  PRO  21           HB3      PRO  21 -22.658   0.749   9.665
  216    HG2  PRO  21           HG2      PRO  21 -24.125  -1.814  10.004
  217    HG3  PRO  21           HG3      PRO  21 -24.742  -0.214   9.551
  218    HD2  PRO  21           HD2      PRO  21 -24.436  -2.189   7.753
  219    HD3  PRO  21           HD3      PRO  21 -24.175  -0.483   7.337
  220    H    SER  22           H        SER  22 -21.954  -3.405   9.197
  221    HA   SER  22           HA       SER  22 -19.723  -3.674  11.049
  222    HB2  SER  22           HB2      SER  22 -21.664  -5.820  10.179
  223    HB3  SER  22           HB3      SER  22 -20.636  -5.816  11.610
  224    HG   SER  22           HG       SER  22 -22.972  -4.338  11.073
  225    H    THR  23           H        THR  23 -20.012  -3.784   7.783
  226    HA   THR  23           HA       THR  23 -18.744  -6.183   7.092
  227    HB   THR  23           HB       THR  23 -18.891  -3.595   5.548
  228    HG1  THR  23           HG1      THR  23 -20.567  -5.858   5.791
  229   HG21  THR  23          HG21      THR  23 -18.245  -6.378   4.610
  230   HG22  THR  23          HG22      THR  23 -17.107  -5.036   4.734
  231   HG23  THR  23          HG23      THR  23 -18.441  -4.958   3.583
  232    H    MET  24           H        MET  24 -16.917  -6.656   7.884
  233    HA   MET  24           HA       MET  24 -14.695  -4.997   8.354
  234    HB2  MET  24           HB2      MET  24 -15.277  -7.779   8.435
  235    HB3  MET  24           HB3      MET  24 -13.820  -7.564   7.480
  236    HG2  MET  24           HG2      MET  24 -13.078  -7.890   9.645
  237    HG3  MET  24           HG3      MET  24 -12.951  -6.152   9.379
  238    HE1  MET  24           HE1      MET  24 -12.708  -5.918  12.057
  239    HE2  MET  24           HE2      MET  24 -13.918  -6.513  13.193
  240    HE3  MET  24           HE3      MET  24 -12.951  -7.655  12.257
  241    H    VAL  25           H        VAL  25 -12.860  -4.595   7.086
  242    HA   VAL  25           HA       VAL  25 -12.903  -4.236   4.404
  243    HB   VAL  25           HB       VAL  25 -10.583  -5.114   6.110
  244   HG11  VAL  25          HG11      VAL  25 -10.103  -5.765   3.798
  245   HG12  VAL  25          HG12      VAL  25 -10.504  -4.136   3.253
  246   HG13  VAL  25          HG13      VAL  25  -9.103  -4.398   4.293
  247   HG21  VAL  25          HG21      VAL  25  -9.969  -2.753   5.914
  248   HG22  VAL  25          HG22      VAL  25 -11.414  -2.467   4.943
  249   HG23  VAL  25          HG23      VAL  25 -11.568  -2.959   6.629
  250    H    TYR  26           H        TYR  26 -12.178  -7.297   6.058
  251    HA   TYR  26           HA       TYR  26 -11.545  -8.680   3.695
  252    HB2  TYR  26           HB2      TYR  26 -11.585 -10.726   4.920
  253    HB3  TYR  26           HB3      TYR  26 -10.854  -9.493   5.925
  254    HD1  TYR  26           HD1      TYR  26 -14.126 -11.198   5.341
  255    HD2  TYR  26           HD2      TYR  26 -11.553  -9.287   8.141
  256    HE1  TYR  26           HE1      TYR  26 -15.696 -11.739   7.150
  257    HE2  TYR  26           HE2      TYR  26 -13.112  -9.841   9.959
  258    HH   TYR  26           HH       TYR  26 -15.758 -12.004   9.529
  259    H    ASP  27           H        ASP  27 -14.596  -8.012   5.241
  260    HA   ASP  27           HA       ASP  27 -16.058  -9.918   3.651
  261    HB2  ASP  27           HB2      ASP  27 -16.786  -9.182   5.929
  262    HB3  ASP  27           HB3      ASP  27 -17.123  -7.588   5.260
  263    H    ALA  28           H        ALA  28 -15.584  -6.419   3.692
  264    HA   ALA  28           HA       ALA  28 -17.195  -5.709   1.544
  265    HB1  ALA  28           HB1      ALA  28 -15.828  -3.696   1.390
  266    HB2  ALA  28           HB2      ALA  28 -16.170  -4.096   3.074
  267    HB3  ALA  28           HB3      ALA  28 -14.585  -4.452   2.387
  268    H    CYS  29           H        CYS  29 -13.757  -6.567   1.570
  269    HA   CYS  29           HA       CYS  29 -13.240  -6.243  -1.136
  270    HB2  CYS  29           HB2      CYS  29 -11.509  -6.615   0.596
  271    HB3  CYS  29           HB3      CYS  29 -12.012  -8.298   0.713
  272    HG   CYS  29           HG       CYS  29  -9.553  -7.529  -0.876
  273    H    ARG  30           H        ARG  30 -14.883  -8.856   0.516
  274    HA   ARG  30           HA       ARG  30 -14.556 -10.735  -1.621
  275    HB2  ARG  30           HB2      ARG  30 -15.435 -12.254  -0.203
  276    HB3  ARG  30           HB3      ARG  30 -15.215 -11.001   1.008
  277    HG2  ARG  30           HG2      ARG  30 -17.516 -10.344   0.850
  278    HG3  ARG  30           HG3      ARG  30 -17.765 -11.411  -0.538
  279    HD2  ARG  30           HD2      ARG  30 -18.617 -12.706   1.147
  280    HD3  ARG  30           HD3      ARG  30 -16.947 -13.263   1.120
  281    HE   ARG  30           HE       ARG  30 -17.930 -11.246   3.046
  282   HH11  ARG  30          HH11      ARG  30 -16.022 -14.099   2.298
  283   HH12  ARG  30          HH12      ARG  30 -15.564 -14.360   3.954
  284   HH21  ARG  30          HH21      ARG  30 -17.335 -11.594   5.185
  285   HH22  ARG  30          HH22      ARG  30 -16.308 -12.942   5.604
  286    H    MET  31           H        MET  31 -17.077  -8.488  -0.610
  287    HA   MET  31           HA       MET  31 -18.911  -9.389  -2.625
  288    HB2  MET  31           HB2      MET  31 -19.004  -6.903  -0.909
  289    HB3  MET  31           HB3      MET  31 -20.326  -7.569  -1.852
  290    HG2  MET  31           HG2      MET  31 -20.310  -9.583  -0.494
  291    HG3  MET  31           HG3      MET  31 -18.972  -8.942   0.449
  292    HE1  MET  31           HE1      MET  31 -19.060  -7.077   2.075
  293    HE2  MET  31           HE2      MET  31 -19.650  -5.917   0.881
  294    HE3  MET  31           HE3      MET  31 -20.463  -6.066   2.443
  295    H    ILE  32           H        ILE  32 -16.679  -6.685  -2.229
  296    HA   ILE  32           HA       ILE  32 -17.640  -5.182  -4.416
  297    HB   ILE  32           HB       ILE  32 -16.146  -4.429  -2.465
  298   HG12  ILE  32          HG12      ILE  32 -16.829  -3.065  -4.505
  299   HG13  ILE  32          HG13      ILE  32 -15.413  -2.519  -3.622
  300   HG21  ILE  32          HG21      ILE  32 -14.355  -6.014  -2.693
  301   HG22  ILE  32          HG22      ILE  32 -13.989  -5.414  -4.311
  302   HG23  ILE  32          HG23      ILE  32 -13.737  -4.375  -2.908
  303   HD11  ILE  32          HD11      ILE  32 -15.076  -2.335  -5.998
  304   HD12  ILE  32          HD12      ILE  32 -13.978  -3.538  -5.319
  305   HD13  ILE  32          HD13      ILE  32 -15.413  -4.055  -6.207
  306    H    ARG  33           H        ARG  33 -14.966  -7.508  -4.150
  307    HA   ARG  33           HA       ARG  33 -14.158  -7.499  -6.827
  308    HB2  ARG  33           HB2      ARG  33 -13.002  -9.528  -6.379
  309    HB3  ARG  33           HB3      ARG  33 -12.982  -8.622  -4.875
  310    HG2  ARG  33           HG2      ARG  33 -14.799  -9.987  -4.010
  311    HG3  ARG  33           HG3      ARG  33 -14.864 -10.879  -5.530
  312    HD2  ARG  33           HD2      ARG  33 -13.643 -12.214  -3.997
  313    HD3  ARG  33           HD3      ARG  33 -12.476 -11.540  -5.133
  314    HE   ARG  33           HE       ARG  33 -12.121  -9.810  -3.271
  315   HH11  ARG  33          HH11      ARG  33 -12.962 -13.163  -2.726
  316   HH12  ARG  33          HH12      ARG  33 -12.190 -13.239  -1.169
  317   HH21  ARG  33          HH21      ARG  33 -11.085  -9.911  -1.224
  318   HH22  ARG  33          HH22      ARG  33 -11.119 -11.393  -0.315
  319    H    GLU  34           H        GLU  34 -16.948  -8.805  -5.363
  320    HA   GLU  34           HA       GLU  34 -17.434 -10.969  -7.150
  321    HB2  GLU  34           HB2      GLU  34 -18.374 -10.969  -4.921
  322    HB3  GLU  34           HB3      GLU  34 -19.276  -9.501  -5.264
  323    HG2  GLU  34           HG2      GLU  34 -20.584 -10.714  -6.942
  324    HG3  GLU  34           HG3      GLU  34 -19.696 -12.187  -6.550
  325    H    ARG  35           H        ARG  35 -19.167  -7.844  -6.814
  326    HA   ARG  35           HA       ARG  35 -20.513  -8.336  -9.312
  327    HB2  ARG  35           HB2      ARG  35 -21.619  -6.150  -8.909
  328    HB3  ARG  35           HB3      ARG  35 -21.803  -7.291  -7.585
  329    HG2  ARG  35           HG2      ARG  35 -19.507  -5.475  -7.366
  330    HG3  ARG  35           HG3      ARG  35 -21.097  -4.708  -7.282
  331    HD2  ARG  35           HD2      ARG  35 -20.370  -7.116  -5.642
  332    HD3  ARG  35           HD3      ARG  35 -20.057  -5.471  -5.093
  333    HE   ARG  35           HE       ARG  35 -22.632  -5.278  -5.617
  334   HH11  ARG  35          HH11      ARG  35 -20.944  -7.954  -4.132
  335   HH12  ARG  35          HH12      ARG  35 -22.250  -8.365  -3.065
  336   HH21  ARG  35          HH21      ARG  35 -24.350  -5.781  -4.187
  337   HH22  ARG  35          HH22      ARG  35 -24.171  -7.098  -3.064
  338    H    ILE  36           H        ILE  36 -17.733  -6.489  -8.320
  339    HA   ILE  36           HA       ILE  36 -17.824  -4.971 -10.832
  340    HB   ILE  36           HB       ILE  36 -16.101  -4.492  -8.398
  341   HG12  ILE  36          HG12      ILE  36 -18.558  -3.014  -9.373
  342   HG13  ILE  36          HG13      ILE  36 -18.528  -4.128  -8.011
  343   HG21  ILE  36          HG21      ILE  36 -16.541  -2.819 -10.869
  344   HG22  ILE  36          HG22      ILE  36 -15.606  -2.334  -9.455
  345   HG23  ILE  36          HG23      ILE  36 -15.064  -3.687 -10.450
  346   HD11  ILE  36          HD11      ILE  36 -16.974  -2.648  -6.844
  347   HD12  ILE  36          HD12      ILE  36 -17.027  -1.530  -8.207
  348   HD13  ILE  36          HD13      ILE  36 -18.482  -1.831  -7.258
  349    HA   PRO  37           HA       PRO  37 -14.680  -7.900 -12.210
  350    HB2  PRO  37           HB2      PRO  37 -15.004  -6.474 -14.754
  351    HB3  PRO  37           HB3      PRO  37 -15.272  -8.179 -14.384
  352    HG2  PRO  37           HG2      PRO  37 -17.307  -6.491 -14.895
  353    HG3  PRO  37           HG3      PRO  37 -17.460  -7.833 -13.745
  354    HD2  PRO  37           HD2      PRO  37 -17.009  -4.919 -13.213
  355    HD3  PRO  37           HD3      PRO  37 -18.072  -6.066 -12.370
  356    H    GLU  38           H        GLU  38 -14.717  -4.414 -12.470
  357    HA   GLU  38           HA       GLU  38 -12.018  -4.180 -13.404
  358    HB2  GLU  38           HB2      GLU  38 -13.910  -2.177 -12.176
  359    HB3  GLU  38           HB3      GLU  38 -12.288  -1.766 -12.715
  360    HG2  GLU  38           HG2      GLU  38 -14.505  -2.846 -14.436
  361    HG3  GLU  38           HG3      GLU  38 -13.945  -1.175 -14.382
  362    H    ALA  39           H        ALA  39 -13.319  -5.037 -10.449
  363    HA   ALA  39           HA       ALA  39 -11.516  -3.714  -8.691
  364    HB1  ALA  39           HB1      ALA  39 -12.339  -5.260  -6.995
  365    HB2  ALA  39           HB2      ALA  39 -13.674  -4.586  -7.931
  366    HB3  ALA  39           HB3      ALA  39 -13.120  -6.229  -8.246
  367    H    LEU  40           H        LEU  40 -11.607  -6.979 -10.091
  368    HA   LEU  40           HA       LEU  40  -9.007  -7.485  -8.914
  369    HB2  LEU  40           HB2      LEU  40  -9.393  -9.843  -9.941
  370    HB3  LEU  40           HB3      LEU  40 -10.184  -9.368  -8.459
  371    HG   LEU  40           HG       LEU  40 -11.602 -10.681 -10.045
  372   HD11  LEU  40          HD11      LEU  40 -13.597  -9.288  -9.807
  373   HD12  LEU  40          HD12      LEU  40 -12.636  -9.339  -8.330
  374   HD13  LEU  40          HD13      LEU  40 -12.578  -7.917  -9.369
  375   HD21  LEU  40          HD21      LEU  40 -11.371  -8.194 -11.710
  376   HD22  LEU  40          HD22      LEU  40 -10.899  -9.833 -12.153
  377   HD23  LEU  40          HD23      LEU  40 -12.607  -9.434 -11.946
  378    H    ALA  41           H        ALA  41  -8.149  -5.813 -10.368
  379    HA   ALA  41           HA       ALA  41  -7.720  -6.327 -13.106
  380    HB1  ALA  41           HB1      ALA  41  -7.296  -4.137 -12.111
  381    HB2  ALA  41           HB2      ALA  41  -5.973  -4.815 -11.160
  382    HB3  ALA  41           HB3      ALA  41  -5.850  -4.746 -12.918
  383    H    GLY  42           H        GLY  42  -6.359  -7.567 -10.224
  384    HA2  GLY  42           HA2      GLY  42  -4.909  -9.574 -11.803
  385    HA3  GLY  42           HA3      GLY  42  -4.133  -8.827 -10.405
  386    HA   PRO  43           HA       PRO  43  -6.425 -12.300  -8.516
  387    HB2  PRO  43           HB2      PRO  43  -4.292 -12.438  -6.571
  388    HB3  PRO  43           HB3      PRO  43  -4.760 -13.637  -7.781
  389    HG2  PRO  43           HG2      PRO  43  -2.410 -12.226  -7.868
  390    HG3  PRO  43           HG3      PRO  43  -3.206 -12.922  -9.290
  391    HD2  PRO  43           HD2      PRO  43  -3.208 -10.097  -8.305
  392    HD3  PRO  43           HD3      PRO  43  -3.134 -10.712  -9.971
  393    HA   PRO  44           HA       PRO  44  -8.367  -9.428  -5.752
  394    HB2  PRO  44           HB2      PRO  44  -9.709 -11.346  -4.262
  395    HB3  PRO  44           HB3      PRO  44 -10.279 -10.650  -5.782
  396    HG2  PRO  44           HG2      PRO  44  -8.810 -13.217  -5.307
  397    HG3  PRO  44           HG3      PRO  44 -10.190 -12.897  -6.380
  398    HD2  PRO  44           HD2      PRO  44  -7.738 -13.092  -7.374
  399    HD3  PRO  44           HD3      PRO  44  -8.845 -11.836  -7.974
  400    H    ASN  45           H        ASN  45  -6.446 -12.127  -4.612
  401    HA   ASN  45           HA       ASN  45  -6.503 -11.458  -1.855
  402    HB2  ASN  45           HB2      ASN  45  -4.770 -13.080  -1.566
  403    HB3  ASN  45           HB3      ASN  45  -5.839 -13.688  -2.824
  404   HD21  ASN  45          HD21      ASN  45  -5.120 -13.922  -4.873
  405   HD22  ASN  45          HD22      ASN  45  -3.455 -13.755  -5.318
  406    H    ASP  46           H        ASP  46  -4.857 -10.122  -4.538
  407    HA   ASP  46           HA       ASP  46  -2.770  -8.913  -2.895
  408    HB2  ASP  46           HB2      ASP  46  -3.296  -8.863  -5.870
  409    HB3  ASP  46           HB3      ASP  46  -2.000  -7.956  -5.098
  410    H    PHE  47           H        PHE  47  -5.878  -8.201  -3.245
  411    HA   PHE  47           HA       PHE  47  -5.422  -5.309  -3.600
  412    HB2  PHE  47           HB2      PHE  47  -7.818  -6.998  -4.311
  413    HB3  PHE  47           HB3      PHE  47  -7.886  -5.241  -4.222
  414    HD1  PHE  47           HD1      PHE  47  -6.702  -3.869  -5.838
  415    HD2  PHE  47           HD2      PHE  47  -6.696  -8.111  -6.123
  416    HE1  PHE  47           HE1      PHE  47  -5.888  -3.708  -8.152
  417    HE2  PHE  47           HE2      PHE  47  -5.882  -7.959  -8.435
  418    HZ   PHE  47           HZ       PHE  47  -5.477  -5.755  -9.455
  419    H    GLY  48           H        GLY  48  -6.206  -3.894  -2.115
  420    HA2  GLY  48           HA2      GLY  48  -7.884  -4.954   0.062
  421    HA3  GLY  48           HA3      GLY  48  -6.386  -4.124   0.452
  422    H    LEU  49           H        LEU  49  -8.094  -2.831   1.683
  423    HA   LEU  49           HA       LEU  49  -9.480  -0.927  -0.068
  424    HB2  LEU  49           HB2      LEU  49  -9.965  -1.574   2.837
  425    HB3  LEU  49           HB3      LEU  49 -10.888  -0.430   1.883
  426    HG   LEU  49           HG       LEU  49 -10.764  -3.416   1.470
  427   HD11  LEU  49          HD11      LEU  49 -12.999  -1.601   2.355
  428   HD12  LEU  49          HD12      LEU  49 -13.133  -3.335   2.058
  429   HD13  LEU  49          HD13      LEU  49 -12.118  -2.741   3.372
  430   HD21  LEU  49          HD21      LEU  49 -10.913  -2.266  -0.671
  431   HD22  LEU  49          HD22      LEU  49 -12.437  -3.062  -0.277
  432   HD23  LEU  49          HD23      LEU  49 -12.276  -1.317  -0.078
  433    H    PHE  50           H        PHE  50  -8.367   0.811  -0.396
  434    HA   PHE  50           HA       PHE  50  -6.909   2.103   1.801
  435    HB2  PHE  50           HB2      PHE  50  -5.651   1.808  -0.274
  436    HB3  PHE  50           HB3      PHE  50  -6.895   2.660  -1.177
  437    HD1  PHE  50           HD1      PHE  50  -4.171   3.043   1.286
  438    HD2  PHE  50           HD2      PHE  50  -6.984   5.033  -1.222
  439    HE1  PHE  50           HE1      PHE  50  -2.986   5.168   1.640
  440    HE2  PHE  50           HE2      PHE  50  -5.799   7.158  -0.867
  441    HZ   PHE  50           HZ       PHE  50  -3.796   7.226   0.565
  442    H    LEU  51           H        LEU  51  -7.659   3.913   2.751
  443    HA   LEU  51           HA       LEU  51 -10.206   4.957   1.770
  444    HB2  LEU  51           HB2      LEU  51  -9.732   4.289   4.223
  445    HB3  LEU  51           HB3      LEU  51  -8.841   5.794   4.317
  446    HG   LEU  51           HG       LEU  51 -11.292   5.745   5.133
  447   HD11  LEU  51          HD11      LEU  51 -10.399   7.868   3.194
  448   HD12  LEU  51          HD12      LEU  51 -11.683   8.034   4.393
  449   HD13  LEU  51          HD13      LEU  51 -10.013   7.800   4.913
  450   HD21  LEU  51          HD21      LEU  51 -12.963   6.187   3.422
  451   HD22  LEU  51          HD22      LEU  51 -11.747   5.973   2.163
  452   HD23  LEU  51          HD23      LEU  51 -12.215   4.609   3.178
  453    H    SER  52           H        SER  52 -10.142   6.568   0.424
  454    HA   SER  52           HA       SER  52  -7.701   8.033   0.020
  455    HB2  SER  52           HB2      SER  52  -9.046   9.034  -1.896
  456    HB3  SER  52           HB3      SER  52  -8.802   7.289  -1.952
  457    HG   SER  52           HG       SER  52 -11.095   8.323  -0.699
  458    H    ASP  53           H        ASP  53  -7.282  10.065   0.537
  459    HA   ASP  53           HA       ASP  53  -9.469  11.767   1.523
  460    HB2  ASP  53           HB2      ASP  53  -8.208  11.304   3.468
  461    HB3  ASP  53           HB3      ASP  53  -6.676  11.417   2.606
  462    H    ASP  54           H        ASP  54  -6.051  12.292   0.841
  463    HA   ASP  54           HA       ASP  54  -6.175  13.481  -1.652
  464    HB2  ASP  54           HB2      ASP  54  -7.549  15.259  -0.753
  465    HB3  ASP  54           HB3      ASP  54  -6.464  15.469   0.619
  466    H    ASP  55           H        ASP  55  -4.818  14.004   1.574
  467    HA   ASP  55           HA       ASP  55  -2.153  14.309   0.409
  468    HB2  ASP  55           HB2      ASP  55  -2.971  15.933   2.112
  469    HB3  ASP  55           HB3      ASP  55  -3.038  14.626   3.287
  470    HA   PRO  56           HA       PRO  56  -0.944  10.111   1.033
  471    HB2  PRO  56           HB2      PRO  56   1.705  10.671   1.718
  472    HB3  PRO  56           HB3      PRO  56   1.083  10.450   0.081
  473    HG2  PRO  56           HG2      PRO  56   1.573  12.980   1.600
  474    HG3  PRO  56           HG3      PRO  56   1.869  12.624  -0.114
  475    HD2  PRO  56           HD2      PRO  56  -0.237  14.067   0.616
  476    HD3  PRO  56           HD3      PRO  56  -0.388  12.845  -0.667
  477    H    LYS  57           H        LYS  57  -0.382  12.540   3.527
  478    HA   LYS  57           HA       LYS  57   0.431  10.562   5.479
  479    HB2  LYS  57           HB2      LYS  57  -0.336  13.426   6.038
  480    HB3  LYS  57           HB3      LYS  57   0.698  12.371   6.997
  481    HG2  LYS  57           HG2      LYS  57   1.372  13.377   4.240
  482    HG3  LYS  57           HG3      LYS  57   1.939  14.100   5.746
  483    HD2  LYS  57           HD2      LYS  57   2.391  11.192   5.277
  484    HD3  LYS  57           HD3      LYS  57   3.408  12.361   4.433
  485    HE2  LYS  57           HE2      LYS  57   4.443  11.641   6.519
  486    HE3  LYS  57           HE3      LYS  57   4.053  13.357   6.562
  487    HZ1  LYS  57           HZ1      LYS  57   2.241  11.317   7.708
  488    HZ2  LYS  57           HZ2      LYS  57   2.279  12.983   8.011
  489    HZ3  LYS  57           HZ3      LYS  57   3.513  11.986   8.606
  490    H    LYS  58           H        LYS  58  -2.493  12.018   4.396
  491    HA   LYS  58           HA       LYS  58  -3.975  11.214   6.770
  492    HB2  LYS  58           HB2      LYS  58  -4.780  12.628   4.234
  493    HB3  LYS  58           HB3      LYS  58  -5.963  12.060   5.400
  494    HG2  LYS  58           HG2      LYS  58  -5.634  14.342   5.846
  495    HG3  LYS  58           HG3      LYS  58  -4.782  13.470   7.119
  496    HD2  LYS  58           HD2      LYS  58  -2.672  13.888   6.089
  497    HD3  LYS  58           HD3      LYS  58  -3.444  14.531   4.638
  498    HE2  LYS  58           HE2      LYS  58  -2.590  16.341   6.011
  499    HE3  LYS  58           HE3      LYS  58  -4.351  16.389   5.956
  500    HZ1  LYS  58           HZ1      LYS  58  -4.422  15.352   8.134
  501    HZ2  LYS  58           HZ2      LYS  58  -3.499  16.773   8.189
  502    HZ3  LYS  58           HZ3      LYS  58  -2.725  15.265   8.178
  503    H    GLY  59           H        GLY  59  -3.307  10.145   3.538
  504    HA2  GLY  59           HA2      GLY  59  -5.393   8.306   3.173
  505    HA3  GLY  59           HA3      GLY  59  -3.798   8.190   2.444
  506    H    ILE  60           H        ILE  60  -5.722   6.217   3.781
  507    HA   ILE  60           HA       ILE  60  -3.729   4.974   5.532
  508    HB   ILE  60           HB       ILE  60  -5.614   4.295   7.084
  509   HG12  ILE  60          HG12      ILE  60  -7.016   6.635   5.777
  510   HG13  ILE  60          HG13      ILE  60  -7.440   4.949   5.510
  511   HG21  ILE  60          HG21      ILE  60  -3.931   5.929   7.716
  512   HG22  ILE  60          HG22      ILE  60  -4.871   7.213   6.955
  513   HG23  ILE  60          HG23      ILE  60  -5.508   6.375   8.370
  514   HD11  ILE  60          HD11      ILE  60  -8.926   6.056   7.106
  515   HD12  ILE  60          HD12      ILE  60  -8.052   4.707   7.835
  516   HD13  ILE  60          HD13      ILE  60  -7.547   6.366   8.161
  517    H    TRP  61           H        TRP  61  -3.897   2.719   5.706
  518    HA   TRP  61           HA       TRP  61  -5.567   1.497   3.633
  519    HB2  TRP  61           HB2      TRP  61  -3.020   0.648   4.971
  520    HB3  TRP  61           HB3      TRP  61  -4.063  -0.551   4.210
  521    HD1  TRP  61           HD1      TRP  61  -1.699   2.315   3.375
  522    HE1  TRP  61           HE1      TRP  61  -1.243   2.314   0.842
  523    HE3  TRP  61           HE3      TRP  61  -5.120  -1.197   1.953
  524    HZ2  TRP  61           HZ2      TRP  61  -2.203   0.981  -1.451
  525    HZ3  TRP  61           HZ3      TRP  61  -5.289  -1.781  -0.431
  526    HH2  TRP  61           HH2      TRP  61  -3.861  -0.711  -2.095
  527    H    LEU  62           H        LEU  62  -7.289   0.471   4.159
  528    HA   LEU  62           HA       LEU  62  -8.041   0.164   6.920
  529    HB2  LEU  62           HB2      LEU  62  -9.504  -0.691   4.418
  530    HB3  LEU  62           HB3      LEU  62 -10.194  -0.487   6.017
  531    HG   LEU  62           HG       LEU  62  -8.989   1.799   4.459
  532   HD11  LEU  62          HD11      LEU  62 -11.884   0.974   4.622
  533   HD12  LEU  62          HD12      LEU  62 -11.251   2.427   3.847
  534   HD13  LEU  62          HD13      LEU  62 -10.852   0.838   3.197
  535   HD21  LEU  62          HD21      LEU  62 -10.897   1.712   6.789
  536   HD22  LEU  62          HD22      LEU  62  -9.180   2.121   6.874
  537   HD23  LEU  62          HD23      LEU  62 -10.292   3.164   5.987
  538    H    GLU  63           H        GLU  63  -7.296  -1.550   8.031
  539    HA   GLU  63           HA       GLU  63  -6.487  -3.957   6.683
  540    HB2  GLU  63           HB2      GLU  63  -5.795  -4.715   8.898
  541    HB3  GLU  63           HB3      GLU  63  -5.203  -3.092   8.577
  542    HG2  GLU  63           HG2      GLU  63  -6.965  -2.152   9.953
  543    HG3  GLU  63           HG3      GLU  63  -7.619  -3.765  10.239
  544    H    ALA  64           H        ALA  64  -7.206  -6.095   7.357
  545    HA   ALA  64           HA       ALA  64 -10.064  -6.262   7.225
  546    HB1  ALA  64           HB1      ALA  64  -9.717  -8.676   7.176
  547    HB2  ALA  64           HB2      ALA  64  -8.632  -7.856   6.053
  548    HB3  ALA  64           HB3      ALA  64  -8.020  -8.448   7.597
  549    H    GLY  65           H        GLY  65  -7.919  -5.908   9.773
  550    HA2  GLY  65           HA2      GLY  65  -9.280  -7.534  11.706
  551    HA3  GLY  65           HA3      GLY  65  -8.004  -6.373  12.028
  552    H    LYS  66           H        LYS  66 -10.053  -4.529  10.353
  553    HA   LYS  66           HA       LYS  66 -11.771  -3.991  12.677
  554    HB2  LYS  66           HB2      LYS  66 -11.116  -1.856  12.906
  555    HB3  LYS  66           HB3      LYS  66  -9.678  -2.368  12.040
  556    HG2  LYS  66           HG2      LYS  66 -12.096  -1.218  10.675
  557    HG3  LYS  66           HG3      LYS  66 -10.759  -0.234  11.260
  558    HD2  LYS  66           HD2      LYS  66  -9.282  -1.086   9.691
  559    HD3  LYS  66           HD3      LYS  66 -10.244  -2.542   9.428
  560    HE2  LYS  66           HE2      LYS  66 -11.077   0.246   8.615
  561    HE3  LYS  66           HE3      LYS  66 -10.362  -0.948   7.531
  562    HZ1  LYS  66           HZ1      LYS  66 -12.669  -1.066   7.240
  563    HZ2  LYS  66           HZ2      LYS  66 -12.972  -1.055   8.905
  564    HZ3  LYS  66           HZ3      LYS  66 -12.270  -2.417   8.184
  565    H    ALA  67           H        ALA  67 -13.721  -2.769  12.209
  566    HA   ALA  67           HA       ALA  67 -14.872  -3.607   9.660
  567    HB1  ALA  67           HB1      ALA  67 -16.164  -2.221  12.011
  568    HB2  ALA  67           HB2      ALA  67 -16.997  -2.917  10.620
  569    HB3  ALA  67           HB3      ALA  67 -16.128  -3.965  11.743
  570    H    LEU  68           H        LEU  68 -16.143  -2.018   8.380
  571    HA   LEU  68           HA       LEU  68 -14.466   0.171   7.726
  572    HB2  LEU  68           HB2      LEU  68 -17.270  -0.466   6.884
  573    HB3  LEU  68           HB3      LEU  68 -16.290   0.786   6.158
  574    HG   LEU  68           HG       LEU  68 -15.665  -2.168   6.138
  575   HD11  LEU  68          HD11      LEU  68 -16.646  -0.352   3.942
  576   HD12  LEU  68          HD12      LEU  68 -16.175  -2.042   3.754
  577   HD13  LEU  68          HD13      LEU  68 -17.577  -1.621   4.739
  578   HD21  LEU  68          HD21      LEU  68 -13.653  -0.802   6.145
  579   HD22  LEU  68          HD22      LEU  68 -13.892  -1.553   4.568
  580   HD23  LEU  68          HD23      LEU  68 -14.278   0.152   4.799
  581    H    ASP  69           H        ASP  69 -17.762   0.110   9.077
  582    HA   ASP  69           HA       ASP  69 -17.997   2.892   9.401
  583    HB2  ASP  69           HB2      ASP  69 -19.971   1.599   9.268
  584    HB3  ASP  69           HB3      ASP  69 -19.478   0.556  10.593
  585    H    TYR  70           H        TYR  70 -16.349   0.553  11.303
  586    HA   TYR  70           HA       TYR  70 -16.239   1.860  13.770
  587    HB2  TYR  70           HB2      TYR  70 -15.241  -0.218  13.874
  588    HB3  TYR  70           HB3      TYR  70 -14.458  -0.055  12.307
  589    HD1  TYR  70           HD1      TYR  70 -14.261   0.794  15.875
  590    HD2  TYR  70           HD2      TYR  70 -12.245   0.898  12.131
  591    HE1  TYR  70           HE1      TYR  70 -12.165   1.336  17.029
  592    HE2  TYR  70           HE2      TYR  70 -10.135   1.439  13.278
  593    HH   TYR  70           HH       TYR  70  -9.727   1.088  16.610
  594    H    TYR  71           H        TYR  71 -14.646   2.479  10.725
  595    HA   TYR  71           HA       TYR  71 -12.930   4.537  11.776
  596    HB2  TYR  71           HB2      TYR  71 -13.389   3.274   9.150
  597    HB3  TYR  71           HB3      TYR  71 -12.910   4.966   9.094
  598    HD1  TYR  71           HD1      TYR  71 -10.734   5.662  10.009
  599    HD2  TYR  71           HD2      TYR  71 -11.865   1.568   9.852
  600    HE1  TYR  71           HE1      TYR  71  -8.388   5.005  10.344
  601    HE2  TYR  71           HE2      TYR  71  -9.524   0.898  10.190
  602    HH   TYR  71           HH       TYR  71  -7.093   3.153  11.118
  603    H    MET  72           H        MET  72 -13.186   6.483   9.802
  604    HA   MET  72           HA       MET  72 -15.570   7.832  10.832
  605    HB2  MET  72           HB2      MET  72 -13.095   8.946   9.494
  606    HB3  MET  72           HB3      MET  72 -14.428   9.906  10.118
  607    HG2  MET  72           HG2      MET  72 -13.957   9.124  12.370
  608    HG3  MET  72           HG3      MET  72 -12.641   8.125  11.756
  609    HE1  MET  72           HE1      MET  72 -10.102  10.833  10.483
  610    HE2  MET  72           HE2      MET  72 -10.395   9.109  10.710
  611    HE3  MET  72           HE3      MET  72 -11.353  10.020   9.543
  612    H    LEU  73           H        LEU  73 -15.743   5.897   8.603
  613    HA   LEU  73           HA       LEU  73 -16.381   7.773   6.423
  614    HB2  LEU  73           HB2      LEU  73 -16.161   5.686   4.943
  615    HB3  LEU  73           HB3      LEU  73 -14.705   6.477   5.509
  616    HG   LEU  73           HG       LEU  73 -14.692   4.711   7.377
  617   HD11  LEU  73          HD11      LEU  73 -16.946   3.876   7.067
  618   HD12  LEU  73          HD12      LEU  73 -16.544   3.367   5.425
  619   HD13  LEU  73          HD13      LEU  73 -15.754   2.599   6.803
  620   HD21  LEU  73          HD21      LEU  73 -13.557   3.104   5.927
  621   HD22  LEU  73          HD22      LEU  73 -14.229   3.919   4.513
  622   HD23  LEU  73          HD23      LEU  73 -13.090   4.766   5.560
  623    H    ARG  74           H        ARG  74 -18.153   7.329   5.110
  624    HA   ARG  74           HA       ARG  74 -20.277   5.657   6.093
  625    HB2  ARG  74           HB2      ARG  74 -21.712   7.457   6.903
  626    HB3  ARG  74           HB3      ARG  74 -20.206   7.492   7.777
  627    HG2  ARG  74           HG2      ARG  74 -20.114   9.152   5.427
  628    HG3  ARG  74           HG3      ARG  74 -21.458   9.587   6.485
  629    HD2  ARG  74           HD2      ARG  74 -20.080  10.558   7.872
  630    HD3  ARG  74           HD3      ARG  74 -19.166   9.072   8.067
  631    HE   ARG  74           HE       ARG  74 -18.116   9.875   5.811
  632   HH11  ARG  74          HH11      ARG  74 -18.935  11.867   8.585
  633   HH12  ARG  74          HH12      ARG  74 -17.674  13.027   8.274
  634   HH21  ARG  74          HH21      ARG  74 -16.489  11.376   5.394
  635   HH22  ARG  74          HH22      ARG  74 -16.279  12.756   6.442
  636    H    ASN  75           H        ASN  75 -22.388   7.234   5.144
  637    HA   ASN  75           HA       ASN  75 -22.313   6.721   2.372
  638    HB2  ASN  75           HB2      ASN  75 -24.201   8.215   4.161
  639    HB3  ASN  75           HB3      ASN  75 -24.401   8.293   2.414
  640   HD21  ASN  75          HD21      ASN  75 -24.468   6.226   5.221
  641   HD22  ASN  75          HD22      ASN  75 -25.320   4.917   4.456
  642    H    GLY  76           H        GLY  76 -20.856   7.743   1.138
  643    HA2  GLY  76           HA2      GLY  76 -21.057   9.837  -0.280
  644    HA3  GLY  76           HA3      GLY  76 -20.869  10.698   1.238
  645    H    ASP  77           H        ASP  77 -18.923   8.438   2.016
  646    HA   ASP  77           HA       ASP  77 -16.602   9.920   1.206
  647    HB2  ASP  77           HB2      ASP  77 -16.884   7.395   2.841
  648    HB3  ASP  77           HB3      ASP  77 -15.346   8.187   2.521
  649    H    THR  78           H        THR  78 -14.896   9.240  -0.031
  650    HA   THR  78           HA       THR  78 -15.460   7.111  -1.935
  651    HB   THR  78           HB       THR  78 -13.174   9.098  -1.860
  652    HG1  THR  78           HG1      THR  78 -15.175  10.133  -2.200
  653   HG21  THR  78          HG21      THR  78 -14.109   7.231  -4.044
  654   HG22  THR  78          HG22      THR  78 -12.597   7.113  -3.142
  655   HG23  THR  78          HG23      THR  78 -12.872   8.473  -4.230
  656    H    MET  79           H        MET  79 -14.468   5.175  -1.876
  657    HA   MET  79           HA       MET  79 -12.151   4.870  -0.092
  658    HB2  MET  79           HB2      MET  79 -14.323   3.889   0.828
  659    HB3  MET  79           HB3      MET  79 -14.247   2.736  -0.498
  660    HG2  MET  79           HG2      MET  79 -12.058   1.972   0.309
  661    HG3  MET  79           HG3      MET  79 -12.178   3.100   1.657
  662    HE1  MET  79           HE1      MET  79 -14.771  -0.656   1.060
  663    HE2  MET  79           HE2      MET  79 -14.877   0.732  -0.024
  664    HE3  MET  79           HE3      MET  79 -13.384  -0.205   0.060
  665    H    GLU  80           H        GLU  80 -10.475   4.393  -1.282
  666    HA   GLU  80           HA       GLU  80 -10.805   3.578  -4.025
  667    HB2  GLU  80           HB2      GLU  80  -9.077   5.236  -2.989
  668    HB3  GLU  80           HB3      GLU  80  -8.179   3.788  -2.566
  669    HG2  GLU  80           HG2      GLU  80  -7.830   3.208  -4.810
  670    HG3  GLU  80           HG3      GLU  80  -9.055   4.342  -5.378
  671    H    TYR  81           H        TYR  81 -10.848   1.471  -4.707
  672    HA   TYR  81           HA       TYR  81  -9.767  -0.565  -2.916
  673    HB2  TYR  81           HB2      TYR  81 -12.082  -0.890  -3.770
  674    HB3  TYR  81           HB3      TYR  81 -11.462  -0.855  -5.416
  675    HD1  TYR  81           HD1      TYR  81 -11.510  -2.802  -2.270
  676    HD2  TYR  81           HD2      TYR  81 -10.455  -2.784  -6.392
  677    HE1  TYR  81           HE1      TYR  81 -11.123  -5.229  -2.178
  678    HE2  TYR  81           HE2      TYR  81 -10.076  -5.210  -6.310
  679    HH   TYR  81           HH       TYR  81  -9.650  -6.951  -4.804
  680    H    ARG  82           H        ARG  82  -7.708  -0.891  -3.261
  681    HA   ARG  82           HA       ARG  82  -6.739  -0.939  -6.013
  682    HB2  ARG  82           HB2      ARG  82  -4.703   0.380  -5.259
  683    HB3  ARG  82           HB3      ARG  82  -6.198   1.285  -5.453
  684    HG2  ARG  82           HG2      ARG  82  -6.553   1.157  -3.017
  685    HG3  ARG  82           HG3      ARG  82  -4.998   0.336  -2.861
  686    HD2  ARG  82           HD2      ARG  82  -5.388   3.082  -4.044
  687    HD3  ARG  82           HD3      ARG  82  -4.896   2.767  -2.382
  688    HE   ARG  82           HE       ARG  82  -3.022   1.437  -3.762
  689   HH11  ARG  82          HH11      ARG  82  -4.321   4.665  -4.206
  690   HH12  ARG  82          HH12      ARG  82  -2.798   5.333  -4.740
  691   HH21  ARG  82          HH21      ARG  82  -1.056   2.293  -4.476
  692   HH22  ARG  82          HH22      ARG  82  -0.940   3.972  -4.911
  693    H    LYS  83           H        LYS  83  -4.547  -1.838  -6.168
  694    HA   LYS  83           HA       LYS  83  -4.311  -4.284  -4.846
  695    HB2  LYS  83           HB2      LYS  83  -3.239  -3.579  -7.031
  696    HB3  LYS  83           HB3      LYS  83  -2.058  -2.686  -6.086
  697    HG2  LYS  83           HG2      LYS  83  -1.237  -4.719  -5.099
  698    HG3  LYS  83           HG3      LYS  83  -2.510  -5.656  -5.902
  699    HD2  LYS  83           HD2      LYS  83  -1.591  -5.095  -8.069
  700    HD3  LYS  83           HD3      LYS  83  -0.391  -4.042  -7.323
  701    HE2  LYS  83           HE2      LYS  83   0.681  -6.096  -7.901
  702    HE3  LYS  83           HE3      LYS  83   0.529  -6.034  -6.145
  703    HZ1  LYS  83           HZ1      LYS  83  -0.039  -8.215  -7.129
  704    HZ2  LYS  83           HZ2      LYS  83  -1.345  -7.492  -7.934
  705    HZ3  LYS  83           HZ3      LYS  83  -1.309  -7.534  -6.243
  706    H    LYS  84           H        LYS  84  -3.559  -4.809  -2.884
  707    HA   LYS  84           HA       LYS  84  -3.091  -3.004  -0.839
  708    HB2  LYS  84           HB2      LYS  84  -2.465  -5.883  -1.263
  709    HB3  LYS  84           HB3      LYS  84  -1.662  -5.076   0.073
  710    HG2  LYS  84           HG2      LYS  84  -4.637  -5.259  -0.341
  711    HG3  LYS  84           HG3      LYS  84  -3.682  -6.216   0.795
  712    HD2  LYS  84           HD2      LYS  84  -2.927  -3.713   1.487
  713    HD3  LYS  84           HD3      LYS  84  -4.584  -3.418   0.959
  714    HE2  LYS  84           HE2      LYS  84  -4.686  -3.863   3.283
  715    HE3  LYS  84           HE3      LYS  84  -5.281  -5.311   2.468
  716    HZ1  LYS  84           HZ1      LYS  84  -2.543  -4.931   3.560
  717    HZ2  LYS  84           HZ2      LYS  84  -3.094  -6.322   2.764
  718    HZ3  LYS  84           HZ3      LYS  84  -3.763  -5.877   4.256
  719    H    GLN  85           H        GLN  85  -0.955  -4.294  -3.191
  720    HA   GLN  85           HA       GLN  85   1.427  -3.207  -1.951
  721    HB2  GLN  85           HB2      GLN  85   1.629  -4.520  -4.574
  722    HB3  GLN  85           HB3      GLN  85   2.553  -4.797  -3.102
  723    HG2  GLN  85           HG2      GLN  85   0.471  -5.966  -2.223
  724    HG3  GLN  85           HG3      GLN  85  -0.095  -5.951  -3.893
  725   HE21  GLN  85          HE21      GLN  85   2.116  -7.300  -1.628
  726   HE22  GLN  85          HE22      GLN  85   2.741  -8.538  -2.653
  727    H    ARG  86           H        ARG  86   2.700  -1.676  -2.927
  728    HA   ARG  86           HA       ARG  86   1.548  -0.317  -5.266
  729    HB2  ARG  86           HB2      ARG  86   2.914   1.698  -4.234
  730    HB3  ARG  86           HB3      ARG  86   1.283   1.330  -3.702
  731    HG2  ARG  86           HG2      ARG  86   2.510   1.747  -1.754
  732    HG3  ARG  86           HG3      ARG  86   2.326  -0.002  -1.830
  733    HD2  ARG  86           HD2      ARG  86   4.581   0.628  -1.148
  734    HD3  ARG  86           HD3      ARG  86   4.599  -0.215  -2.697
  735    HE   ARG  86           HE       ARG  86   5.485   1.645  -3.647
  736   HH11  ARG  86          HH11      ARG  86   3.941   2.636  -0.634
  737   HH12  ARG  86          HH12      ARG  86   4.569   4.254  -0.723
  738   HH21  ARG  86          HH21      ARG  86   6.336   3.759  -3.716
  739   HH22  ARG  86          HH22      ARG  86   5.909   4.899  -2.479
  740    HA   PRO  87           HA       PRO  87   5.216  -1.122  -7.468
  741    HB2  PRO  87           HB2      PRO  87   5.208   1.555  -8.659
  742    HB3  PRO  87           HB3      PRO  87   4.927  -0.011  -9.422
  743    HG2  PRO  87           HG2      PRO  87   2.948   1.786  -9.048
  744    HG3  PRO  87           HG3      PRO  87   2.669   0.036  -9.006
  745    HD2  PRO  87           HD2      PRO  87   2.928   1.972  -6.737
  746    HD3  PRO  87           HD3      PRO  87   1.821   0.594  -6.926
  747    H    LEU  88           H        LEU  88   6.982  -1.249  -6.267
  748    HA   LEU  88           HA       LEU  88   8.260   1.227  -5.351
  749    HB2  LEU  88           HB2      LEU  88   8.404  -1.614  -4.431
  750    HB3  LEU  88           HB3      LEU  88   9.736  -0.520  -4.098
  751    HG   LEU  88           HG       LEU  88   6.885   0.038  -3.287
  752   HD11  LEU  88          HD11      LEU  88   9.151  -1.084  -1.652
  753   HD12  LEU  88          HD12      LEU  88   7.575  -0.587  -1.034
  754   HD13  LEU  88          HD13      LEU  88   7.695  -1.952  -2.143
  755   HD21  LEU  88          HD21      LEU  88   9.523   1.280  -2.531
  756   HD22  LEU  88          HD22      LEU  88   8.262   2.014  -3.521
  757   HD23  LEU  88          HD23      LEU  88   7.962   1.687  -1.812
  758    H    LYS  89           H        LYS  89   9.773   2.010  -6.641
  759    HA   LYS  89           HA       LYS  89  11.227   0.218  -8.406
  760    HB2  LYS  89           HB2      LYS  89  11.214   3.223  -8.152
  761    HB3  LYS  89           HB3      LYS  89  12.302   2.348  -9.224
  762    HG2  LYS  89           HG2      LYS  89  10.035   1.273 -10.050
  763    HG3  LYS  89           HG3      LYS  89   9.381   2.790  -9.428
  764    HD2  LYS  89           HD2      LYS  89  11.670   2.592 -11.372
  765    HD3  LYS  89           HD3      LYS  89   9.993   2.852 -11.830
  766    HE2  LYS  89           HE2      LYS  89  11.509   4.659  -9.962
  767    HE3  LYS  89           HE3      LYS  89  11.407   4.926 -11.701
  768    HZ1  LYS  89           HZ1      LYS  89   9.098   5.278 -11.571
  769    HZ2  LYS  89           HZ2      LYS  89   9.756   6.164 -10.282
  770    HZ3  LYS  89           HZ3      LYS  89   9.000   4.675  -9.990
  771    H    ILE  90           H        ILE  90  13.055  -0.633  -7.842
  772    HA   ILE  90           HA       ILE  90  14.524   0.520  -5.560
  773    HB   ILE  90           HB       ILE  90  13.960  -2.422  -5.996
  774   HG12  ILE  90          HG12      ILE  90  11.971  -1.184  -5.213
  775   HG13  ILE  90          HG13      ILE  90  12.572  -2.306  -3.998
  776   HG21  ILE  90          HG21      ILE  90  15.457  -0.987  -3.813
  777   HG22  ILE  90          HG22      ILE  90  14.994  -2.689  -3.759
  778   HG23  ILE  90          HG23      ILE  90  16.115  -2.119  -4.997
  779   HD11  ILE  90          HD11      ILE  90  13.637  -0.452  -2.820
  780   HD12  ILE  90          HD12      ILE  90  13.022   0.667  -4.036
  781   HD13  ILE  90          HD13      ILE  90  11.899  -0.208  -2.996
  782    H    ARG  91           H        ARG  91  16.701   0.682  -5.908
  783    HA   ARG  91           HA       ARG  91  17.783  -0.761  -8.227
  784    HB2  ARG  91           HB2      ARG  91  17.981   1.764  -8.162
  785    HB3  ARG  91           HB3      ARG  91  19.034   1.565  -6.769
  786    HG2  ARG  91           HG2      ARG  91  20.621   0.311  -8.097
  787    HG3  ARG  91           HG3      ARG  91  19.556   0.422  -9.500
  788    HD2  ARG  91           HD2      ARG  91  20.767   2.776  -8.057
  789    HD3  ARG  91           HD3      ARG  91  21.402   2.069  -9.543
  790    HE   ARG  91           HE       ARG  91  18.882   2.635 -10.252
  791   HH11  ARG  91          HH11      ARG  91  21.303   4.562  -8.612
  792   HH12  ARG  91          HH12      ARG  91  20.706   6.066  -9.237
  793   HH21  ARG  91          HH21      ARG  91  18.111   4.604 -11.089
  794   HH22  ARG  91          HH22      ARG  91  18.913   6.095 -10.665
  795    H    MET  92           H        MET  92  19.028  -2.442  -7.826
  796    HA   MET  92           HA       MET  92  19.666  -3.151  -5.115
  797    HB2  MET  92           HB2      MET  92  19.500  -4.464  -7.730
  798    HB3  MET  92           HB3      MET  92  20.791  -5.076  -6.708
  799    HG2  MET  92           HG2      MET  92  18.522  -6.212  -6.612
  800    HG3  MET  92           HG3      MET  92  19.316  -5.834  -5.088
  801    HE1  MET  92           HE1      MET  92  16.347  -5.096  -7.495
  802    HE2  MET  92           HE2      MET  92  15.717  -3.576  -6.860
  803    HE3  MET  92           HE3      MET  92  17.303  -3.621  -7.632
  804    H    LEU  93           H        LEU  93  21.878  -4.425  -4.992
  805    HA   LEU  93           HA       LEU  93  23.733  -2.424  -4.500
  806    HB2  LEU  93           HB2      LEU  93  24.289  -5.372  -4.838
  807    HB3  LEU  93           HB3      LEU  93  25.345  -4.218  -4.056
  808    HG   LEU  93           HG       LEU  93  24.381  -5.294  -2.264
  809   HD11  LEU  93          HD11      LEU  93  22.772  -3.778  -1.223
  810   HD12  LEU  93          HD12      LEU  93  24.116  -2.913  -1.970
  811   HD13  LEU  93          HD13      LEU  93  22.545  -2.967  -2.771
  812   HD21  LEU  93          HD21      LEU  93  22.762  -6.583  -3.650
  813   HD22  LEU  93          HD22      LEU  93  22.136  -6.068  -2.083
  814   HD23  LEU  93          HD23      LEU  93  21.660  -5.212  -3.546
  815    H    ASP  94           H        ASP  94  23.659  -4.803  -7.126
  816    HA   ASP  94           HA       ASP  94  26.098  -4.001  -8.323
  817    HB2  ASP  94           HB2      ASP  94  24.919  -6.187  -8.699
  818    HB3  ASP  94           HB3      ASP  94  23.737  -5.324  -9.675
  819    H    GLY  95           H        GLY  95  23.077  -2.494  -8.186
  820    HA2  GLY  95           HA2      GLY  95  22.746  -0.294  -9.053
  821    HA3  GLY  95           HA3      GLY  95  23.836  -0.683 -10.379
  822    H    THR  96           H        THR  96  21.643  -3.146  -9.589
  823    HA   THR  96           HA       THR  96  20.272  -2.735 -12.118
  824    HB   THR  96           HB       THR  96  20.030  -5.045 -10.178
  825    HG1  THR  96           HG1      THR  96  22.008  -4.360 -11.972
  826   HG21  THR  96          HG21      THR  96  19.202  -6.280 -12.131
  827   HG22  THR  96          HG22      THR  96  19.314  -4.814 -13.105
  828   HG23  THR  96          HG23      THR  96  18.176  -4.894 -11.760
  829    H    VAL  97           H        VAL  97  18.210  -2.025 -12.268
  830    HA   VAL  97           HA       VAL  97  16.850  -1.534  -9.707
  831    HB   VAL  97           HB       VAL  97  17.355   0.513 -10.943
  832   HG11  VAL  97          HG11      VAL  97  15.640  -0.638 -13.131
  833   HG12  VAL  97          HG12      VAL  97  16.272   1.007 -13.076
  834   HG13  VAL  97          HG13      VAL  97  17.380  -0.359 -13.202
  835   HG21  VAL  97          HG21      VAL  97  14.408  -0.124 -10.931
  836   HG22  VAL  97          HG22      VAL  97  15.350   0.476  -9.567
  837   HG23  VAL  97          HG23      VAL  97  15.110   1.492 -10.988
  838    H    LYS  98           H        LYS  98  14.829  -2.200  -9.371
  839    HA   LYS  98           HA       LYS  98  13.348  -3.426 -11.574
  840    HB2  LYS  98           HB2      LYS  98  12.830  -5.445 -10.462
  841    HB3  LYS  98           HB3      LYS  98  14.568  -5.257 -10.303
  842    HG2  LYS  98           HG2      LYS  98  14.416  -4.724  -8.028
  843    HG3  LYS  98           HG3      LYS  98  12.687  -4.392  -8.134
  844    HD2  LYS  98           HD2      LYS  98  13.898  -7.118  -8.593
  845    HD3  LYS  98           HD3      LYS  98  13.287  -6.585  -7.024
  846    HE2  LYS  98           HE2      LYS  98  11.494  -7.755  -7.913
  847    HE3  LYS  98           HE3      LYS  98  11.099  -6.078  -8.300
  848    HZ1  LYS  98           HZ1      LYS  98  12.404  -7.961 -10.197
  849    HZ2  LYS  98           HZ2      LYS  98  11.807  -6.411 -10.544
  850    HZ3  LYS  98           HZ3      LYS  98  10.735  -7.660 -10.149
  851    H    THR  99           H        THR  99  11.063  -3.549 -11.189
  852    HA   THR  99           HA       THR  99  10.176  -1.815  -8.984
  853    HB   THR  99           HB       THR  99   8.774  -2.337 -11.618
  854    HG1  THR  99           HG1      THR  99  10.733  -0.979 -11.688
  855   HG21  THR  99          HG21      THR  99   7.256  -1.879  -9.750
  856   HG22  THR  99          HG22      THR  99   7.265  -0.547 -10.907
  857   HG23  THR  99          HG23      THR  99   8.145  -0.400  -9.384
  858    H    ILE 100           H        ILE 100   9.241  -2.972  -7.401
  859    HA   ILE 100           HA       ILE 100   7.893  -5.479  -8.147
  860    HB   ILE 100           HB       ILE 100  10.104  -5.846  -7.063
  861   HG12  ILE 100          HG12      ILE 100   7.918  -7.303  -6.755
  862   HG13  ILE 100          HG13      ILE 100   9.404  -7.693  -5.903
  863   HG21  ILE 100          HG21      ILE 100   8.838  -4.512  -4.679
  864   HG22  ILE 100          HG22      ILE 100  10.375  -5.376  -4.671
  865   HG23  ILE 100          HG23      ILE 100  10.194  -3.907  -5.629
  866   HD11  ILE 100          HD11      ILE 100   8.548  -6.608  -3.900
  867   HD12  ILE 100          HD12      ILE 100   7.067  -6.181  -4.758
  868   HD13  ILE 100          HD13      ILE 100   7.457  -7.875  -4.461
  869    H    MET 101           H        MET 101   5.991  -5.965  -7.002
  870    HA   MET 101           HA       MET 101   4.753  -3.624  -5.789
  871    HB2  MET 101           HB2      MET 101   3.573  -6.342  -6.395
  872    HB3  MET 101           HB3      MET 101   2.678  -4.896  -5.955
  873    HG2  MET 101           HG2      MET 101   4.323  -5.221  -8.453
  874    HG3  MET 101           HG3      MET 101   2.573  -5.402  -8.355
  875    HE1  MET 101           HE1      MET 101   1.936  -3.062  -6.204
  876    HE2  MET 101           HE2      MET 101   1.494  -1.760  -7.311
  877    HE3  MET 101           HE3      MET 101   0.942  -3.407  -7.619
  878    H    VAL 102           H        VAL 102   5.127  -3.325  -3.769
  879    HA   VAL 102           HA       VAL 102   5.053  -5.599  -1.884
  880    HB   VAL 102           HB       VAL 102   6.222  -2.875  -1.328
  881   HG11  VAL 102          HG11      VAL 102   7.395  -4.042   0.480
  882   HG12  VAL 102          HG12      VAL 102   5.643  -4.170   0.640
  883   HG13  VAL 102          HG13      VAL 102   6.576  -5.540   0.036
  884   HG21  VAL 102          HG21      VAL 102   7.623  -5.330  -2.366
  885   HG22  VAL 102          HG22      VAL 102   7.456  -3.769  -3.174
  886   HG23  VAL 102          HG23      VAL 102   8.437  -3.906  -1.714
  887    H    ASP 103           H        ASP 103   3.446  -5.679  -0.450
  888    HA   ASP 103           HA       ASP 103   1.196  -4.091  -0.457
  889    HB2  ASP 103           HB2      ASP 103   2.402  -5.556   1.906
  890    HB3  ASP 103           HB3      ASP 103   0.757  -4.938   1.839
  891    H    ASP 104           H        ASP 104   0.743  -2.041   0.252
  892    HA   ASP 104           HA       ASP 104   2.956  -0.552   1.356
  893    HB2  ASP 104           HB2      ASP 104   1.331   0.392  -0.335
  894    HB3  ASP 104           HB3      ASP 104   0.144   0.472   0.966
  895    H    SER 105           H        SER 105   0.379  -2.335   2.590
  896    HA   SER 105           HA       SER 105   0.065  -0.803   5.024
  897    HB2  SER 105           HB2      SER 105  -1.377  -2.793   5.685
  898    HB3  SER 105           HB3      SER 105  -1.890  -1.911   4.249
  899    HG   SER 105           HG       SER 105  -0.572  -4.425   4.402
  900    H    LYS 106           H        LYS 106   2.516  -0.953   5.312
  901    HA   LYS 106           HA       LYS 106   3.181  -2.728   7.391
  902    HB2  LYS 106           HB2      LYS 106   4.923  -4.075   6.198
  903    HB3  LYS 106           HB3      LYS 106   3.275  -4.468   5.741
  904    HG2  LYS 106           HG2      LYS 106   4.448  -4.457   3.735
  905    HG3  LYS 106           HG3      LYS 106   3.634  -2.894   3.765
  906    HD2  LYS 106           HD2      LYS 106   5.954  -2.245   4.956
  907    HD3  LYS 106           HD3      LYS 106   6.505  -3.550   3.905
  908    HE2  LYS 106           HE2      LYS 106   6.708  -1.375   2.816
  909    HE3  LYS 106           HE3      LYS 106   5.546  -2.406   1.979
  910    HZ1  LYS 106           HZ1      LYS 106   4.785  -0.087   2.284
  911    HZ2  LYS 106           HZ2      LYS 106   4.794  -0.326   3.962
  912    HZ3  LYS 106           HZ3      LYS 106   3.753  -1.229   2.980
  913    H    THR 107           H        THR 107   5.643  -2.716   7.790
  914    HA   THR 107           HA       THR 107   6.552   0.045   7.428
  915    HB   THR 107           HB       THR 107   8.197  -0.568   9.246
  916    HG1  THR 107           HG1      THR 107   6.511  -2.857   9.543
  917   HG21  THR 107          HG21      THR 107   6.149   0.661   9.743
  918   HG22  THR 107          HG22      THR 107   6.519  -0.474  11.041
  919   HG23  THR 107          HG23      THR 107   5.255  -0.854   9.872
  920    H    VAL 108           H        VAL 108   9.266  -0.183   7.816
  921    HA   VAL 108           HA       VAL 108  10.118  -0.579   5.169
  922    HB   VAL 108           HB       VAL 108  11.853  -0.426   7.622
  923   HG11  VAL 108          HG11      VAL 108  13.061  -1.129   5.641
  924   HG12  VAL 108          HG12      VAL 108  12.422   0.248   4.744
  925   HG13  VAL 108          HG13      VAL 108  13.525   0.511   6.094
  926   HG21  VAL 108          HG21      VAL 108  10.295   1.432   7.601
  927   HG22  VAL 108          HG22      VAL 108  11.926   1.990   7.229
  928   HG23  VAL 108          HG23      VAL 108  10.740   1.806   5.936
  929    H    THR 109           H        THR 109  11.010  -2.384   8.091
  930    HA   THR 109           HA       THR 109  12.627  -4.313   7.038
  931    HB   THR 109           HB       THR 109  10.594  -4.888   9.190
  932    HG1  THR 109           HG1      THR 109  11.629  -3.519  10.430
  933   HG21  THR 109          HG21      THR 109  11.941  -6.805   8.469
  934   HG22  THR 109          HG22      THR 109  12.384  -6.301  10.099
  935   HG23  THR 109          HG23      THR 109  13.416  -5.875   8.733
  936    H    ASP 110           H        ASP 110   9.065  -4.401   7.110
  937    HA   ASP 110           HA       ASP 110   8.885  -7.073   6.121
  938    HB2  ASP 110           HB2      ASP 110   7.078  -6.020   7.430
  939    HB3  ASP 110           HB3      ASP 110   6.819  -4.859   6.131
  940    H    MET 111           H        MET 111   8.743  -3.860   4.720
  941    HA   MET 111           HA       MET 111   8.238  -4.568   2.049
  942    HB2  MET 111           HB2      MET 111   8.015  -2.290   2.606
  943    HB3  MET 111           HB3      MET 111   9.597  -2.229   3.365
  944    HG2  MET 111           HG2      MET 111  10.666  -2.394   1.190
  945    HG3  MET 111           HG3      MET 111   9.090  -2.515   0.412
  946    HE1  MET 111           HE1      MET 111  11.002  -0.390   3.033
  947    HE2  MET 111           HE2      MET 111  10.291   1.216   2.830
  948    HE3  MET 111           HE3      MET 111   9.324  -0.094   3.504
  949    H    LEU 112           H        LEU 112  11.271  -4.110   3.820
  950    HA   LEU 112           HA       LEU 112  13.032  -4.606   1.691
  951    HB2  LEU 112           HB2      LEU 112  13.487  -3.713   4.078
  952    HB3  LEU 112           HB3      LEU 112  13.615  -5.405   4.526
  953    HG   LEU 112           HG       LEU 112  15.396  -5.616   2.721
  954   HD11  LEU 112          HD11      LEU 112  15.228  -2.611   2.893
  955   HD12  LEU 112          HD12      LEU 112  16.504  -3.521   2.081
  956   HD13  LEU 112          HD13      LEU 112  14.845  -3.601   1.484
  957   HD21  LEU 112          HD21      LEU 112  17.135  -4.676   4.153
  958   HD22  LEU 112          HD22      LEU 112  15.913  -3.781   5.056
  959   HD23  LEU 112          HD23      LEU 112  15.925  -5.544   5.097
  960    H    MET 113           H        MET 113  11.580  -6.742   4.093
  961    HA   MET 113           HA       MET 113  12.765  -9.164   3.449
  962    HB2  MET 113           HB2      MET 113  11.188  -8.753   5.333
  963    HB3  MET 113           HB3      MET 113   9.867  -8.699   4.180
  964    HG2  MET 113           HG2      MET 113  10.388 -11.027   3.535
  965    HG3  MET 113           HG3      MET 113  11.615 -11.065   4.801
  966    HE1  MET 113           HE1      MET 113   9.404 -10.578   8.029
  967    HE2  MET 113           HE2      MET 113  11.043 -10.791   7.413
  968    HE3  MET 113           HE3      MET 113  10.159  -9.304   7.072
  969    H    THR 114           H        THR 114   9.955  -7.598   2.063
  970    HA   THR 114           HA       THR 114   9.278  -9.628   0.230
  971    HB   THR 114           HB       THR 114   8.642  -6.677   0.215
  972    HG1  THR 114           HG1      THR 114   7.747  -7.546   2.029
  973   HG21  THR 114          HG21      THR 114   8.274  -7.646  -1.993
  974   HG22  THR 114          HG22      THR 114   6.732  -7.301  -1.210
  975   HG23  THR 114          HG23      THR 114   7.336  -8.956  -1.277
  976    H    ILE 115           H        ILE 115  11.260  -6.674  -0.093
  977    HA   ILE 115           HA       ILE 115  11.457  -6.869  -2.935
  978    HB   ILE 115           HB       ILE 115  13.144  -5.292  -0.986
  979   HG12  ILE 115          HG12      ILE 115  10.812  -4.407  -2.699
  980   HG13  ILE 115          HG13      ILE 115  10.705  -4.760  -0.978
  981   HG21  ILE 115          HG21      ILE 115  13.778  -3.941  -2.926
  982   HG22  ILE 115          HG22      ILE 115  14.284  -5.619  -3.118
  983   HG23  ILE 115          HG23      ILE 115  12.864  -5.021  -3.979
  984   HD11  ILE 115          HD11      ILE 115  10.849  -2.375  -1.381
  985   HD12  ILE 115          HD12      ILE 115  12.272  -2.950  -0.511
  986   HD13  ILE 115          HD13      ILE 115  12.375  -2.599  -2.237
  987    H    CYS 116           H        CYS 116  13.651  -7.639  -0.249
  988    HA   CYS 116           HA       CYS 116  15.836  -8.383  -1.890
  989    HB2  CYS 116           HB2      CYS 116  15.212  -9.205   0.952
  990    HB3  CYS 116           HB3      CYS 116  16.774  -9.370   0.157
  991    HG   CYS 116           HG       CYS 116  16.318  -6.317  -0.274
  992    H    ALA 117           H        ALA 117  13.007 -10.068  -0.778
  993    HA   ALA 117           HA       ALA 117  13.945 -12.708  -1.266
  994    HB1  ALA 117           HB1      ALA 117  12.047 -12.266   0.207
  995    HB2  ALA 117           HB2      ALA 117  11.113 -11.674  -1.167
  996    HB3  ALA 117           HB3      ALA 117  11.602 -13.367  -1.098
  997    H    ARG 118           H        ARG 118  12.650 -10.184  -3.272
  998    HA   ARG 118           HA       ARG 118  11.889 -11.855  -5.461
  999    HB2  ARG 118           HB2      ARG 118  12.701  -8.951  -5.718
 1000    HB3  ARG 118           HB3      ARG 118  11.595  -9.872  -6.729
 1001    HG2  ARG 118           HG2      ARG 118  11.114  -8.996  -3.896
 1002    HG3  ARG 118           HG3      ARG 118  10.372  -8.332  -5.348
 1003    HD2  ARG 118           HD2      ARG 118  10.056 -11.170  -4.388
 1004    HD3  ARG 118           HD3      ARG 118   8.900  -9.870  -4.111
 1005    HE   ARG 118           HE       ARG 118   9.515 -10.304  -6.896
 1006   HH11  ARG 118          HH11      ARG 118   7.481 -11.224  -4.187
 1007   HH12  ARG 118          HH12      ARG 118   6.194 -11.830  -5.192
 1008   HH21  ARG 118          HH21      ARG 118   7.804 -11.099  -8.225
 1009   HH22  ARG 118          HH22      ARG 118   6.382 -11.763  -7.473
 1010    H    ILE 119           H        ILE 119  14.812 -10.148  -4.501
 1011    HA   ILE 119           HA       ILE 119  16.216 -10.586  -6.941
 1012    HB   ILE 119           HB       ILE 119  17.709 -10.243  -4.384
 1013   HG12  ILE 119          HG12      ILE 119  15.757  -8.779  -4.057
 1014   HG13  ILE 119          HG13      ILE 119  17.229  -7.843  -4.290
 1015   HG21  ILE 119          HG21      ILE 119  18.896 -10.300  -6.494
 1016   HG22  ILE 119          HG22      ILE 119  17.911  -8.972  -7.108
 1017   HG23  ILE 119          HG23      ILE 119  19.024  -8.698  -5.768
 1018   HD11  ILE 119          HD11      ILE 119  15.118  -8.355  -6.370
 1019   HD12  ILE 119          HD12      ILE 119  15.351  -6.858  -5.464
 1020   HD13  ILE 119          HD13      ILE 119  16.587  -7.405  -6.597
 1021    H    GLY 120           H        GLY 120  15.996 -12.212  -3.832
 1022    HA2  GLY 120           HA2      GLY 120  16.233 -14.659  -3.850
 1023    HA3  GLY 120           HA3      GLY 120  17.588 -14.436  -4.950
 1024    H    ILE 121           H        ILE 121  16.823 -12.615  -2.026
 1025    HA   ILE 121           HA       ILE 121  19.425 -13.422  -0.909
 1026    HB   ILE 121           HB       ILE 121  17.717 -11.022  -0.219
 1027   HG12  ILE 121          HG12      ILE 121  20.336 -11.085  -1.726
 1028   HG13  ILE 121          HG13      ILE 121  18.766 -11.001  -2.516
 1029   HG21  ILE 121          HG21      ILE 121  19.064 -11.762   1.661
 1030   HG22  ILE 121          HG22      ILE 121  20.507 -11.764   0.648
 1031   HG23  ILE 121          HG23      ILE 121  19.692 -10.245   1.017
 1032   HD11  ILE 121          HD11      ILE 121  19.803  -8.809  -2.373
 1033   HD12  ILE 121          HD12      ILE 121  18.327  -8.866  -1.412
 1034   HD13  ILE 121          HD13      ILE 121  19.900  -8.953  -0.619
 1035    H    THR 122           H        THR 122  19.508 -14.427   1.067
 1036    HA   THR 122           HA       THR 122  17.001 -15.405   2.137
 1037    HB   THR 122           HB       THR 122  19.761 -15.885   3.269
 1038    HG1  THR 122           HG1      THR 122  19.105 -16.494   0.860
 1039   HG21  THR 122          HG21      THR 122  17.206 -17.492   3.383
 1040   HG22  THR 122          HG22      THR 122  17.889 -16.542   4.700
 1041   HG23  THR 122          HG23      THR 122  18.750 -17.959   4.098
 1042    H    ASN 123           H        ASN 123  19.852 -13.835   3.628
 1043    HA   ASN 123           HA       ASN 123  18.101 -12.850   5.740
 1044    HB2  ASN 123           HB2      ASN 123  20.201 -12.194   6.905
 1045    HB3  ASN 123           HB3      ASN 123  20.091 -13.913   6.564
 1046   HD21  ASN 123          HD21      ASN 123  22.439 -12.516   7.196
 1047   HD22  ASN 123          HD22      ASN 123  23.500 -12.619   5.840
 1048    H    HIS 124           H        HIS 124  17.094 -11.075   5.319
 1049    HA   HIS 124           HA       HIS 124  18.168  -9.250   3.308
 1050    HB2  HIS 124           HB2      HIS 124  15.885  -8.379   3.161
 1051    HB3  HIS 124           HB3      HIS 124  15.893 -10.131   2.990
 1052    HD1  HIS 124           HD1      HIS 124  14.796  -7.398   5.295
 1053    HD2  HIS 124           HD2      HIS 124  14.633 -11.540   5.056
 1054    HE1  HIS 124           HE1      HIS 124  13.169  -8.109   7.075
 1055    HE2  HIS 124           HE2      HIS 124  13.270 -10.632   7.060
 1056    H    ASP 125           H        ASP 125  17.616  -9.387   6.712
 1057    HA   ASP 125           HA       ASP 125  17.123  -6.589   7.073
 1058    HB2  ASP 125           HB2      ASP 125  16.346  -8.415   8.634
 1059    HB3  ASP 125           HB3      ASP 125  18.013  -8.561   9.181
 1060    H    GLU 126           H        GLU 126  19.789  -8.091   6.079
 1061    HA   GLU 126           HA       GLU 126  21.778  -6.702   7.623
 1062    HB2  GLU 126           HB2      GLU 126  22.211  -7.956   4.921
 1063    HB3  GLU 126           HB3      GLU 126  23.368  -7.756   6.229
 1064    HG2  GLU 126           HG2      GLU 126  21.027  -9.645   6.188
 1065    HG3  GLU 126           HG3      GLU 126  22.726 -10.071   6.008
 1066    H    TYR 127           H        TYR 127  19.583  -5.768   5.386
 1067    HA   TYR 127           HA       TYR 127  21.311  -3.684   4.230
 1068    HB2  TYR 127           HB2      TYR 127  18.697  -4.776   3.167
 1069    HB3  TYR 127           HB3      TYR 127  19.701  -3.555   2.392
 1070    HD1  TYR 127           HD1      TYR 127  21.911  -4.197   1.456
 1071    HD2  TYR 127           HD2      TYR 127  19.174  -7.080   2.952
 1072    HE1  TYR 127           HE1      TYR 127  23.138  -5.962   0.275
 1073    HE2  TYR 127           HE2      TYR 127  20.386  -8.854   1.779
 1074    HH   TYR 127           HH       TYR 127  21.929  -9.274   0.156
 1075    H    SER 128           H        SER 128  20.460  -1.560   4.061
 1076    HA   SER 128           HA       SER 128  18.062  -1.054   5.693
 1077    HB2  SER 128           HB2      SER 128  20.192   0.951   4.910
 1078    HB3  SER 128           HB3      SER 128  18.904   1.155   6.098
 1079    HG   SER 128           HG       SER 128  19.944  -0.647   7.250
 1080    H    LEU 129           H        LEU 129  17.077   1.210   4.807
 1081    HA   LEU 129           HA       LEU 129  16.897   0.884   1.883
 1082    HB2  LEU 129           HB2      LEU 129  14.870   0.324   3.564
 1083    HB3  LEU 129           HB3      LEU 129  14.600   2.043   3.375
 1084    HG   LEU 129           HG       LEU 129  13.221   0.677   1.849
 1085   HD11  LEU 129          HD11      LEU 129  13.665   1.913  -0.187
 1086   HD12  LEU 129          HD12      LEU 129  13.823   2.963   1.221
 1087   HD13  LEU 129          HD13      LEU 129  15.265   2.353   0.408
 1088   HD21  LEU 129          HD21      LEU 129  15.852  -0.096   0.603
 1089   HD22  LEU 129          HD22      LEU 129  14.783  -1.165   1.511
 1090   HD23  LEU 129          HD23      LEU 129  14.251  -0.482  -0.025
 1091    H    VAL 130           H        VAL 130  16.992   2.764   0.676
 1092    HA   VAL 130           HA       VAL 130  16.924   5.303   2.129
 1093    HB   VAL 130           HB       VAL 130  19.241   5.092   1.976
 1094   HG11  VAL 130          HG11      VAL 130  18.871   3.987  -0.787
 1095   HG12  VAL 130          HG12      VAL 130  20.427   4.312  -0.022
 1096   HG13  VAL 130          HG13      VAL 130  19.346   3.096   0.658
 1097   HG21  VAL 130          HG21      VAL 130  20.016   6.644   0.252
 1098   HG22  VAL 130          HG22      VAL 130  18.458   6.512  -0.566
 1099   HG23  VAL 130          HG23      VAL 130  18.552   7.231   1.044
 1100    H    ARG 131           H        ARG 131  15.435   6.529   1.278
 1101    HA   ARG 131           HA       ARG 131  14.520   5.929  -1.451
 1102    HB2  ARG 131           HB2      ARG 131  13.083   7.557   0.637
 1103    HB3  ARG 131           HB3      ARG 131  12.416   6.856  -0.828
 1104    HG2  ARG 131           HG2      ARG 131  12.821   4.608   0.123
 1105    HG3  ARG 131           HG3      ARG 131  13.333   5.386   1.626
 1106    HD2  ARG 131           HD2      ARG 131  11.030   4.794   1.865
 1107    HD3  ARG 131           HD3      ARG 131  11.138   6.552   1.684
 1108    HE   ARG 131           HE       ARG 131  10.255   6.362  -0.494
 1109   HH11  ARG 131          HH11      ARG 131  10.380   3.295   1.175
 1110   HH12  ARG 131          HH12      ARG 131   9.245   2.518   0.124
 1111   HH21  ARG 131          HH21      ARG 131   8.745   5.350  -1.896
 1112   HH22  ARG 131          HH22      ARG 131   8.315   3.692  -1.634
 1113    H    GLU 132           H        GLU 132  15.790   7.217  -2.725
 1114    HA   GLU 132           HA       GLU 132  16.073  10.002  -2.215
 1115    HB2  GLU 132           HB2      GLU 132  16.430   8.405  -4.762
 1116    HB3  GLU 132           HB3      GLU 132  16.803  10.118  -4.617
 1117    HG2  GLU 132           HG2      GLU 132  18.464   9.561  -2.877
 1118    HG3  GLU 132           HG3      GLU 132  18.126   7.849  -3.152
 1119    H    LEU 133           H        LEU 133  14.450  11.391  -2.277
 1120    HA   LEU 133           HA       LEU 133  12.206  10.822  -4.080
 1121    HB2  LEU 133           HB2      LEU 133  12.205  12.869  -1.884
 1122    HB3  LEU 133           HB3      LEU 133  10.833  12.190  -2.727
 1123    HG   LEU 133           HG       LEU 133  12.547  10.863  -0.644
 1124   HD11  LEU 133          HD11      LEU 133   9.623  11.568  -0.830
 1125   HD12  LEU 133          HD12      LEU 133  10.359  10.655   0.491
 1126   HD13  LEU 133          HD13      LEU 133  10.831  12.331   0.203
 1127   HD21  LEU 133          HD21      LEU 133  12.099   9.236  -2.408
 1128   HD22  LEU 133          HD22      LEU 133  11.169   8.867  -0.956
 1129   HD23  LEU 133          HD23      LEU 133  10.378   9.623  -2.339
 1130    H    MET 134           H        MET 134  11.029  13.084  -4.432
 1131    HA   MET 134           HA       MET 134  12.964  14.883  -5.743
 1132    HB2  MET 134           HB2      MET 134  11.036  15.413  -7.260
 1133    HB3  MET 134           HB3      MET 134  11.567  13.737  -7.355
 1134    HG2  MET 134           HG2      MET 134   9.275  13.508  -7.265
 1135    HG3  MET 134           HG3      MET 134   9.740  13.309  -5.581
 1136    HE1  MET 134           HE1      MET 134   6.400  15.120  -5.004
 1137    HE2  MET 134           HE2      MET 134   6.776  13.812  -6.126
 1138    HE3  MET 134           HE3      MET 134   7.471  13.810  -4.504
 1139    H    GLU 135           H        GLU 135  11.483  14.689  -3.003
 1140    HA   GLU 135           HA       GLU 135   9.355  16.424  -2.856
 1141    HB2  GLU 135           HB2      GLU 135  11.289  15.362  -0.881
 1142    HB3  GLU 135           HB3      GLU 135  10.237  16.678  -0.382
 1143    HG2  GLU 135           HG2      GLU 135   8.322  15.234  -1.247
 1144    HG3  GLU 135           HG3      GLU 135   9.498  13.916  -1.260
 1145    H    GLU 136           H        GLU 136   9.071  18.502  -2.900
 1146    HA   GLU 136           HA       GLU 136  11.175  20.418  -2.559
 1147    HB2  GLU 136           HB2      GLU 136   9.351  22.055  -2.722
 1148    HB3  GLU 136           HB3      GLU 136   9.223  20.845  -3.992
 1149    HG2  GLU 136           HG2      GLU 136   7.523  19.661  -2.676
 1150    HG3  GLU 136           HG3      GLU 136   7.618  20.923  -1.450
 1151    H    LYS 137           H        LYS 137   9.119  18.603  -0.549
 1152    HA   LYS 137           HA       LYS 137   8.886  20.394   1.655
 1153    HB2  LYS 137           HB2      LYS 137   8.627  17.380   1.632
 1154    HB3  LYS 137           HB3      LYS 137   8.031  18.467   2.877
 1155    HG2  LYS 137           HG2      LYS 137   6.399  19.385   1.378
 1156    HG3  LYS 137           HG3      LYS 137   7.072  18.474   0.025
 1157    HD2  LYS 137           HD2      LYS 137   6.505  16.374   1.217
 1158    HD3  LYS 137           HD3      LYS 137   5.732  17.337   2.478
 1159    HE2  LYS 137           HE2      LYS 137   4.099  18.164   0.944
 1160    HE3  LYS 137           HE3      LYS 137   4.951  17.458  -0.428
 1161    HZ1  LYS 137           HZ1      LYS 137   3.480  16.030   1.718
 1162    HZ2  LYS 137           HZ2      LYS 137   4.526  15.246   0.638
 1163    HZ3  LYS 137           HZ3      LYS 137   3.150  16.045   0.054
 1164    H    LYS 138           H        LYS 138  10.342  17.179   1.900
 1165    HA   LYS 138           HA       LYS 138  12.325  18.171   3.756
 1166    HB2  LYS 138           HB2      LYS 138  11.909  15.421   2.569
 1167    HB3  LYS 138           HB3      LYS 138  13.063  15.797   3.838
 1168    HG2  LYS 138           HG2      LYS 138  11.177  16.507   5.271
 1169    HG3  LYS 138           HG3      LYS 138  10.079  15.988   3.987
 1170    HD2  LYS 138           HD2      LYS 138  12.133  14.128   5.120
 1171    HD3  LYS 138           HD3      LYS 138  10.568  14.343   5.907
 1172    HE2  LYS 138           HE2      LYS 138  11.074  13.399   3.088
 1173    HE3  LYS 138           HE3      LYS 138  10.487  12.426   4.437
 1174    HZ1  LYS 138           HZ1      LYS 138   8.553  14.030   4.511
 1175    HZ2  LYS 138           HZ2      LYS 138   8.603  12.975   3.187
 1176    HZ3  LYS 138           HZ3      LYS 138   9.074  14.590   2.992
 1177    H    ASP 169           H        ASP 169  12.391  16.406   0.709
 1178    HA   ASP 169           HA       ASP 169  13.981  15.957  -0.775
 1179    HB2  ASP 169           HB2      ASP 169  13.998  18.373  -1.205
 1180    HB3  ASP 169           HB3      ASP 169  15.168  18.603   0.092
 1181    H    GLU 170           H        GLU 170  14.624  14.187   0.265
 1182    HA   GLU 170           HA       GLU 170  17.119  14.344   1.756
 1183    HB2  GLU 170           HB2      GLU 170  14.616  14.171   3.029
 1184    HB3  GLU 170           HB3      GLU 170  15.289  12.549   3.090
 1185    HG2  GLU 170           HG2      GLU 170  16.825  14.972   3.965
 1186    HG3  GLU 170           HG3      GLU 170  15.779  14.058   5.049
 1187    H    LEU 171           H        LEU 171  18.031  12.230   2.166
 1188    HA   LEU 171           HA       LEU 171  17.768  10.469  -0.093
 1189    HB2  LEU 171           HB2      LEU 171  19.343  10.033   2.444
 1190    HB3  LEU 171           HB3      LEU 171  19.590   9.248   0.896
 1191    HG   LEU 171           HG       LEU 171  20.109  12.140   1.547
 1192   HD11  LEU 171          HD11      LEU 171  21.958   9.873   0.827
 1193   HD12  LEU 171          HD12      LEU 171  22.436  11.553   1.071
 1194   HD13  LEU 171          HD13      LEU 171  21.790  10.615   2.417
 1195   HD21  LEU 171          HD21      LEU 171  20.971  12.277  -0.756
 1196   HD22  LEU 171          HD22      LEU 171  20.371  10.645  -1.054
 1197   HD23  LEU 171          HD23      LEU 171  19.237  11.951  -0.700
 1198    H    ASN 172           H        ASN 172  16.442  10.770   3.002
 1199    HA   ASN 172           HA       ASN 172  15.163   9.470   4.351
 1200    HB2  ASN 172           HB2      ASN 172  14.274   8.610   1.606
 1201    HB3  ASN 172           HB3      ASN 172  13.499   8.011   3.057
 1202   HD21  ASN 172          HD21      ASN 172  13.798  10.556   0.860
 1203   HD22  ASN 172          HD22      ASN 172  12.680  11.653   1.594
 1204    H    TRP 173           H        TRP 173  17.070   8.343   5.202
 1205    HA   TRP 173           HA       TRP 173  17.610   5.720   4.067
 1206    HB2  TRP 173           HB2      TRP 173  19.000   7.557   5.961
 1207    HB3  TRP 173           HB3      TRP 173  19.262   5.826   6.167
 1208    HD1  TRP 173           HD1      TRP 173  19.699   8.594   3.508
 1209    HE1  TRP 173           HE1      TRP 173  21.642   7.925   1.969
 1210    HE3  TRP 173           HE3      TRP 173  20.667   3.948   5.405
 1211    HZ2  TRP 173           HZ2      TRP 173  23.369   5.719   1.608
 1212    HZ3  TRP 173           HZ3      TRP 173  22.484   2.622   4.407
 1213    HH2  TRP 173           HH2      TRP 173  23.806   3.491   2.547
 1214    H    LEU 174           H        LEU 174  15.826   4.583   4.585
 1215    HA   LEU 174           HA       LEU 174  14.256   4.926   6.863
 1216    HB2  LEU 174           HB2      LEU 174  14.469   2.450   5.165
 1217    HB3  LEU 174           HB3      LEU 174  13.153   2.858   6.246
 1218    HG   LEU 174           HG       LEU 174  13.845   4.085   3.599
 1219   HD11  LEU 174          HD11      LEU 174  11.413   3.625   3.246
 1220   HD12  LEU 174          HD12      LEU 174  12.410   2.191   3.500
 1221   HD13  LEU 174          HD13      LEU 174  11.407   2.809   4.813
 1222   HD21  LEU 174          HD21      LEU 174  13.509   5.984   5.039
 1223   HD22  LEU 174          HD22      LEU 174  12.063   5.765   4.051
 1224   HD23  LEU 174          HD23      LEU 174  12.067   5.251   5.740
 1225    H    ASP 175           H        ASP 175  14.344   4.278   8.809
 1226    HA   ASP 175           HA       ASP 175  16.710   2.941   9.781
 1227    HB2  ASP 175           HB2      ASP 175  15.979   3.730  11.954
 1228    HB3  ASP 175           HB3      ASP 175  15.826   5.041  10.786
 1229    H    HIS 176           H        HIS 176  13.846   1.823   8.721
 1230    HA   HIS 176           HA       HIS 176  12.762  -0.164   8.904
 1231    HB2  HIS 176           HB2      HIS 176  14.989  -0.789  10.826
 1232    HB3  HIS 176           HB3      HIS 176  13.665  -1.912  10.535
 1233    HD1  HIS 176           HD1      HIS 176  13.652  -3.173   8.333
 1234    HD2  HIS 176           HD2      HIS 176  16.769  -0.465   8.676
 1235    HE1  HIS 176           HE1      HIS 176  15.146  -3.603   6.354
 1236    HE2  HIS 176           HE2      HIS 176  17.192  -2.208   6.810
 1237    H    GLY 177           H        GLY 177  12.139   2.215  10.482
 1238    HA2  GLY 177           HA2      GLY 177  10.339   0.829  12.352
 1239    HA3  GLY 177           HA3      GLY 177  11.314   2.162  12.955
 1240    H    ARG 178           H        ARG 178  10.622   2.790   9.794
 1241    HA   ARG 178           HA       ARG 178   8.442   4.579  10.627
 1242    HB2  ARG 178           HB2      ARG 178  10.722   5.513   9.937
 1243    HB3  ARG 178           HB3      ARG 178  10.293   5.031   8.302
 1244    HG2  ARG 178           HG2      ARG 178   9.806   7.372   8.661
 1245    HG3  ARG 178           HG3      ARG 178   8.318   6.457   8.403
 1246    HD2  ARG 178           HD2      ARG 178   8.230   8.144  10.270
 1247    HD3  ARG 178           HD3      ARG 178   7.787   6.497  10.717
 1248    HE   ARG 178           HE       ARG 178  10.572   7.166  11.152
 1249   HH11  ARG 178          HH11      ARG 178   7.353   7.119  12.527
 1250   HH12  ARG 178          HH12      ARG 178   7.904   7.065  14.167
 1251   HH21  ARG 178          HH21      ARG 178  11.320   7.077  13.313
 1252   HH22  ARG 178          HH22      ARG 178  10.174   7.017  14.616
 1253    H    THR 179           H        THR 179   6.504   4.170   9.773
 1254    HA   THR 179           HA       THR 179   6.124   2.552   7.460
 1255    HB   THR 179           HB       THR 179   4.332   2.582   9.008
 1256    HG1  THR 179           HG1      THR 179   2.671   3.841   7.527
 1257   HG21  THR 179          HG21      THR 179   4.192   5.572   8.642
 1258   HG22  THR 179          HG22      THR 179   4.754   4.726  10.083
 1259   HG23  THR 179          HG23      THR 179   3.064   4.604   9.592
 1260    H    LEU 180           H        LEU 180   5.174   3.263   5.452
 1261    HA   LEU 180           HA       LEU 180   6.963   5.247   4.430
 1262    HB2  LEU 180           HB2      LEU 180   4.897   3.605   2.977
 1263    HB3  LEU 180           HB3      LEU 180   6.276   4.434   2.266
 1264    HG   LEU 180           HG       LEU 180   6.493   2.185   4.269
 1265   HD11  LEU 180          HD11      LEU 180   7.273   0.847   2.353
 1266   HD12  LEU 180          HD12      LEU 180   5.565   1.297   2.264
 1267   HD13  LEU 180          HD13      LEU 180   6.753   2.150   1.277
 1268   HD21  LEU 180          HD21      LEU 180   8.566   3.528   2.547
 1269   HD22  LEU 180          HD22      LEU 180   8.385   3.709   4.294
 1270   HD23  LEU 180          HD23      LEU 180   8.837   2.146   3.611
 1271    H    ARG 181           H        ARG 181   3.501   5.076   4.985
 1272    HA   ARG 181           HA       ARG 181   2.964   7.469   3.485
 1273    HB2  ARG 181           HB2      ARG 181   1.374   5.595   5.139
 1274    HB3  ARG 181           HB3      ARG 181   0.763   7.239   4.996
 1275    HG2  ARG 181           HG2      ARG 181   0.697   7.059   2.599
 1276    HG3  ARG 181           HG3      ARG 181   1.460   5.468   2.662
 1277    HD2  ARG 181           HD2      ARG 181  -1.158   6.094   3.998
 1278    HD3  ARG 181           HD3      ARG 181  -1.045   5.489   2.344
 1279    HE   ARG 181           HE       ARG 181  -0.022   3.476   3.229
 1280   HH11  ARG 181          HH11      ARG 181  -1.723   5.540   5.489
 1281   HH12  ARG 181          HH12      ARG 181  -1.917   4.294   6.687
 1282   HH21  ARG 181          HH21      ARG 181  -0.252   1.839   4.803
 1283   HH22  ARG 181          HH22      ARG 181  -1.058   2.183   6.303
 1284    H    GLU 182           H        GLU 182   4.361   6.868   6.450
 1285    HA   GLU 182           HA       GLU 182   3.568   9.414   7.634
 1286    HB2  GLU 182           HB2      GLU 182   3.885   7.413   9.061
 1287    HB3  GLU 182           HB3      GLU 182   5.565   7.329   8.560
 1288    HG2  GLU 182           HG2      GLU 182   5.329   8.289  10.775
 1289    HG3  GLU 182           HG3      GLU 182   6.020   9.449   9.639
 1290    H    GLN 183           H        GLN 183   5.852   8.153   5.497
 1291    HA   GLN 183           HA       GLN 183   7.885  10.170   5.989
 1292    HB2  GLN 183           HB2      GLN 183   7.791   8.285   3.652
 1293    HB3  GLN 183           HB3      GLN 183   9.198   9.017   4.415
 1294    HG2  GLN 183           HG2      GLN 183   8.993   7.619   6.319
 1295    HG3  GLN 183           HG3      GLN 183   7.422   7.024   5.785
 1296   HE21  GLN 183          HE21      GLN 183   9.628   5.425   6.451
 1297   HE22  GLN 183          HE22      GLN 183  10.100   4.574   5.027
 1298    H    GLY 184           H        GLY 184   5.209   9.491   3.888
 1299    HA2  GLY 184           HA2      GLY 184   4.042  11.028   2.572
 1300    HA3  GLY 184           HA3      GLY 184   5.374  12.161   2.753
 1301    H    VAL 185           H        VAL 185   6.608   9.185   1.973
 1302    HA   VAL 185           HA       VAL 185   7.570  10.030  -0.528
 1303    HB   VAL 185           HB       VAL 185   8.417   7.742  -0.789
 1304   HG11  VAL 185          HG11      VAL 185   8.715   8.844   2.003
 1305   HG12  VAL 185          HG12      VAL 185   9.794   7.672   1.245
 1306   HG13  VAL 185          HG13      VAL 185   9.665   9.304   0.589
 1307   HG21  VAL 185          HG21      VAL 185   7.973   6.047   0.925
 1308   HG22  VAL 185          HG22      VAL 185   6.827   7.136   1.705
 1309   HG23  VAL 185          HG23      VAL 185   6.493   6.518   0.087
 1310    H    GLU 186           H        GLU 186   7.056   9.534  -2.580
 1311    HA   GLU 186           HA       GLU 186   4.332   8.737  -3.086
 1312    HB2  GLU 186           HB2      GLU 186   6.209  10.493  -4.267
 1313    HB3  GLU 186           HB3      GLU 186   5.888   9.245  -5.461
 1314    HG2  GLU 186           HG2      GLU 186   3.770  10.827  -4.067
 1315    HG3  GLU 186           HG3      GLU 186   4.449  11.239  -5.632
 1316    H    GLU 187           H        GLU 187   4.342   7.528  -5.428
 1317    HA   GLU 187           HA       GLU 187   5.552   4.940  -4.833
 1318    HB2  GLU 187           HB2      GLU 187   3.397   5.871  -6.709
 1319    HB3  GLU 187           HB3      GLU 187   4.044   4.236  -6.765
 1320    HG2  GLU 187           HG2      GLU 187   3.206   3.716  -4.639
 1321    HG3  GLU 187           HG3      GLU 187   2.910   5.406  -4.247
 1322    H    HIS 188           H        HIS 188   5.685   7.563  -7.108
 1323    HA   HIS 188           HA       HIS 188   7.190   6.160  -9.096
 1324    HB2  HIS 188           HB2      HIS 188   7.509   8.408 -10.114
 1325    HB3  HIS 188           HB3      HIS 188   5.823   8.046  -9.768
 1326    HD1  HIS 188           HD1      HIS 188   4.617   9.978  -8.775
 1327    HD2  HIS 188           HD2      HIS 188   8.638   9.972  -7.751
 1328    HE1  HIS 188           HE1      HIS 188   4.967  11.997  -7.327
 1329    HE2  HIS 188           HE2      HIS 188   7.355  11.842  -6.563
 1330    H    GLU 189           H        GLU 189   8.036   7.335  -6.086
 1331    HA   GLU 189           HA       GLU 189  10.563   8.515  -6.620
 1332    HB2  GLU 189           HB2      GLU 189   9.647   7.184  -4.068
 1333    HB3  GLU 189           HB3      GLU 189  10.938   8.363  -4.234
 1334    HG2  GLU 189           HG2      GLU 189   8.012   8.873  -4.706
 1335    HG3  GLU 189           HG3      GLU 189   8.929   9.342  -3.279
 1336    H    THR 190           H        THR 190  12.508   7.575  -7.011
 1337    HA   THR 190           HA       THR 190  12.694   4.705  -7.040
 1338    HB   THR 190           HB       THR 190  14.830   6.777  -7.598
 1339    HG1  THR 190           HG1      THR 190  13.331   7.000  -9.185
 1340   HG21  THR 190          HG21      THR 190  14.747   3.820  -8.232
 1341   HG22  THR 190          HG22      THR 190  15.790   4.591  -7.040
 1342   HG23  THR 190          HG23      THR 190  15.998   4.947  -8.754
 1343    H    LEU 191           H        LEU 191  13.555   3.419  -5.572
 1344    HA   LEU 191           HA       LEU 191  14.823   4.679  -3.222
 1345    HB2  LEU 191           HB2      LEU 191  13.416   2.020  -3.138
 1346    HB3  LEU 191           HB3      LEU 191  13.891   3.036  -1.798
 1347    HG   LEU 191           HG       LEU 191  11.611   3.297  -1.797
 1348   HD11  LEU 191          HD11      LEU 191  12.507   5.488  -3.652
 1349   HD12  LEU 191          HD12      LEU 191  11.041   5.492  -2.671
 1350   HD13  LEU 191          HD13      LEU 191  12.624   5.498  -1.893
 1351   HD21  LEU 191          HD21      LEU 191  10.206   3.481  -3.783
 1352   HD22  LEU 191          HD22      LEU 191  11.637   3.344  -4.805
 1353   HD23  LEU 191          HD23      LEU 191  11.151   1.992  -3.783
 1354    H    LEU 192           H        LEU 192  16.682   3.632  -2.385
 1355    HA   LEU 192           HA       LEU 192  17.848   1.723  -4.300
 1356    HB2  LEU 192           HB2      LEU 192  19.517   3.372  -2.458
 1357    HB3  LEU 192           HB3      LEU 192  19.892   2.767  -4.059
 1358    HG   LEU 192           HG       LEU 192  17.915   4.992  -3.567
 1359   HD11  LEU 192          HD11      LEU 192  20.120   5.644  -2.748
 1360   HD12  LEU 192          HD12      LEU 192  20.821   5.210  -4.308
 1361   HD13  LEU 192          HD13      LEU 192  19.665   6.538  -4.199
 1362   HD21  LEU 192          HD21      LEU 192  18.213   5.458  -5.922
 1363   HD22  LEU 192          HD22      LEU 192  19.394   4.151  -6.059
 1364   HD23  LEU 192          HD23      LEU 192  17.705   3.783  -5.703
 1365    H    LEU 193           H        LEU 193  18.492  -0.222  -3.525
 1366    HA   LEU 193           HA       LEU 193  18.214  -0.758  -0.695
 1367    HB2  LEU 193           HB2      LEU 193  17.414  -2.307  -2.487
 1368    HB3  LEU 193           HB3      LEU 193  19.079  -2.571  -2.958
 1369    HG   LEU 193           HG       LEU 193  18.294  -3.170  -0.140
 1370   HD11  LEU 193          HD11      LEU 193  16.526  -4.189  -1.484
 1371   HD12  LEU 193          HD12      LEU 193  17.743  -4.968  -2.495
 1372   HD13  LEU 193          HD13      LEU 193  17.594  -5.411  -0.794
 1373   HD21  LEU 193          HD21      LEU 193  20.626  -3.366  -0.788
 1374   HD22  LEU 193          HD22      LEU 193  19.948  -4.962  -0.455
 1375   HD23  LEU 193          HD23      LEU 193  20.183  -4.433  -2.121
 1376    H    ARG 194           H        ARG 194  19.857  -0.693   0.721
 1377    HA   ARG 194           HA       ARG 194  22.605  -0.620  -0.347
 1378    HB2  ARG 194           HB2      ARG 194  21.415   1.085   1.847
 1379    HB3  ARG 194           HB3      ARG 194  23.131   1.005   1.482
 1380    HG2  ARG 194           HG2      ARG 194  21.027   1.895  -0.475
 1381    HG3  ARG 194           HG3      ARG 194  21.970   2.985   0.542
 1382    HD2  ARG 194           HD2      ARG 194  23.030   1.111  -1.569
 1383    HD3  ARG 194           HD3      ARG 194  22.942   2.872  -1.663
 1384    HE   ARG 194           HE       ARG 194  24.500   1.773   0.535
 1385   HH11  ARG 194          HH11      ARG 194  24.497   3.149  -2.692
 1386   HH12  ARG 194          HH12      ARG 194  26.191   3.557  -2.651
 1387   HH21  ARG 194          HH21      ARG 194  26.716   2.303   0.582
 1388   HH22  ARG 194          HH22      ARG 194  27.454   3.068  -0.798
 1389    H    ARG 195           H        ARG 195  24.084  -1.858   0.679
 1390    HA   ARG 195           HA       ARG 195  23.117  -3.679   2.704
 1391    HB2  ARG 195           HB2      ARG 195  24.711  -4.248   0.769
 1392    HB3  ARG 195           HB3      ARG 195  25.963  -3.468   1.729
 1393    HG2  ARG 195           HG2      ARG 195  25.625  -5.050   3.522
 1394    HG3  ARG 195           HG3      ARG 195  24.285  -5.792   2.648
 1395    HD2  ARG 195           HD2      ARG 195  26.081  -6.128   0.775
 1396    HD3  ARG 195           HD3      ARG 195  27.220  -5.938   2.110
 1397    HE   ARG 195           HE       ARG 195  25.309  -7.781   2.916
 1398   HH11  ARG 195          HH11      ARG 195  27.952  -7.563   0.626
 1399   HH12  ARG 195          HH12      ARG 195  28.053  -9.286   0.403
 1400   HH21  ARG 195          HH21      ARG 195  25.443 -10.052   2.594
 1401   HH22  ARG 195          HH22      ARG 195  26.651 -10.684   1.518
 1402    H    LYS 196           H        LYS 196  23.237  -3.330   4.820
 1403    HA   LYS 196           HA       LYS 196  24.865  -1.113   5.789
 1404    HB2  LYS 196           HB2      LYS 196  22.487  -1.326   6.505
 1405    HB3  LYS 196           HB3      LYS 196  22.896  -2.836   7.308
 1406    HG2  LYS 196           HG2      LYS 196  24.466  -1.624   8.758
 1407    HG3  LYS 196           HG3      LYS 196  24.002  -0.113   7.972
 1408    HD2  LYS 196           HD2      LYS 196  21.663  -0.517   8.699
 1409    HD3  LYS 196           HD3      LYS 196  22.220  -1.942   9.579
 1410    HE2  LYS 196           HE2      LYS 196  22.012  -0.053  11.087
 1411    HE3  LYS 196           HE3      LYS 196  23.705  -0.518  10.918
 1412    HZ1  LYS 196           HZ1      LYS 196  22.406   1.720   9.454
 1413    HZ2  LYS 196           HZ2      LYS 196  24.053   1.308   9.407
 1414    HZ3  LYS 196           HZ3      LYS 196  23.367   1.898  10.840
 1415    H    PHE 197           H        PHE 197  24.323  -4.555   6.541
 1416    HA   PHE 197           HA       PHE 197  26.817  -4.584   8.058
 1417    HB2  PHE 197           HB2      PHE 197  24.925  -6.892   7.587
 1418    HB3  PHE 197           HB3      PHE 197  26.218  -6.791   8.779
 1419    HD1  PHE 197           HD1      PHE 197  25.802  -4.197  10.017
 1420    HD2  PHE 197           HD2      PHE 197  22.952  -7.077   8.723
 1421    HE1  PHE 197           HE1      PHE 197  24.183  -3.328  11.652
 1422    HE2  PHE 197           HE2      PHE 197  21.323  -6.209  10.345
 1423    HZ   PHE 197           HZ       PHE 197  21.939  -4.332  11.820
 1424    H    PHE 198           H        PHE 198  28.601  -5.727   7.473
 1425    HA   PHE 198           HA       PHE 198  28.579  -6.766   4.714
 1426    HB2  PHE 198           HB2      PHE 198  30.854  -5.344   6.112
 1427    HB3  PHE 198           HB3      PHE 198  30.908  -6.027   4.492
 1428    HD1  PHE 198           HD1      PHE 198  29.312  -5.086   2.751
 1429    HD2  PHE 198           HD2      PHE 198  30.131  -3.157   6.454
 1430    HE1  PHE 198           HE1      PHE 198  28.502  -2.958   1.817
 1431    HE2  PHE 198           HE2      PHE 198  29.326  -1.026   5.527
 1432    HZ   PHE 198           HZ       PHE 198  28.509  -0.925   3.206
 1433    H    TYR 199           H        TYR 199  27.927  -8.459   6.633
 1434    HA   TYR 199           HA       TYR 199  29.941  -9.947   7.851
 1435    HB2  TYR 199           HB2      TYR 199  28.295 -11.831   7.763
 1436    HB3  TYR 199           HB3      TYR 199  27.616 -10.333   8.390
 1437    HD1  TYR 199           HD1      TYR 199  26.310  -8.860   6.721
 1438    HD2  TYR 199           HD2      TYR 199  27.231 -12.954   5.998
 1439    HE1  TYR 199           HE1      TYR 199  24.519  -8.961   5.048
 1440    HE2  TYR 199           HE2      TYR 199  25.437 -13.059   4.321
 1441    HH   TYR 199           HH       TYR 199  23.256 -11.786   3.851
 1442    H    SER 200           H        SER 200  28.630 -10.092   4.587
 1443    HA   SER 200           HA       SER 200  29.221 -11.206   2.707
 1444    HB2  SER 200           HB2      SER 200  31.988 -10.942   3.894
 1445    HB3  SER 200           HB3      SER 200  31.611 -11.231   2.198
 1446    HG   SER 200           HG       SER 200  31.893  -8.915   3.343
 1447    H    ASP 201           H        ASP 201  28.069 -13.077   3.707
 1448    HA   ASP 201           HA       ASP 201  27.849 -15.313   3.994
 1449    HB2  ASP 201           HB2      ASP 201  29.082 -15.372   1.873
 1450    HB3  ASP 201           HB3      ASP 201  30.606 -15.348   2.745
 1451    H    GLN 202           H        GLN 202  29.247 -13.607   6.067
 1452    HA   GLN 202           HA       GLN 202  30.318 -15.853   7.631
 1453    HB2  GLN 202           HB2      GLN 202  31.991 -14.037   6.732
 1454    HB3  GLN 202           HB3      GLN 202  31.337 -13.059   8.035
 1455    HG2  GLN 202           HG2      GLN 202  32.612 -15.761   8.398
 1456    HG3  GLN 202           HG3      GLN 202  33.441 -14.221   8.603
 1457   HE21  GLN 202          HE21      GLN 202  32.897 -12.898  10.346
 1458   HE22  GLN 202          HE22      GLN 202  32.086 -13.530  11.746
  Start of MODEL   11
    1    H1   GLY  -5           H1       GLY  -5 -23.308 -15.963  -2.501
    2    H2   GLY  -5           H2       GLY  -5 -22.997 -17.457  -1.756
    3    H3   GLY  -5           H3       GLY  -5 -23.179 -16.060  -0.815
    4    HA2  GLY  -5           HA2      GLY  -5 -25.307 -17.278  -2.477
    5    HA3  GLY  -5           HA3      GLY  -5 -25.152 -17.471  -0.737
    6    H    ILE  -4           H        ILE  -4 -26.788 -16.371   0.125
    7    HA   ILE  -4           HA       ILE  -4 -27.427 -13.717  -0.949
    8    HB   ILE  -4           HB       ILE  -4 -29.322 -15.219  -0.835
    9   HG12  ILE  -4          HG12      ILE  -4 -30.841 -13.890   0.633
   10   HG13  ILE  -4          HG13      ILE  -4 -29.428 -13.072   1.293
   11   HG21  ILE  -4          HG21      ILE  -4 -30.155 -16.105   1.294
   12   HG22  ILE  -4          HG22      ILE  -4 -28.556 -16.729   0.889
   13   HG23  ILE  -4          HG23      ILE  -4 -28.726 -15.465   2.106
   14   HD11  ILE  -4          HD11      ILE  -4 -30.307 -13.015  -1.585
   15   HD12  ILE  -4          HD12      ILE  -4 -30.537 -11.727  -0.402
   16   HD13  ILE  -4          HD13      ILE  -4 -28.909 -12.179  -0.910
   17    H    ASP  -3           H        ASP  -3 -27.076 -11.907   0.181
   18    HA   ASP  -3           HA       ASP  -3 -26.437 -12.125   3.044
   19    HB2  ASP  -3           HB2      ASP  -3 -24.911 -10.615   0.921
   20    HB3  ASP  -3           HB3      ASP  -3 -24.795 -10.195   2.626
   21    HA   PRO  -2           HA       PRO  -2 -29.775  -9.174   2.945
   22    HB2  PRO  -2           HB2      PRO  -2 -30.172  -9.053   5.610
   23    HB3  PRO  -2           HB3      PRO  -2 -30.681 -10.436   4.635
   24    HG2  PRO  -2           HG2      PRO  -2 -28.272 -10.129   6.375
   25    HG3  PRO  -2           HG3      PRO  -2 -29.341 -11.529   6.176
   26    HD2  PRO  -2           HD2      PRO  -2 -26.905 -11.286   4.951
   27    HD3  PRO  -2           HD3      PRO  -2 -28.244 -12.250   4.301
   28    H    PHE  -1           H        PHE  -1 -29.931  -7.005   3.086
   29    HA   PHE  -1           HA       PHE  -1 -27.850  -5.550   4.544
   30    HB2  PHE  -1           HB2      PHE  -1 -28.917  -5.076   1.770
   31    HB3  PHE  -1           HB3      PHE  -1 -28.147  -3.796   2.694
   32    HD1  PHE  -1           HD1      PHE  -1 -25.784  -4.096   3.449
   33    HD2  PHE  -1           HD2      PHE  -1 -27.647  -6.696   0.644
   34    HE1  PHE  -1           HE1      PHE  -1 -23.567  -4.874   2.704
   35    HE2  PHE  -1           HE2      PHE  -1 -25.437  -7.481  -0.104
   36    HZ   PHE  -1           HZ       PHE  -1 -23.392  -6.571   0.925
   37    H    THR   0           H        THR   0 -29.229  -5.309   6.267
   38    HA   THR   0           HA       THR   0 -31.791  -4.058   6.001
   39    HB   THR   0           HB       THR   0 -31.666  -3.949   8.524
   40    HG1  THR   0           HG1      THR   0 -29.301  -5.507   8.159
   41   HG21  THR   0          HG21      THR   0 -31.873  -6.378   8.811
   42   HG22  THR   0          HG22      THR   0 -31.159  -6.624   7.218
   43   HG23  THR   0          HG23      THR   0 -32.722  -5.822   7.369
   44    H    MET   1           H        MET   1 -31.653  -2.274   8.279
   45    HA   MET   1           HA       MET   1 -30.736   0.063   6.866
   46    HB2  MET   1           HB2      MET   1 -32.860   0.015   8.166
   47    HB3  MET   1           HB3      MET   1 -31.917  -0.119   9.641
   48    HG2  MET   1           HG2      MET   1 -32.624   2.143   9.394
   49    HG3  MET   1           HG3      MET   1 -30.886   2.076   9.128
   50    HE1  MET   1           HE1      MET   1 -30.407   3.046   5.474
   51    HE2  MET   1           HE2      MET   1 -29.719   3.041   7.097
   52    HE3  MET   1           HE3      MET   1 -30.132   1.520   6.309
   53    H    VAL   2           H        VAL   2 -28.587  -1.322   7.197
   54    HA   VAL   2           HA       VAL   2 -26.959   0.437   8.807
   55    HB   VAL   2           HB       VAL   2 -25.495  -1.577   9.450
   56   HG11  VAL   2          HG11      VAL   2 -28.182  -1.269  10.784
   57   HG12  VAL   2          HG12      VAL   2 -26.753  -2.009  11.504
   58   HG13  VAL   2          HG13      VAL   2 -26.747  -0.293  11.098
   59   HG21  VAL   2          HG21      VAL   2 -26.572  -3.251   8.052
   60   HG22  VAL   2          HG22      VAL   2 -26.667  -3.711   9.753
   61   HG23  VAL   2          HG23      VAL   2 -28.082  -3.042   8.939
   62    H    ALA   3           H        ALA   3 -26.595   1.287   6.701
   63    HA   ALA   3           HA       ALA   3 -24.704  -0.306   5.138
   64    HB1  ALA   3           HB1      ALA   3 -26.858  -0.736   4.092
   65    HB2  ALA   3           HB2      ALA   3 -27.155   0.997   3.950
   66    HB3  ALA   3           HB3      ALA   3 -25.847   0.250   3.035
   67    H    LEU   4           H        LEU   4 -23.178   0.806   4.162
   68    HA   LEU   4           HA       LEU   4 -23.180   3.729   4.493
   69    HB2  LEU   4           HB2      LEU   4 -21.090   1.644   4.843
   70    HB3  LEU   4           HB3      LEU   4 -20.580   3.162   4.139
   71    HG   LEU   4           HG       LEU   4 -21.139   4.376   6.099
   72   HD11  LEU   4          HD11      LEU   4 -22.254   3.477   8.014
   73   HD12  LEU   4          HD12      LEU   4 -23.273   3.254   6.593
   74   HD13  LEU   4          HD13      LEU   4 -22.367   1.889   7.251
   75   HD21  LEU   4          HD21      LEU   4 -19.053   3.123   6.196
   76   HD22  LEU   4          HD22      LEU   4 -19.783   3.288   7.794
   77   HD23  LEU   4          HD23      LEU   4 -19.909   1.761   6.921
   78    H    SER   5           H        SER   5 -22.871   4.929   2.711
   79    HA   SER   5           HA       SER   5 -22.817   3.495   0.161
   80    HB2  SER   5           HB2      SER   5 -23.503   6.382   0.779
   81    HB3  SER   5           HB3      SER   5 -23.534   5.660  -0.825
   82    HG   SER   5           HG       SER   5 -25.197   5.144   1.389
   83    H    LEU   6           H        LEU   6 -20.802   3.109  -0.501
   84    HA   LEU   6           HA       LEU   6 -18.783   5.204  -0.027
   85    HB2  LEU   6           HB2      LEU   6 -18.274   2.238  -0.265
   86    HB3  LEU   6           HB3      LEU   6 -17.135   3.479   0.236
   87    HG   LEU   6           HG       LEU   6 -19.554   2.547   1.787
   88   HD11  LEU   6          HD11      LEU   6 -17.936   1.685   3.378
   89   HD12  LEU   6          HD12      LEU   6 -17.709   0.951   1.790
   90   HD13  LEU   6          HD13      LEU   6 -16.611   2.218   2.340
   91   HD21  LEU   6          HD21      LEU   6 -17.490   4.635   2.464
   92   HD22  LEU   6          HD22      LEU   6 -19.206   4.907   2.152
   93   HD23  LEU   6          HD23      LEU   6 -18.701   4.000   3.578
   94    H    LYS   7           H        LYS   7 -17.882   6.046  -1.783
   95    HA   LYS   7           HA       LYS   7 -18.417   4.889  -4.374
   96    HB2  LYS   7           HB2      LYS   7 -17.098   7.406  -3.438
   97    HB3  LYS   7           HB3      LYS   7 -16.802   6.836  -5.078
   98    HG2  LYS   7           HG2      LYS   7 -19.282   6.779  -5.406
   99    HG3  LYS   7           HG3      LYS   7 -19.437   7.589  -3.847
  100    HD2  LYS   7           HD2      LYS   7 -18.296   9.513  -4.629
  101    HD3  LYS   7           HD3      LYS   7 -17.754   8.680  -6.088
  102    HE2  LYS   7           HE2      LYS   7 -20.044   8.523  -6.876
  103    HE3  LYS   7           HE3      LYS   7 -20.622   9.308  -5.404
  104    HZ1  LYS   7           HZ1      LYS   7 -20.511  10.888  -7.189
  105    HZ2  LYS   7           HZ2      LYS   7 -18.885  10.516  -7.489
  106    HZ3  LYS   7           HZ3      LYS   7 -19.327  11.280  -6.042
  107    H    ILE   8           H        ILE   8 -17.267   3.322  -5.167
  108    HA   ILE   8           HA       ILE   8 -14.606   2.783  -4.131
  109    HB   ILE   8           HB       ILE   8 -16.209   1.211  -6.155
  110   HG12  ILE   8          HG12      ILE   8 -17.420   1.326  -4.030
  111   HG13  ILE   8          HG13      ILE   8 -16.778  -0.292  -4.285
  112   HG21  ILE   8          HG21      ILE   8 -13.820   0.446  -4.486
  113   HG22  ILE   8          HG22      ILE   8 -14.689  -0.610  -5.600
  114   HG23  ILE   8          HG23      ILE   8 -13.810   0.789  -6.216
  115   HD11  ILE   8          HD11      ILE   8 -15.601   1.819  -2.492
  116   HD12  ILE   8          HD12      ILE   8 -16.516   0.401  -1.979
  117   HD13  ILE   8          HD13      ILE   8 -14.943   0.203  -2.751
  118    H    SER   9           H        SER   9 -13.150   4.116  -5.037
  119    HA   SER   9           HA       SER   9 -13.244   4.673  -7.887
  120    HB2  SER   9           HB2      SER   9 -11.169   6.054  -7.302
  121    HB3  SER   9           HB3      SER   9 -12.689   6.570  -6.573
  122    HG   SER   9           HG       SER   9 -10.610   5.068  -5.359
  123    H    ILE  10           H        ILE  10 -12.463   3.146  -9.197
  124    HA   ILE  10           HA       ILE  10 -10.077   1.671  -8.305
  125    HB   ILE  10           HB       ILE  10 -12.100   0.754 -10.356
  126   HG12  ILE  10          HG12      ILE  10 -11.754  -0.170  -7.493
  127   HG13  ILE  10          HG13      ILE  10 -13.026   0.920  -8.036
  128   HG21  ILE  10          HG21      ILE  10  -9.832  -0.690  -8.983
  129   HG22  ILE  10          HG22      ILE  10 -10.979  -1.416 -10.109
  130   HG23  ILE  10          HG23      ILE  10  -9.864  -0.170 -10.669
  131   HD11  ILE  10          HD11      ILE  10 -13.841  -1.353  -7.795
  132   HD12  ILE  10          HD12      ILE  10 -13.910  -0.833  -9.479
  133   HD13  ILE  10          HD13      ILE  10 -12.630  -1.921  -8.944
  134    H    GLY  11           H        GLY  11  -8.613   3.163  -9.067
  135    HA2  GLY  11           HA2      GLY  11  -7.227   4.163 -10.594
  136    HA3  GLY  11           HA3      GLY  11  -7.811   2.983 -11.758
  137    H    ASN  12           H        ASN  12  -9.157   3.617 -13.324
  138    HA   ASN  12           HA       ASN  12  -9.714   6.470 -13.498
  139    HB2  ASN  12           HB2      ASN  12 -10.321   5.920 -15.880
  140    HB3  ASN  12           HB3      ASN  12  -8.653   5.584 -15.437
  141   HD21  ASN  12          HD21      ASN  12  -8.365   4.103 -17.068
  142   HD22  ASN  12          HD22      ASN  12  -9.101   2.531 -17.046
  143    H    VAL  13           H        VAL  13 -11.392   3.615 -12.717
  144    HA   VAL  13           HA       VAL  13 -13.951   4.752 -13.601
  145    HB   VAL  13           HB       VAL  13 -13.380   2.439 -14.347
  146   HG11  VAL  13          HG11      VAL  13 -13.556   0.592 -12.750
  147   HG12  VAL  13          HG12      VAL  13 -12.196   1.655 -12.388
  148   HG13  VAL  13          HG13      VAL  13 -13.674   1.754 -11.430
  149   HG21  VAL  13          HG21      VAL  13 -15.562   1.445 -13.834
  150   HG22  VAL  13          HG22      VAL  13 -15.816   2.667 -12.586
  151   HG23  VAL  13          HG23      VAL  13 -15.697   3.146 -14.280
  152    H    VAL  14           H        VAL  14 -15.737   4.820 -12.179
  153    HA   VAL  14           HA       VAL  14 -15.104   4.502  -9.328
  154    HB   VAL  14           HB       VAL  14 -15.005   6.875  -9.651
  155   HG11  VAL  14          HG11      VAL  14 -16.161   7.047 -11.783
  156   HG12  VAL  14          HG12      VAL  14 -17.697   6.688 -10.994
  157   HG13  VAL  14          HG13      VAL  14 -16.838   8.179 -10.613
  158   HG21  VAL  14          HG21      VAL  14 -17.676   6.114  -8.465
  159   HG22  VAL  14          HG22      VAL  14 -16.130   6.171  -7.618
  160   HG23  VAL  14          HG23      VAL  14 -16.861   7.658  -8.225
  161    H    LYS  15           H        LYS  15 -16.414   3.104  -8.430
  162    HA   LYS  15           HA       LYS  15 -19.112   2.752  -9.567
  163    HB2  LYS  15           HB2      LYS  15 -17.223   0.722  -8.374
  164    HB3  LYS  15           HB3      LYS  15 -18.937   0.402  -8.596
  165    HG2  LYS  15           HG2      LYS  15 -16.992   1.091 -10.796
  166    HG3  LYS  15           HG3      LYS  15 -17.572  -0.530 -10.403
  167    HD2  LYS  15           HD2      LYS  15 -19.881   0.226 -10.855
  168    HD3  LYS  15           HD3      LYS  15 -19.248   1.802 -11.329
  169    HE2  LYS  15           HE2      LYS  15 -19.674   0.492 -13.303
  170    HE3  LYS  15           HE3      LYS  15 -17.936   0.700 -13.109
  171    HZ1  LYS  15           HZ1      LYS  15 -18.866  -1.609 -13.698
  172    HZ2  LYS  15           HZ2      LYS  15 -19.269  -1.714 -12.055
  173    HZ3  LYS  15           HZ3      LYS  15 -17.649  -1.504 -12.520
  174    H    THR  16           H        THR  16 -20.819   2.477  -8.084
  175    HA   THR  16           HA       THR  16 -20.123   3.466  -5.395
  176    HB   THR  16           HB       THR  16 -22.833   3.619  -6.725
  177    HG1  THR  16           HG1      THR  16 -20.973   4.844  -7.719
  178   HG21  THR  16          HG21      THR  16 -23.269   5.319  -5.013
  179   HG22  THR  16          HG22      THR  16 -21.657   5.067  -4.345
  180   HG23  THR  16          HG23      THR  16 -22.853   3.772  -4.277
  181    H    MET  17           H        MET  17 -20.353   2.090  -3.739
  182    HA   MET  17           HA       MET  17 -22.301  -0.068  -3.985
  183    HB2  MET  17           HB2      MET  17 -19.368  -0.384  -3.532
  184    HB3  MET  17           HB3      MET  17 -20.459  -1.431  -2.636
  185    HG2  MET  17           HG2      MET  17 -21.496  -1.969  -4.916
  186    HG3  MET  17           HG3      MET  17 -20.032  -1.251  -5.591
  187    HE1  MET  17           HE1      MET  17 -21.461  -4.098  -3.260
  188    HE2  MET  17           HE2      MET  17 -19.967  -4.863  -2.714
  189    HE3  MET  17           HE3      MET  17 -20.343  -3.207  -2.227
  190    H    GLN  18           H        GLN  18 -23.118  -0.804  -2.031
  191    HA   GLN  18           HA       GLN  18 -22.422   0.868   0.276
  192    HB2  GLN  18           HB2      GLN  18 -25.031  -0.390  -0.542
  193    HB3  GLN  18           HB3      GLN  18 -24.741   0.178   1.100
  194    HG2  GLN  18           HG2      GLN  18 -24.716   2.373   0.495
  195    HG3  GLN  18           HG3      GLN  18 -24.163   2.027  -1.144
  196   HE21  GLN  18          HE21      GLN  18 -25.709   3.288  -2.088
  197   HE22  GLN  18          HE22      GLN  18 -27.370   2.834  -2.159
  198    H    PHE  19           H        PHE  19 -21.931  -0.098   2.188
  199    HA   PHE  19           HA       PHE  19 -21.908  -3.031   2.272
  200    HB2  PHE  19           HB2      PHE  19 -19.685  -1.216   3.262
  201    HB3  PHE  19           HB3      PHE  19 -19.721  -2.969   3.378
  202    HD1  PHE  19           HD1      PHE  19 -19.352  -4.346   1.394
  203    HD2  PHE  19           HD2      PHE  19 -19.062  -0.105   1.250
  204    HE1  PHE  19           HE1      PHE  19 -18.129  -4.504  -0.737
  205    HE2  PHE  19           HE2      PHE  19 -17.838  -0.252  -0.876
  206    HZ   PHE  19           HZ       PHE  19 -17.367  -2.456  -1.873
  207    H    GLU  20           H        GLU  20 -21.946  -3.797   4.536
  208    HA   GLU  20           HA       GLU  20 -23.460  -2.022   6.221
  209    HB2  GLU  20           HB2      GLU  20 -22.321  -4.768   6.783
  210    HB3  GLU  20           HB3      GLU  20 -23.402  -3.887   7.853
  211    HG2  GLU  20           HG2      GLU  20 -25.118  -3.916   6.074
  212    HG3  GLU  20           HG3      GLU  20 -24.035  -4.906   5.094
  213    HA   PRO  21           HA       PRO  21 -20.153  -0.046   8.432
  214    HB2  PRO  21           HB2      PRO  21 -21.419  -0.259  10.950
  215    HB3  PRO  21           HB3      PRO  21 -21.499   1.109   9.839
  216    HG2  PRO  21           HG2      PRO  21 -23.448  -1.086  10.277
  217    HG3  PRO  21           HG3      PRO  21 -23.741   0.588   9.767
  218    HD2  PRO  21           HD2      PRO  21 -23.903  -1.470   8.060
  219    HD3  PRO  21           HD3      PRO  21 -23.311   0.127   7.561
  220    H    SER  22           H        SER  22 -21.542  -3.098   9.402
  221    HA   SER  22           HA       SER  22 -19.133  -3.782  10.926
  222    HB2  SER  22           HB2      SER  22 -21.829  -5.154  10.859
  223    HB3  SER  22           HB3      SER  22 -20.483  -5.558  11.925
  224    HG   SER  22           HG       SER  22 -20.825  -3.787  13.093
  225    H    THR  23           H        THR  23 -19.836  -3.920   7.841
  226    HA   THR  23           HA       THR  23 -19.731  -6.611   7.063
  227    HB   THR  23           HB       THR  23 -18.880  -4.077   5.684
  228    HG1  THR  23           HG1      THR  23 -21.054  -5.889   5.533
  229   HG21  THR  23          HG21      THR  23 -17.413  -5.819   4.828
  230   HG22  THR  23          HG22      THR  23 -18.607  -5.361   3.614
  231   HG23  THR  23          HG23      THR  23 -18.803  -6.860   4.523
  232    H    MET  24           H        MET  24 -17.105  -4.271   7.507
  233    HA   MET  24           HA       MET  24 -14.914  -4.526   8.059
  234    HB2  MET  24           HB2      MET  24 -15.946  -6.641   9.298
  235    HB3  MET  24           HB3      MET  24 -15.028  -7.504   8.077
  236    HG2  MET  24           HG2      MET  24 -12.990  -6.603   8.863
  237    HG3  MET  24           HG3      MET  24 -13.828  -5.439   9.892
  238    HE1  MET  24           HE1      MET  24 -12.468  -7.478  12.777
  239    HE2  MET  24           HE2      MET  24 -11.706  -6.726  11.375
  240    HE3  MET  24           HE3      MET  24 -13.004  -5.885  12.228
  241    H    VAL  25           H        VAL  25 -13.091  -4.673   6.911
  242    HA   VAL  25           HA       VAL  25 -13.155  -4.430   4.237
  243    HB   VAL  25           HB       VAL  25 -10.838  -5.401   5.886
  244   HG11  VAL  25          HG11      VAL  25  -9.400  -4.712   4.016
  245   HG12  VAL  25          HG12      VAL  25 -10.453  -6.052   3.561
  246   HG13  VAL  25          HG13      VAL  25 -10.832  -4.414   3.031
  247   HG21  VAL  25          HG21      VAL  25 -11.728  -3.212   6.450
  248   HG22  VAL  25          HG22      VAL  25 -10.146  -3.061   5.686
  249   HG23  VAL  25          HG23      VAL  25 -11.607  -2.715   4.763
  250    H    TYR  26           H        TYR  26 -12.268  -7.525   5.813
  251    HA   TYR  26           HA       TYR  26 -11.654  -8.854   3.431
  252    HB2  TYR  26           HB2      TYR  26 -11.743 -10.933   4.662
  253    HB3  TYR  26           HB3      TYR  26 -10.971  -9.698   5.641
  254    HD1  TYR  26           HD1      TYR  26 -13.985 -11.770   5.237
  255    HD2  TYR  26           HD2      TYR  26 -11.957  -8.966   7.712
  256    HE1  TYR  26           HE1      TYR  26 -15.502 -12.320   7.090
  257    HE2  TYR  26           HE2      TYR  26 -13.473  -9.504   9.570
  258    HH   TYR  26           HH       TYR  26 -15.734 -10.444   9.914
  259    H    ASP  27           H        ASP  27 -14.722  -8.399   5.034
  260    HA   ASP  27           HA       ASP  27 -16.116 -10.305   3.390
  261    HB2  ASP  27           HB2      ASP  27 -16.820  -9.679   5.722
  262    HB3  ASP  27           HB3      ASP  27 -17.307  -8.108   5.090
  263    H    ALA  28           H        ALA  28 -15.675  -6.805   3.468
  264    HA   ALA  28           HA       ALA  28 -17.332  -6.110   1.341
  265    HB1  ALA  28           HB1      ALA  28 -16.245  -4.470   2.799
  266    HB2  ALA  28           HB2      ALA  28 -14.681  -4.877   2.093
  267    HB3  ALA  28           HB3      ALA  28 -15.929  -4.128   1.098
  268    H    CYS  29           H        CYS  29 -13.953  -7.153   1.342
  269    HA   CYS  29           HA       CYS  29 -13.339  -6.845  -1.331
  270    HB2  CYS  29           HB2      CYS  29 -11.701  -7.403   0.414
  271    HB3  CYS  29           HB3      CYS  29 -12.370  -9.027   0.524
  272    HG   CYS  29           HG       CYS  29 -10.831  -7.731  -2.254
  273    H    ARG  30           H        ARG  30 -14.989  -9.591   0.206
  274    HA   ARG  30           HA       ARG  30 -14.819 -11.218  -2.136
  275    HB2  ARG  30           HB2      ARG  30 -16.474 -12.695  -1.048
  276    HB3  ARG  30           HB3      ARG  30 -15.088 -12.341  -0.032
  277    HG2  ARG  30           HG2      ARG  30 -16.319 -11.297   1.513
  278    HG3  ARG  30           HG3      ARG  30 -17.396 -10.552   0.327
  279    HD2  ARG  30           HD2      ARG  30 -18.554 -12.684   0.046
  280    HD3  ARG  30           HD3      ARG  30 -17.461 -13.440   1.207
  281    HE   ARG  30           HE       ARG  30 -18.377 -11.663   2.793
  282   HH11  ARG  30          HH11      ARG  30 -20.276 -13.130   0.230
  283   HH12  ARG  30          HH12      ARG  30 -21.789 -12.874   1.052
  284   HH21  ARG  30          HH21      ARG  30 -20.324 -11.353   3.857
  285   HH22  ARG  30          HH22      ARG  30 -21.820 -11.888   3.126
  286    H    MET  31           H        MET  31 -17.204  -9.006  -0.855
  287    HA   MET  31           HA       MET  31 -19.212  -9.703  -2.756
  288    HB2  MET  31           HB2      MET  31 -18.970  -7.288  -0.968
  289    HB3  MET  31           HB3      MET  31 -20.403  -7.759  -1.866
  290    HG2  MET  31           HG2      MET  31 -20.504  -9.849  -0.605
  291    HG3  MET  31           HG3      MET  31 -19.087  -9.352   0.312
  292    HE1  MET  31           HE1      MET  31 -18.961  -7.389   1.879
  293    HE2  MET  31           HE2      MET  31 -19.580  -6.244   0.687
  294    HE3  MET  31           HE3      MET  31 -20.291  -6.306   2.304
  295    H    ILE  32           H        ILE  32 -16.882  -7.024  -2.481
  296    HA   ILE  32           HA       ILE  32 -17.951  -5.516  -4.601
  297    HB   ILE  32           HB       ILE  32 -16.440  -4.530  -2.974
  298   HG12  ILE  32          HG12      ILE  32 -15.334  -4.426  -5.788
  299   HG13  ILE  32          HG13      ILE  32 -16.689  -3.479  -5.180
  300   HG21  ILE  32          HG21      ILE  32 -14.023  -4.917  -3.063
  301   HG22  ILE  32          HG22      ILE  32 -14.909  -6.379  -2.626
  302   HG23  ILE  32          HG23      ILE  32 -14.276  -6.188  -4.260
  303   HD11  ILE  32          HD11      ILE  32 -13.860  -3.323  -4.183
  304   HD12  ILE  32          HD12      ILE  32 -14.635  -2.183  -5.282
  305   HD13  ILE  32          HD13      ILE  32 -15.219  -2.345  -3.627
  306    H    ARG  33           H        ARG  33 -15.270  -7.844  -4.587
  307    HA   ARG  33           HA       ARG  33 -14.653  -7.792  -7.301
  308    HB2  ARG  33           HB2      ARG  33 -14.538 -10.177  -5.447
  309    HB3  ARG  33           HB3      ARG  33 -13.697 -10.033  -6.983
  310    HG2  ARG  33           HG2      ARG  33 -12.431  -8.119  -6.085
  311    HG3  ARG  33           HG3      ARG  33 -13.241  -8.338  -4.533
  312    HD2  ARG  33           HD2      ARG  33 -11.372 -10.258  -5.915
  313    HD3  ARG  33           HD3      ARG  33 -11.085  -9.379  -4.413
  314    HE   ARG  33           HE       ARG  33 -13.387 -11.002  -4.181
  315   HH11  ARG  33          HH11      ARG  33  -9.886 -11.151  -4.130
  316   HH12  ARG  33          HH12      ARG  33  -9.843 -12.699  -3.345
  317   HH21  ARG  33          HH21      ARG  33 -13.321 -13.031  -3.127
  318   HH22  ARG  33          HH22      ARG  33 -11.778 -13.745  -2.753
  319    H    GLU  34           H        GLU  34 -17.384  -9.118  -5.715
  320    HA   GLU  34           HA       GLU  34 -18.063 -11.119  -7.641
  321    HB2  GLU  34           HB2      GLU  34 -18.957 -11.298  -5.413
  322    HB3  GLU  34           HB3      GLU  34 -19.711  -9.715  -5.532
  323    HG2  GLU  34           HG2      GLU  34 -21.388 -11.406  -5.744
  324    HG3  GLU  34           HG3      GLU  34 -21.195 -10.591  -7.294
  325    H    ARG  35           H        ARG  35 -19.565  -7.928  -6.974
  326    HA   ARG  35           HA       ARG  35 -20.937  -8.076  -9.509
  327    HB2  ARG  35           HB2      ARG  35 -21.934  -5.879  -8.861
  328    HB3  ARG  35           HB3      ARG  35 -22.262  -7.200  -7.754
  329    HG2  ARG  35           HG2      ARG  35 -19.940  -5.473  -7.149
  330    HG3  ARG  35           HG3      ARG  35 -21.549  -4.777  -6.936
  331    HD2  ARG  35           HD2      ARG  35 -20.363  -7.196  -5.598
  332    HD3  ARG  35           HD3      ARG  35 -20.924  -5.705  -4.852
  333    HE   ARG  35           HE       ARG  35 -23.204  -6.530  -5.829
  334   HH11  ARG  35          HH11      ARG  35 -20.680  -8.447  -4.350
  335   HH12  ARG  35          HH12      ARG  35 -21.759  -9.678  -3.765
  336   HH21  ARG  35          HH21      ARG  35 -24.640  -8.164  -5.087
  337   HH22  ARG  35          HH22      ARG  35 -24.014  -9.527  -4.200
  338    H    ILE  36           H        ILE  36 -18.199  -6.337  -8.178
  339    HA   ILE  36           HA       ILE  36 -18.019  -4.743 -10.641
  340    HB   ILE  36           HB       ILE  36 -16.480  -4.403  -8.060
  341   HG12  ILE  36          HG12      ILE  36 -18.828  -2.823  -9.135
  342   HG13  ILE  36          HG13      ILE  36 -18.905  -3.968  -7.799
  343   HG21  ILE  36          HG21      ILE  36 -16.706  -2.625 -10.486
  344   HG22  ILE  36          HG22      ILE  36 -15.866  -2.217  -8.991
  345   HG23  ILE  36          HG23      ILE  36 -15.283  -3.545  -9.995
  346   HD11  ILE  36          HD11      ILE  36 -17.307  -1.419  -7.850
  347   HD12  ILE  36          HD12      ILE  36 -18.832  -1.678  -7.001
  348   HD13  ILE  36          HD13      ILE  36 -17.387  -2.562  -6.510
  349    HA   PRO  37           HA       PRO  37 -14.817  -7.774 -11.672
  350    HB2  PRO  37           HB2      PRO  37 -14.947  -6.616 -14.340
  351    HB3  PRO  37           HB3      PRO  37 -15.366  -8.248 -13.816
  352    HG2  PRO  37           HG2      PRO  37 -17.216  -6.446 -14.643
  353    HG3  PRO  37           HG3      PRO  37 -17.563  -7.709 -13.450
  354    HD2  PRO  37           HD2      PRO  37 -16.972  -4.803 -13.017
  355    HD3  PRO  37           HD3      PRO  37 -18.170  -5.841 -12.213
  356    H    GLU  38           H        GLU  38 -14.890  -4.338 -12.073
  357    HA   GLU  38           HA       GLU  38 -12.233  -4.019 -13.043
  358    HB2  GLU  38           HB2      GLU  38 -14.005  -2.043 -11.592
  359    HB3  GLU  38           HB3      GLU  38 -12.497  -1.644 -12.397
  360    HG2  GLU  38           HG2      GLU  38 -14.201  -1.001 -13.869
  361    HG3  GLU  38           HG3      GLU  38 -13.550  -2.502 -14.523
  362    H    ALA  39           H        ALA  39 -13.625  -4.539  -9.941
  363    HA   ALA  39           HA       ALA  39 -11.668  -3.412  -8.276
  364    HB1  ALA  39           HB1      ALA  39 -12.546  -4.897  -6.548
  365    HB2  ALA  39           HB2      ALA  39 -13.861  -4.177  -7.477
  366    HB3  ALA  39           HB3      ALA  39 -13.382  -5.850  -7.775
  367    H    LEU  40           H        LEU  40 -11.988  -6.609  -9.668
  368    HA   LEU  40           HA       LEU  40  -9.534  -7.567  -8.442
  369    HB2  LEU  40           HB2      LEU  40 -10.223  -9.701  -9.489
  370    HB3  LEU  40           HB3      LEU  40 -11.455  -9.009  -8.443
  371    HG   LEU  40           HG       LEU  40 -11.990  -7.968 -10.972
  372   HD11  LEU  40          HD11      LEU  40 -11.333 -10.886 -11.135
  373   HD12  LEU  40          HD12      LEU  40 -12.209  -9.961 -12.360
  374   HD13  LEU  40          HD13      LEU  40 -10.531  -9.556 -11.980
  375   HD21  LEU  40          HD21      LEU  40 -14.008  -9.312 -10.802
  376   HD22  LEU  40          HD22      LEU  40 -13.275 -10.247  -9.495
  377   HD23  LEU  40          HD23      LEU  40 -13.604  -8.527  -9.273
  378    H    ALA  41           H        ALA  41  -9.278  -5.484 -10.390
  379    HA   ALA  41           HA       ALA  41  -8.640  -6.462 -12.965
  380    HB1  ALA  41           HB1      ALA  41  -7.776  -3.890 -11.653
  381    HB2  ALA  41           HB2      ALA  41  -7.753  -4.237 -13.382
  382    HB3  ALA  41           HB3      ALA  41  -9.290  -4.146 -12.520
  383    H    GLY  42           H        GLY  42  -7.232  -8.006 -11.031
  384    HA2  GLY  42           HA2      GLY  42  -4.792  -8.308 -12.352
  385    HA3  GLY  42           HA3      GLY  42  -4.500  -7.434 -10.846
  386    HA   PRO  43           HA       PRO  43  -5.014 -11.564  -9.126
  387    HB2  PRO  43           HB2      PRO  43  -2.964 -11.280  -7.306
  388    HB3  PRO  43           HB3      PRO  43  -2.813 -11.999  -8.911
  389    HG2  PRO  43           HG2      PRO  43  -1.709  -9.517  -7.950
  390    HG3  PRO  43           HG3      PRO  43  -1.452 -10.311  -9.510
  391    HD2  PRO  43           HD2      PRO  43  -3.217  -8.078  -8.830
  392    HD3  PRO  43           HD3      PRO  43  -2.669  -8.634 -10.424
  393    HA   PRO  44           HA       PRO  44  -7.423  -8.985  -6.323
  394    HB2  PRO  44           HB2      PRO  44  -9.427 -10.739  -5.890
  395    HB3  PRO  44           HB3      PRO  44  -9.267  -9.829  -7.397
  396    HG2  PRO  44           HG2      PRO  44  -8.483 -12.656  -6.799
  397    HG3  PRO  44           HG3      PRO  44  -9.298 -11.998  -8.230
  398    HD2  PRO  44           HD2      PRO  44  -6.638 -12.560  -8.165
  399    HD3  PRO  44           HD3      PRO  44  -7.333 -11.275  -9.173
  400    H    ASN  45           H        ASN  45  -5.259 -10.999  -5.410
  401    HA   ASN  45           HA       ASN  45  -6.383 -11.659  -2.779
  402    HB2  ASN  45           HB2      ASN  45  -3.918 -12.655  -4.216
  403    HB3  ASN  45           HB3      ASN  45  -4.304 -13.064  -2.548
  404   HD21  ASN  45          HD21      ASN  45  -4.074 -14.705  -5.012
  405   HD22  ASN  45          HD22      ASN  45  -5.573 -15.582  -5.099
  406    H    ASP  46           H        ASP  46  -4.247  -9.545  -4.405
  407    HA   ASP  46           HA       ASP  46  -3.086  -8.660  -1.848
  408    HB2  ASP  46           HB2      ASP  46  -1.221  -7.805  -3.038
  409    HB3  ASP  46           HB3      ASP  46  -1.569  -9.374  -3.731
  410    H    PHE  47           H        PHE  47  -5.647  -8.108  -3.462
  411    HA   PHE  47           HA       PHE  47  -5.435  -5.228  -3.837
  412    HB2  PHE  47           HB2      PHE  47  -7.280  -7.377  -4.790
  413    HB3  PHE  47           HB3      PHE  47  -7.826  -5.699  -4.809
  414    HD1  PHE  47           HD1      PHE  47  -4.396  -7.010  -5.489
  415    HD2  PHE  47           HD2      PHE  47  -7.939  -5.239  -7.092
  416    HE1  PHE  47           HE1      PHE  47  -3.255  -6.630  -7.635
  417    HE2  PHE  47           HE2      PHE  47  -6.789  -4.864  -9.229
  418    HZ   PHE  47           HZ       PHE  47  -4.446  -5.562  -9.506
  419    H    GLY  48           H        GLY  48  -6.251  -3.852  -2.422
  420    HA2  GLY  48           HA2      GLY  48  -8.149  -4.868  -0.410
  421    HA3  GLY  48           HA3      GLY  48  -6.658  -4.103   0.111
  422    H    LEU  49           H        LEU  49  -8.300  -2.780   1.256
  423    HA   LEU  49           HA       LEU  49  -9.656  -0.834  -0.462
  424    HB2  LEU  49           HB2      LEU  49 -10.088  -1.388   2.471
  425    HB3  LEU  49           HB3      LEU  49 -11.081  -0.376   1.440
  426    HG   LEU  49           HG       LEU  49 -10.783  -3.372   1.203
  427   HD11  LEU  49          HD11      LEU  49 -12.069  -2.708   3.157
  428   HD12  LEU  49          HD12      LEU  49 -13.086  -1.676   2.152
  429   HD13  LEU  49          HD13      LEU  49 -13.116  -3.426   1.932
  430   HD21  LEU  49          HD21      LEU  49 -12.519  -1.446  -0.333
  431   HD22  LEU  49          HD22      LEU  49 -11.130  -2.328  -0.967
  432   HD23  LEU  49          HD23      LEU  49 -12.573  -3.204  -0.454
  433    H    PHE  50           H        PHE  50  -8.416   0.860  -0.800
  434    HA   PHE  50           HA       PHE  50  -6.954   2.080   1.430
  435    HB2  PHE  50           HB2      PHE  50  -5.764   1.851  -0.726
  436    HB3  PHE  50           HB3      PHE  50  -6.986   2.851  -1.501
  437    HD1  PHE  50           HD1      PHE  50  -4.203   2.847   0.926
  438    HD2  PHE  50           HD2      PHE  50  -6.947   5.217  -1.312
  439    HE1  PHE  50           HE1      PHE  50  -2.916   4.863   1.483
  440    HE2  PHE  50           HE2      PHE  50  -5.659   7.235  -0.755
  441    HZ   PHE  50           HZ       PHE  50  -3.640   7.061   0.642
  442    H    LEU  51           H        LEU  51  -7.678   3.854   2.471
  443    HA   LEU  51           HA       LEU  51 -10.258   4.909   1.593
  444    HB2  LEU  51           HB2      LEU  51  -9.668   4.146   4.011
  445    HB3  LEU  51           HB3      LEU  51  -8.854   5.692   4.131
  446    HG   LEU  51           HG       LEU  51 -11.193   5.609   5.068
  447   HD11  LEU  51          HD11      LEU  51 -11.863   7.775   4.171
  448   HD12  LEU  51          HD12      LEU  51 -10.131   7.733   4.512
  449   HD13  LEU  51          HD13      LEU  51 -10.707   7.592   2.851
  450   HD21  LEU  51          HD21      LEU  51 -11.930   5.456   2.149
  451   HD22  LEU  51          HD22      LEU  51 -12.201   4.203   3.360
  452   HD23  LEU  51          HD23      LEU  51 -13.049   5.743   3.482
  453    H    SER  52           H        SER  52 -10.284   6.614   0.361
  454    HA   SER  52           HA       SER  52  -7.918   8.215  -0.012
  455    HB2  SER  52           HB2      SER  52  -9.348   9.335  -1.765
  456    HB3  SER  52           HB3      SER  52  -9.144   7.597  -1.983
  457    HG   SER  52           HG       SER  52 -11.322   8.450  -0.470
  458    H    ASP  53           H        ASP  53  -7.471   9.889   1.225
  459    HA   ASP  53           HA       ASP  53  -9.668  11.442   2.409
  460    HB2  ASP  53           HB2      ASP  53  -8.043  10.687   4.041
  461    HB3  ASP  53           HB3      ASP  53  -6.716  11.327   3.077
  462    H    ASP  54           H        ASP  54  -6.414  12.098   1.172
  463    HA   ASP  54           HA       ASP  54  -7.023  13.864  -0.866
  464    HB2  ASP  54           HB2      ASP  54  -8.084  15.355   0.680
  465    HB3  ASP  54           HB3      ASP  54  -6.761  15.207   1.830
  466    H    ASP  55           H        ASP  55  -4.903  13.649   1.977
  467    HA   ASP  55           HA       ASP  55  -2.586  13.884   0.168
  468    HB2  ASP  55           HB2      ASP  55  -2.758  15.748   1.745
  469    HB3  ASP  55           HB3      ASP  55  -2.836  14.623   3.094
  470    HA   PRO  56           HA       PRO  56  -1.465   9.701   0.946
  471    HB2  PRO  56           HB2      PRO  56   1.296  10.084   1.193
  472    HB3  PRO  56           HB3      PRO  56   0.410   9.781  -0.303
  473    HG2  PRO  56           HG2      PRO  56   1.343  12.364   0.860
  474    HG3  PRO  56           HG3      PRO  56   1.274  11.852  -0.838
  475    HD2  PRO  56           HD2      PRO  56  -0.533  13.544   0.154
  476    HD3  PRO  56           HD3      PRO  56  -1.007  12.280  -1.001
  477    H    LYS  57           H        LYS  57  -0.246  12.173   3.183
  478    HA   LYS  57           HA       LYS  57   0.664  10.259   5.120
  479    HB2  LYS  57           HB2      LYS  57  -0.064  13.139   5.666
  480    HB3  LYS  57           HB3      LYS  57   1.030  12.111   6.585
  481    HG2  LYS  57           HG2      LYS  57   1.554  12.955   3.748
  482    HG3  LYS  57           HG3      LYS  57   2.119  13.854   5.155
  483    HD2  LYS  57           HD2      LYS  57   2.778  10.974   4.555
  484    HD3  LYS  57           HD3      LYS  57   3.835  12.347   4.227
  485    HE2  LYS  57           HE2      LYS  57   2.818  11.510   6.940
  486    HE3  LYS  57           HE3      LYS  57   4.434  11.203   6.312
  487    HZ1  LYS  57           HZ1      LYS  57   4.545  13.092   7.717
  488    HZ2  LYS  57           HZ2      LYS  57   3.226  13.836   6.956
  489    HZ3  LYS  57           HZ3      LYS  57   4.695  13.664   6.127
  490    H    LYS  58           H        LYS  58  -2.357  11.635   4.276
  491    HA   LYS  58           HA       LYS  58  -3.569  10.926   6.846
  492    HB2  LYS  58           HB2      LYS  58  -4.701  12.427   4.475
  493    HB3  LYS  58           HB3      LYS  58  -5.601  12.056   5.934
  494    HG2  LYS  58           HG2      LYS  58  -4.933  14.279   6.180
  495    HG3  LYS  58           HG3      LYS  58  -3.808  13.363   7.182
  496    HD2  LYS  58           HD2      LYS  58  -2.085  13.542   5.553
  497    HD3  LYS  58           HD3      LYS  58  -3.205  14.181   4.350
  498    HE2  LYS  58           HE2      LYS  58  -2.312  15.545   6.887
  499    HE3  LYS  58           HE3      LYS  58  -1.846  15.967   5.239
  500    HZ1  LYS  58           HZ1      LYS  58  -4.292  16.333   4.830
  501    HZ2  LYS  58           HZ2      LYS  58  -3.530  17.465   5.831
  502    HZ3  LYS  58           HZ3      LYS  58  -4.505  16.258   6.513
  503    H    GLY  59           H        GLY  59  -3.471  10.023   3.482
  504    HA2  GLY  59           HA2      GLY  59  -5.688   8.307   3.367
  505    HA3  GLY  59           HA3      GLY  59  -4.235   8.152   2.388
  506    H    ILE  60           H        ILE  60  -5.921   6.075   3.699
  507    HA   ILE  60           HA       ILE  60  -3.836   4.804   5.320
  508    HB   ILE  60           HB       ILE  60  -5.631   3.972   6.890
  509   HG12  ILE  60          HG12      ILE  60  -7.188   6.293   5.728
  510   HG13  ILE  60          HG13      ILE  60  -7.552   4.594   5.444
  511   HG21  ILE  60          HG21      ILE  60  -4.009   5.643   7.558
  512   HG22  ILE  60          HG22      ILE  60  -5.029   6.922   6.899
  513   HG23  ILE  60          HG23      ILE  60  -5.582   5.978   8.283
  514   HD11  ILE  60          HD11      ILE  60  -8.003   4.291   7.816
  515   HD12  ILE  60          HD12      ILE  60  -7.624   5.989   8.108
  516   HD13  ILE  60          HD13      ILE  60  -9.019   5.553   7.121
  517    H    TRP  61           H        TRP  61  -3.985   2.533   5.444
  518    HA   TRP  61           HA       TRP  61  -5.598   1.341   3.318
  519    HB2  TRP  61           HB2      TRP  61  -3.166   0.410   4.814
  520    HB3  TRP  61           HB3      TRP  61  -4.170  -0.725   3.913
  521    HD1  TRP  61           HD1      TRP  61  -1.481   1.832   3.468
  522    HE1  TRP  61           HE1      TRP  61  -0.867   2.039   0.985
  523    HE3  TRP  61           HE3      TRP  61  -5.316  -0.888   1.500
  524    HZ2  TRP  61           HZ2      TRP  61  -1.888   1.141  -1.494
  525    HZ3  TRP  61           HZ3      TRP  61  -5.428  -1.172  -0.940
  526    HH2  TRP  61           HH2      TRP  61  -3.746  -0.176  -2.401
  527    H    LEU  62           H        LEU  62  -7.307   0.188   3.721
  528    HA   LEU  62           HA       LEU  62  -8.104  -0.237   6.473
  529    HB2  LEU  62           HB2      LEU  62  -9.589  -0.914   3.930
  530    HB3  LEU  62           HB3      LEU  62 -10.264  -0.795   5.545
  531    HG   LEU  62           HG       LEU  62  -9.106   1.520   3.987
  532   HD11  LEU  62          HD11      LEU  62 -11.975   0.797   4.546
  533   HD12  LEU  62          HD12      LEU  62 -11.407   2.269   3.756
  534   HD13  LEU  62          HD13      LEU  62 -11.167   0.703   2.981
  535   HD21  LEU  62          HD21      LEU  62 -10.614   1.417   6.588
  536   HD22  LEU  62          HD22      LEU  62  -8.902   1.796   6.389
  537   HD23  LEU  62          HD23      LEU  62 -10.127   2.885   5.734
  538    H    GLU  63           H        GLU  63  -7.171  -1.970   7.385
  539    HA   GLU  63           HA       GLU  63  -6.569  -4.343   5.865
  540    HB2  GLU  63           HB2      GLU  63  -5.588  -5.168   7.937
  541    HB3  GLU  63           HB3      GLU  63  -5.032  -3.533   7.609
  542    HG2  GLU  63           HG2      GLU  63  -6.539  -2.633   9.248
  543    HG3  GLU  63           HG3      GLU  63  -7.266  -4.220   9.503
  544    H    ALA  64           H        ALA  64  -7.275  -6.480   6.588
  545    HA   ALA  64           HA       ALA  64 -10.115  -6.578   6.945
  546    HB1  ALA  64           HB1      ALA  64  -9.813  -9.005   6.878
  547    HB2  ALA  64           HB2      ALA  64  -8.946  -8.208   5.566
  548    HB3  ALA  64           HB3      ALA  64  -8.067  -8.789   6.980
  549    H    GLY  65           H        GLY  65  -7.853  -5.869   9.125
  550    HA2  GLY  65           HA2      GLY  65  -8.842  -7.577  11.276
  551    HA3  GLY  65           HA3      GLY  65  -7.440  -6.524  11.352
  552    H    LYS  66           H        LYS  66 -10.111  -4.929   9.986
  553    HA   LYS  66           HA       LYS  66 -11.266  -4.129  12.502
  554    HB2  LYS  66           HB2      LYS  66 -10.459  -2.018  12.716
  555    HB3  LYS  66           HB3      LYS  66  -9.088  -2.683  11.845
  556    HG2  LYS  66           HG2      LYS  66 -11.378  -1.284  10.490
  557    HG3  LYS  66           HG3      LYS  66  -9.934  -0.450  11.058
  558    HD2  LYS  66           HD2      LYS  66  -8.748  -1.111   9.289
  559    HD3  LYS  66           HD3      LYS  66  -9.304  -2.780   9.444
  560    HE2  LYS  66           HE2      LYS  66  -9.945  -1.652   7.300
  561    HE3  LYS  66           HE3      LYS  66 -11.291  -2.319   8.219
  562    HZ1  LYS  66           HZ1      LYS  66 -11.716  -0.085   7.310
  563    HZ2  LYS  66           HZ2      LYS  66 -10.482   0.533   8.287
  564    HZ3  LYS  66           HZ3      LYS  66 -11.862  -0.154   8.995
  565    H    ALA  67           H        ALA  67 -13.061  -2.516  12.132
  566    HA   ALA  67           HA       ALA  67 -14.505  -3.422   9.769
  567    HB1  ALA  67           HB1      ALA  67 -15.566  -3.525  11.981
  568    HB2  ALA  67           HB2      ALA  67 -15.467  -1.765  12.098
  569    HB3  ALA  67           HB3      ALA  67 -16.471  -2.512  10.852
  570    H    LEU  68           H        LEU  68 -15.982  -1.698   8.745
  571    HA   LEU  68           HA       LEU  68 -14.237   0.257   7.583
  572    HB2  LEU  68           HB2      LEU  68 -17.196  -0.210   7.222
  573    HB3  LEU  68           HB3      LEU  68 -16.226   0.877   6.257
  574    HG   LEU  68           HG       LEU  68 -15.855  -2.115   6.402
  575   HD11  LEU  68          HD11      LEU  68 -17.909  -1.519   5.250
  576   HD12  LEU  68          HD12      LEU  68 -17.026  -0.374   4.238
  577   HD13  LEU  68          HD13      LEU  68 -16.701  -2.102   4.104
  578   HD21  LEU  68          HD21      LEU  68 -14.312  -1.780   4.538
  579   HD22  LEU  68          HD22      LEU  68 -14.538  -0.036   4.666
  580   HD23  LEU  68          HD23      LEU  68 -13.772  -0.922   5.982
  581    H    ASP  69           H        ASP  69 -17.261   0.446   9.405
  582    HA   ASP  69           HA       ASP  69 -17.327   3.256   9.634
  583    HB2  ASP  69           HB2      ASP  69 -19.374   2.083   9.820
  584    HB3  ASP  69           HB3      ASP  69 -18.748   1.021  11.073
  585    H    TYR  70           H        TYR  70 -15.539   0.894  11.341
  586    HA   TYR  70           HA       TYR  70 -15.166   2.063  13.823
  587    HB2  TYR  70           HB2      TYR  70 -14.179  -0.001  13.718
  588    HB3  TYR  70           HB3      TYR  70 -13.576   0.236  12.084
  589    HD1  TYR  70           HD1      TYR  70 -12.963   1.175  15.639
  590    HD2  TYR  70           HD2      TYR  70 -11.363   0.846  11.714
  591    HE1  TYR  70           HE1      TYR  70 -10.711   1.633  16.524
  592    HE2  TYR  70           HE2      TYR  70  -9.116   1.304  12.582
  593    HH   TYR  70           HH       TYR  70  -8.360   1.233  15.893
  594    H    TYR  71           H        TYR  71 -13.677   2.843  10.720
  595    HA   TYR  71           HA       TYR  71 -12.075   4.954  11.863
  596    HB2  TYR  71           HB2      TYR  71 -12.566   4.006   9.060
  597    HB3  TYR  71           HB3      TYR  71 -11.738   5.527   9.370
  598    HD1  TYR  71           HD1      TYR  71  -9.672   5.417  10.938
  599    HD2  TYR  71           HD2      TYR  71 -11.363   2.028   9.008
  600    HE1  TYR  71           HE1      TYR  71  -7.544   4.208  11.213
  601    HE2  TYR  71           HE2      TYR  71  -9.246   0.812   9.281
  602    HH   TYR  71           HH       TYR  71  -6.801   1.787  11.333
  603    H    MET  72           H        MET  72 -12.712   6.653   9.430
  604    HA   MET  72           HA       MET  72 -14.876   8.122  10.761
  605    HB2  MET  72           HB2      MET  72 -12.693   9.041   8.891
  606    HB3  MET  72           HB3      MET  72 -13.960  10.085   9.518
  607    HG2  MET  72           HG2      MET  72 -13.167   9.777  11.768
  608    HG3  MET  72           HG3      MET  72 -11.973   8.601  11.221
  609    HE1  MET  72           HE1      MET  72 -12.959  11.896   9.326
  610    HE2  MET  72           HE2      MET  72 -13.118  12.361  11.019
  611    HE3  MET  72           HE3      MET  72 -11.837  13.060  10.031
  612    H    LEU  73           H        LEU  73 -14.946   5.947   8.483
  613    HA   LEU  73           HA       LEU  73 -16.189   7.597   6.411
  614    HB2  LEU  73           HB2      LEU  73 -16.212   5.249   5.209
  615    HB3  LEU  73           HB3      LEU  73 -14.811   6.299   5.188
  616    HG   LEU  73           HG       LEU  73 -14.998   4.246   7.341
  617   HD11  LEU  73          HD11      LEU  73 -15.573   3.040   5.280
  618   HD12  LEU  73          HD12      LEU  73 -14.127   3.688   4.507
  619   HD13  LEU  73          HD13      LEU  73 -13.976   2.591   5.880
  620   HD21  LEU  73          HD21      LEU  73 -13.215   5.882   7.352
  621   HD22  LEU  73          HD22      LEU  73 -12.561   4.282   6.995
  622   HD23  LEU  73          HD23      LEU  73 -12.788   5.457   5.696
  623    H    ARG  74           H        ARG  74 -18.144   7.468   5.801
  624    HA   ARG  74           HA       ARG  74 -19.959   5.405   6.742
  625    HB2  ARG  74           HB2      ARG  74 -20.430   8.352   7.308
  626    HB3  ARG  74           HB3      ARG  74 -21.575   7.053   7.605
  627    HG2  ARG  74           HG2      ARG  74 -20.566   6.427   9.506
  628    HG3  ARG  74           HG3      ARG  74 -18.946   6.777   8.891
  629    HD2  ARG  74           HD2      ARG  74 -20.972   8.846   9.735
  630    HD3  ARG  74           HD3      ARG  74 -19.625   8.287  10.713
  631    HE   ARG  74           HE       ARG  74 -18.810   9.280   8.151
  632   HH11  ARG  74          HH11      ARG  74 -19.645  10.227  11.418
  633   HH12  ARG  74          HH12      ARG  74 -18.677  11.674  11.378
  634   HH21  ARG  74          HH21      ARG  74 -17.554  11.174   8.088
  635   HH22  ARG  74          HH22      ARG  74 -17.499  12.224   9.474
  636    H    ASN  75           H        ASN  75 -22.221   7.158   5.947
  637    HA   ASN  75           HA       ASN  75 -22.237   6.580   3.172
  638    HB2  ASN  75           HB2      ASN  75 -24.078   7.974   5.054
  639    HB3  ASN  75           HB3      ASN  75 -24.302   8.249   3.329
  640   HD21  ASN  75          HD21      ASN  75 -24.232   5.824   5.846
  641   HD22  ASN  75          HD22      ASN  75 -25.139   4.628   4.970
  642    H    GLY  76           H        GLY  76 -20.698   7.582   1.969
  643    HA2  GLY  76           HA2      GLY  76 -20.983   9.771   0.609
  644    HA3  GLY  76           HA3      GLY  76 -20.546  10.508   2.140
  645    H    ASP  77           H        ASP  77 -18.611   8.318   2.785
  646    HA   ASP  77           HA       ASP  77 -16.393   9.707   1.689
  647    HB2  ASP  77           HB2      ASP  77 -16.511   7.162   3.311
  648    HB3  ASP  77           HB3      ASP  77 -15.037   8.056   2.942
  649    H    THR  78           H        THR  78 -14.731   8.947   0.400
  650    HA   THR  78           HA       THR  78 -15.576   6.985  -1.594
  651    HB   THR  78           HB       THR  78 -13.200   8.866  -1.633
  652    HG1  THR  78           HG1      THR  78 -15.663   9.558  -1.707
  653   HG21  THR  78          HG21      THR  78 -13.240   8.459  -4.065
  654   HG22  THR  78          HG22      THR  78 -14.538   7.286  -3.837
  655   HG23  THR  78          HG23      THR  78 -12.939   6.977  -3.156
  656    H    MET  79           H        MET  79 -14.509   5.068  -1.902
  657    HA   MET  79           HA       MET  79 -12.166   4.560  -0.214
  658    HB2  MET  79           HB2      MET  79 -14.333   3.618   0.759
  659    HB3  MET  79           HB3      MET  79 -14.354   2.523  -0.618
  660    HG2  MET  79           HG2      MET  79 -12.189   1.629   0.050
  661    HG3  MET  79           HG3      MET  79 -12.155   2.732   1.424
  662    HE1  MET  79           HE1      MET  79 -14.931  -0.897   0.933
  663    HE2  MET  79           HE2      MET  79 -15.072   0.515  -0.117
  664    HE3  MET  79           HE3      MET  79 -13.600  -0.462  -0.148
  665    H    GLU  80           H        GLU  80 -10.584   4.119  -1.499
  666    HA   GLU  80           HA       GLU  80 -10.993   3.363  -4.251
  667    HB2  GLU  80           HB2      GLU  80  -9.225   4.958  -3.224
  668    HB3  GLU  80           HB3      GLU  80  -8.367   3.497  -2.771
  669    HG2  GLU  80           HG2      GLU  80  -8.175   2.862  -5.103
  670    HG3  GLU  80           HG3      GLU  80  -9.093   4.291  -5.578
  671    H    TYR  81           H        TYR  81 -11.155   1.203  -4.924
  672    HA   TYR  81           HA       TYR  81  -9.927  -0.811  -3.197
  673    HB2  TYR  81           HB2      TYR  81 -12.284  -1.193  -4.032
  674    HB3  TYR  81           HB3      TYR  81 -11.629  -1.274  -5.665
  675    HD1  TYR  81           HD1      TYR  81 -11.837  -2.972  -2.424
  676    HD2  TYR  81           HD2      TYR  81 -10.357  -3.234  -6.402
  677    HE1  TYR  81           HE1      TYR  81 -11.376  -5.359  -2.089
  678    HE2  TYR  81           HE2      TYR  81  -9.886  -5.630  -6.077
  679    HH   TYR  81           HH       TYR  81  -9.404  -7.139  -4.034
  680    H    ARG  82           H        ARG  82  -7.898  -1.098  -3.606
  681    HA   ARG  82           HA       ARG  82  -6.990  -1.032  -6.385
  682    HB2  ARG  82           HB2      ARG  82  -5.059   0.400  -5.758
  683    HB3  ARG  82           HB3      ARG  82  -6.609   1.223  -5.642
  684    HG2  ARG  82           HG2      ARG  82  -6.619   0.978  -3.253
  685    HG3  ARG  82           HG3      ARG  82  -5.146   0.009  -3.315
  686    HD2  ARG  82           HD2      ARG  82  -5.342   2.857  -4.264
  687    HD3  ARG  82           HD3      ARG  82  -4.801   2.389  -2.656
  688    HE   ARG  82           HE       ARG  82  -3.097   1.004  -4.120
  689   HH11  ARG  82          HH11      ARG  82  -4.313   4.212  -4.767
  690   HH12  ARG  82          HH12      ARG  82  -2.773   4.838  -5.300
  691   HH21  ARG  82          HH21      ARG  82  -1.074   1.794  -4.890
  692   HH22  ARG  82          HH22      ARG  82  -0.934   3.449  -5.390
  693    H    LYS  83           H        LYS  83  -4.629  -1.604  -6.489
  694    HA   LYS  83           HA       LYS  83  -4.044  -4.009  -5.128
  695    HB2  LYS  83           HB2      LYS  83  -3.141  -3.429  -7.342
  696    HB3  LYS  83           HB3      LYS  83  -2.266  -2.078  -6.643
  697    HG2  LYS  83           HG2      LYS  83  -0.596  -3.377  -5.919
  698    HG3  LYS  83           HG3      LYS  83  -1.686  -4.675  -5.425
  699    HD2  LYS  83           HD2      LYS  83  -1.945  -5.337  -7.766
  700    HD3  LYS  83           HD3      LYS  83  -0.826  -4.058  -8.249
  701    HE2  LYS  83           HE2      LYS  83   0.938  -5.326  -7.768
  702    HE3  LYS  83           HE3      LYS  83   0.296  -5.716  -6.171
  703    HZ1  LYS  83           HZ1      LYS  83   0.626  -7.661  -7.668
  704    HZ2  LYS  83           HZ2      LYS  83  -0.598  -7.045  -8.668
  705    HZ3  LYS  83           HZ3      LYS  83  -0.958  -7.501  -7.071
  706    H    LYS  84           H        LYS  84  -3.235  -4.265  -3.091
  707    HA   LYS  84           HA       LYS  84  -2.787  -2.034  -1.408
  708    HB2  LYS  84           HB2      LYS  84  -2.008  -4.929  -1.069
  709    HB3  LYS  84           HB3      LYS  84  -1.715  -3.708   0.156
  710    HG2  LYS  84           HG2      LYS  84  -4.290  -3.297  -0.072
  711    HG3  LYS  84           HG3      LYS  84  -4.273  -4.938  -0.726
  712    HD2  LYS  84           HD2      LYS  84  -2.959  -5.619   1.313
  713    HD3  LYS  84           HD3      LYS  84  -3.300  -4.017   1.973
  714    HE2  LYS  84           HE2      LYS  84  -5.687  -4.459   1.861
  715    HE3  LYS  84           HE3      LYS  84  -5.379  -6.035   1.132
  716    HZ1  LYS  84           HZ1      LYS  84  -4.741  -5.155   3.891
  717    HZ2  LYS  84           HZ2      LYS  84  -4.076  -6.553   3.204
  718    HZ3  LYS  84           HZ3      LYS  84  -5.754  -6.430   3.403
  719    H    GLN  85           H        GLN  85  -0.812  -3.748  -3.603
  720    HA   GLN  85           HA       GLN  85   1.664  -2.859  -2.400
  721    HB2  GLN  85           HB2      GLN  85   1.673  -4.220  -5.020
  722    HB3  GLN  85           HB3      GLN  85   2.670  -4.506  -3.599
  723    HG2  GLN  85           HG2      GLN  85   0.518  -5.495  -2.576
  724    HG3  GLN  85           HG3      GLN  85  -0.042  -5.572  -4.246
  725   HE21  GLN  85          HE21      GLN  85   2.039  -6.895  -1.862
  726   HE22  GLN  85          HE22      GLN  85   2.663  -8.196  -2.816
  727    H    ARG  86           H        ARG  86   3.043  -1.429  -3.351
  728    HA   ARG  86           HA       ARG  86   1.997   0.007  -5.690
  729    HB2  ARG  86           HB2      ARG  86   3.407   1.956  -4.610
  730    HB3  ARG  86           HB3      ARG  86   1.757   1.637  -4.107
  731    HG2  ARG  86           HG2      ARG  86   3.072   2.044  -2.165
  732    HG3  ARG  86           HG3      ARG  86   2.647   0.335  -2.191
  733    HD2  ARG  86           HD2      ARG  86   5.029   0.902  -1.539
  734    HD3  ARG  86           HD3      ARG  86   4.833  -0.307  -2.808
  735    HE   ARG  86           HE       ARG  86   5.957   1.067  -4.203
  736   HH11  ARG  86          HH11      ARG  86   4.644   3.057  -1.642
  737   HH12  ARG  86          HH12      ARG  86   5.438   4.497  -2.187
  738   HH21  ARG  86          HH21      ARG  86   7.000   2.956  -4.926
  739   HH22  ARG  86          HH22      ARG  86   6.795   4.444  -4.047
  740    HA   PRO  87           HA       PRO  87   5.711  -0.819  -7.828
  741    HB2  PRO  87           HB2      PRO  87   6.181   1.546  -9.133
  742    HB3  PRO  87           HB3      PRO  87   4.967   0.364  -9.633
  743    HG2  PRO  87           HG2      PRO  87   4.627   2.886  -8.067
  744    HG3  PRO  87           HG3      PRO  87   3.599   2.212  -9.345
  745    HD2  PRO  87           HD2      PRO  87   2.971   2.003  -6.727
  746    HD3  PRO  87           HD3      PRO  87   2.558   0.740  -7.905
  747    H    LEU  88           H        LEU  88   7.366  -1.115  -6.470
  748    HA   LEU  88           HA       LEU  88   8.793   1.238  -5.449
  749    HB2  LEU  88           HB2      LEU  88   8.733  -1.641  -4.628
  750    HB3  LEU  88           HB3      LEU  88  10.097  -0.628  -4.198
  751    HG   LEU  88           HG       LEU  88   7.289   0.190  -3.511
  752   HD11  LEU  88          HD11      LEU  88   7.625  -0.820  -1.314
  753   HD12  LEU  88          HD12      LEU  88   7.618  -2.037  -2.591
  754   HD13  LEU  88          HD13      LEU  88   9.142  -1.525  -1.871
  755   HD21  LEU  88          HD21      LEU  88   8.998   1.903  -3.338
  756   HD22  LEU  88          HD22      LEU  88   8.466   1.422  -1.725
  757   HD23  LEU  88          HD23      LEU  88  10.004   0.835  -2.361
  758    H    LYS  89           H        LYS  89  10.411   1.934  -6.669
  759    HA   LYS  89           HA       LYS  89  11.834   0.043  -8.373
  760    HB2  LYS  89           HB2      LYS  89  11.913   3.054  -8.178
  761    HB3  LYS  89           HB3      LYS  89  13.111   2.146  -9.091
  762    HG2  LYS  89           HG2      LYS  89  11.611   2.689 -10.730
  763    HG3  LYS  89           HG3      LYS  89  11.026   1.096 -10.247
  764    HD2  LYS  89           HD2      LYS  89   9.068   2.279 -10.254
  765    HD3  LYS  89           HD3      LYS  89   9.563   2.500  -8.576
  766    HE2  LYS  89           HE2      LYS  89   8.858   4.623  -9.482
  767    HE3  LYS  89           HE3      LYS  89  10.598   4.656  -9.198
  768    HZ1  LYS  89           HZ1      LYS  89   9.240   4.261 -11.812
  769    HZ2  LYS  89           HZ2      LYS  89  10.916   4.163 -11.581
  770    HZ3  LYS  89           HZ3      LYS  89  10.113   5.633 -11.327
  771    H    ILE  90           H        ILE  90  13.563  -0.915  -7.666
  772    HA   ILE  90           HA       ILE  90  14.997   0.252  -5.367
  773    HB   ILE  90           HB       ILE  90  14.399  -2.695  -5.717
  774   HG12  ILE  90          HG12      ILE  90  12.371  -1.423  -5.104
  775   HG13  ILE  90          HG13      ILE  90  12.897  -2.482  -3.800
  776   HG21  ILE  90          HG21      ILE  90  16.510  -2.301  -4.594
  777   HG22  ILE  90          HG22      ILE  90  15.731  -1.195  -3.461
  778   HG23  ILE  90          HG23      ILE  90  15.319  -2.910  -3.444
  779   HD11  ILE  90          HD11      ILE  90  13.903  -0.565  -2.664
  780   HD12  ILE  90          HD12      ILE  90  13.354   0.489  -3.967
  781   HD13  ILE  90          HD13      ILE  90  12.177  -0.335  -2.943
  782    H    ARG  91           H        ARG  91  17.209   0.187  -5.536
  783    HA   ARG  91           HA       ARG  91  18.319  -1.267  -7.833
  784    HB2  ARG  91           HB2      ARG  91  18.598   1.238  -7.808
  785    HB3  ARG  91           HB3      ARG  91  19.534   1.057  -6.330
  786    HG2  ARG  91           HG2      ARG  91  21.160  -0.331  -7.543
  787    HG3  ARG  91           HG3      ARG  91  20.251  -0.054  -9.031
  788    HD2  ARG  91           HD2      ARG  91  21.426   2.137  -7.328
  789    HD3  ARG  91           HD3      ARG  91  22.230   1.442  -8.732
  790    HE   ARG  91           HE       ARG  91  20.045   2.199  -9.909
  791   HH11  ARG  91          HH11      ARG  91  21.710   3.928  -7.343
  792   HH12  ARG  91          HH12      ARG  91  21.169   5.492  -7.883
  793   HH21  ARG  91          HH21      ARG  91  19.374   4.238 -10.631
  794   HH22  ARG  91          HH22      ARG  91  19.868   5.670  -9.774
  795    H    MET  92           H        MET  92  19.566  -2.979  -7.377
  796    HA   MET  92           HA       MET  92  20.246  -3.593  -4.637
  797    HB2  MET  92           HB2      MET  92  20.625  -5.057  -7.243
  798    HB3  MET  92           HB3      MET  92  21.320  -5.643  -5.741
  799    HG2  MET  92           HG2      MET  92  19.420  -6.795  -5.568
  800    HG3  MET  92           HG3      MET  92  18.745  -5.265  -5.011
  801    HE1  MET  92           HE1      MET  92  17.690  -3.466  -6.823
  802    HE2  MET  92           HE2      MET  92  16.297  -4.212  -7.607
  803    HE3  MET  92           HE3      MET  92  16.576  -4.461  -5.883
  804    H    LEU  93           H        LEU  93  22.539  -4.646  -4.391
  805    HA   LEU  93           HA       LEU  93  24.265  -2.438  -4.254
  806    HB2  LEU  93           HB2      LEU  93  24.962  -5.363  -3.974
  807    HB3  LEU  93           HB3      LEU  93  25.967  -4.026  -3.464
  808    HG   LEU  93           HG       LEU  93  25.047  -4.766  -1.481
  809   HD11  LEU  93          HD11      LEU  93  24.723  -2.375  -1.692
  810   HD12  LEU  93          HD12      LEU  93  23.133  -2.640  -2.408
  811   HD13  LEU  93          HD13      LEU  93  23.434  -3.105  -0.734
  812   HD21  LEU  93          HD21      LEU  93  22.787  -5.497  -1.132
  813   HD22  LEU  93          HD22      LEU  93  22.338  -5.023  -2.769
  814   HD23  LEU  93          HD23      LEU  93  23.466  -6.354  -2.517
  815    H    ASP  94           H        ASP  94  24.075  -5.126  -6.516
  816    HA   ASP  94           HA       ASP  94  26.500  -4.653  -7.883
  817    HB2  ASP  94           HB2      ASP  94  25.150  -6.732  -8.095
  818    HB3  ASP  94           HB3      ASP  94  23.936  -5.826  -8.990
  819    H    GLY  95           H        GLY  95  23.583  -2.919  -7.795
  820    HA2  GLY  95           HA2      GLY  95  23.409  -0.725  -8.720
  821    HA3  GLY  95           HA3      GLY  95  24.497  -1.219 -10.014
  822    H    THR  96           H        THR  96  22.211  -3.560  -9.243
  823    HA   THR  96           HA       THR  96  20.865  -3.126 -11.776
  824    HB   THR  96           HB       THR  96  20.514  -5.386  -9.795
  825    HG1  THR  96           HG1      THR  96  22.473  -4.864 -11.742
  826   HG21  THR  96          HG21      THR  96  19.886  -5.182 -12.743
  827   HG22  THR  96          HG22      THR  96  18.710  -5.202 -11.429
  828   HG23  THR  96          HG23      THR  96  19.699  -6.628 -11.750
  829    H    VAL  97           H        VAL  97  18.809  -2.383 -11.961
  830    HA   VAL  97           HA       VAL  97  17.398  -1.887  -9.427
  831    HB   VAL  97           HB       VAL  97  17.986   0.187 -10.529
  832   HG11  VAL  97          HG11      VAL  97  17.100   0.785 -12.723
  833   HG12  VAL  97          HG12      VAL  97  18.194  -0.595 -12.807
  834   HG13  VAL  97          HG13      VAL  97  16.450  -0.844 -12.900
  835   HG21  VAL  97          HG21      VAL  97  15.871   0.144  -9.331
  836   HG22  VAL  97          HG22      VAL  97  15.772   1.215 -10.729
  837   HG23  VAL  97          HG23      VAL  97  15.037  -0.387 -10.793
  838    H    LYS  98           H        LYS  98  15.341  -2.466  -9.185
  839    HA   LYS  98           HA       LYS  98  13.915  -3.679 -11.435
  840    HB2  LYS  98           HB2      LYS  98  13.322  -5.686 -10.308
  841    HB3  LYS  98           HB3      LYS  98  15.062  -5.530 -10.140
  842    HG2  LYS  98           HG2      LYS  98  14.907  -4.980  -7.869
  843    HG3  LYS  98           HG3      LYS  98  13.189  -4.602  -7.992
  844    HD2  LYS  98           HD2      LYS  98  14.364  -7.360  -8.355
  845    HD3  LYS  98           HD3      LYS  98  13.640  -6.778  -6.852
  846    HE2  LYS  98           HE2      LYS  98  11.809  -7.780  -7.738
  847    HE3  LYS  98           HE3      LYS  98  11.639  -6.202  -8.507
  848    HZ1  LYS  98           HZ1      LYS  98  12.752  -8.679  -9.713
  849    HZ2  LYS  98           HZ2      LYS  98  12.845  -7.159 -10.454
  850    HZ3  LYS  98           HZ3      LYS  98  11.334  -7.864 -10.156
  851    H    THR  99           H        THR  99  11.597  -3.795 -11.103
  852    HA   THR  99           HA       THR  99  10.680  -2.111  -8.873
  853    HB   THR  99           HB       THR  99   9.410  -2.348 -11.609
  854    HG1  THR  99           HG1      THR  99  11.530  -0.947 -10.853
  855   HG21  THR  99          HG21      THR  99   8.036  -0.462 -10.858
  856   HG22  THR  99          HG22      THR  99   8.835  -0.502  -9.286
  857   HG23  THR  99          HG23      THR  99   7.831  -1.858  -9.799
  858    H    ILE 100           H        ILE 100   9.610  -3.295  -7.445
  859    HA   ILE 100           HA       ILE 100   8.074  -5.610  -8.404
  860    HB   ILE 100           HB       ILE 100  10.187  -6.259  -7.234
  861   HG12  ILE 100          HG12      ILE 100   7.847  -7.509  -7.161
  862   HG13  ILE 100          HG13      ILE 100   9.242  -8.112  -6.278
  863   HG21  ILE 100          HG21      ILE 100  10.361  -4.452  -5.647
  864   HG22  ILE 100          HG22      ILE 100   8.886  -4.983  -4.837
  865   HG23  ILE 100          HG23      ILE 100  10.327  -5.998  -4.796
  866   HD11  ILE 100          HD11      ILE 100   7.227  -8.214  -4.934
  867   HD12  ILE 100          HD12      ILE 100   8.388  -7.086  -4.235
  868   HD13  ILE 100          HD13      ILE 100   6.994  -6.476  -5.126
  869    H    MET 101           H        MET 101   6.099  -6.010  -7.319
  870    HA   MET 101           HA       MET 101   5.003  -3.590  -6.134
  871    HB2  MET 101           HB2      MET 101   3.668  -6.210  -6.847
  872    HB3  MET 101           HB3      MET 101   2.843  -4.735  -6.364
  873    HG2  MET 101           HG2      MET 101   4.534  -5.050  -8.833
  874    HG3  MET 101           HG3      MET 101   2.772  -5.109  -8.782
  875    HE1  MET 101           HE1      MET 101   2.079  -2.922  -6.651
  876    HE2  MET 101           HE2      MET 101   1.880  -1.474  -7.642
  877    HE3  MET 101           HE3      MET 101   1.231  -3.018  -8.196
  878    H    VAL 102           H        VAL 102   5.296  -3.312  -4.106
  879    HA   VAL 102           HA       VAL 102   4.903  -5.565  -2.234
  880    HB   VAL 102           HB       VAL 102   6.462  -3.096  -1.529
  881   HG11  VAL 102          HG11      VAL 102   5.788  -4.503   0.307
  882   HG12  VAL 102          HG12      VAL 102   6.471  -5.922  -0.488
  883   HG13  VAL 102          HG13      VAL 102   7.532  -4.631   0.076
  884   HG21  VAL 102          HG21      VAL 102   7.545  -3.920  -3.504
  885   HG22  VAL 102          HG22      VAL 102   8.530  -4.314  -2.094
  886   HG23  VAL 102          HG23      VAL 102   7.552  -5.566  -2.864
  887    H    ASP 103           H        ASP 103   3.443  -5.327  -0.654
  888    HA   ASP 103           HA       ASP 103   1.372  -3.522  -0.819
  889    HB2  ASP 103           HB2      ASP 103   2.321  -4.877   1.712
  890    HB3  ASP 103           HB3      ASP 103   0.704  -4.262   1.392
  891    H    ASP 104           H        ASP 104   1.022  -1.512  -0.182
  892    HA   ASP 104           HA       ASP 104   3.143   0.003   1.093
  893    HB2  ASP 104           HB2      ASP 104   1.882   0.966  -0.779
  894    HB3  ASP 104           HB3      ASP 104   0.382   0.799   0.122
  895    H    SER 105           H        SER 105   0.592  -1.888   2.027
  896    HA   SER 105           HA       SER 105  -0.318  -0.408   4.332
  897    HB2  SER 105           HB2      SER 105  -0.840  -3.324   3.861
  898    HB3  SER 105           HB3      SER 105  -1.914  -2.095   4.532
  899    HG   SER 105           HG       SER 105  -1.680  -1.157   2.273
  900    H    LYS 106           H        LYS 106   2.496  -0.848   4.475
  901    HA   LYS 106           HA       LYS 106   2.691  -2.525   6.854
  902    HB2  LYS 106           HB2      LYS 106   4.624  -3.763   5.938
  903    HB3  LYS 106           HB3      LYS 106   3.149  -4.085   5.031
  904    HG2  LYS 106           HG2      LYS 106   3.833  -2.691   3.248
  905    HG3  LYS 106           HG3      LYS 106   5.167  -2.026   4.186
  906    HD2  LYS 106           HD2      LYS 106   6.281  -3.517   2.867
  907    HD3  LYS 106           HD3      LYS 106   5.941  -4.522   4.276
  908    HE2  LYS 106           HE2      LYS 106   4.243  -4.448   1.783
  909    HE3  LYS 106           HE3      LYS 106   5.493  -5.647   2.100
  910    HZ1  LYS 106           HZ1      LYS 106   3.423  -6.590   2.702
  911    HZ2  LYS 106           HZ2      LYS 106   2.972  -5.233   3.610
  912    HZ3  LYS 106           HZ3      LYS 106   4.233  -6.235   4.150
  913    H    THR 107           H        THR 107   5.337  -2.594   7.258
  914    HA   THR 107           HA       THR 107   6.224   0.212   7.167
  915    HB   THR 107           HB       THR 107   7.814  -0.476   8.994
  916    HG1  THR 107           HG1      THR 107   6.160  -2.810   9.071
  917   HG21  THR 107          HG21      THR 107   5.745   0.707   9.514
  918   HG22  THR 107          HG22      THR 107   6.114  -0.477  10.768
  919   HG23  THR 107          HG23      THR 107   4.868  -0.823   9.568
  920    H    VAL 108           H        VAL 108   8.922  -0.097   7.581
  921    HA   VAL 108           HA       VAL 108   9.787  -0.557   4.931
  922    HB   VAL 108           HB       VAL 108  11.467  -0.244   7.401
  923   HG11  VAL 108          HG11      VAL 108  12.101   0.268   4.505
  924   HG12  VAL 108          HG12      VAL 108  13.165   0.624   5.866
  925   HG13  VAL 108          HG13      VAL 108  12.734  -1.047   5.499
  926   HG21  VAL 108          HG21      VAL 108  10.342   1.867   5.574
  927   HG22  VAL 108          HG22      VAL 108   9.885   1.583   7.253
  928   HG23  VAL 108          HG23      VAL 108  11.509   2.153   6.865
  929    H    THR 109           H        THR 109  10.726  -2.171   7.942
  930    HA   THR 109           HA       THR 109  12.374  -4.137   7.074
  931    HB   THR 109           HB       THR 109  10.242  -4.519   9.178
  932    HG1  THR 109           HG1      THR 109  11.398  -3.239  10.411
  933   HG21  THR 109          HG21      THR 109  12.956  -5.807   8.846
  934   HG22  THR 109          HG22      THR 109  11.400  -6.594   8.585
  935   HG23  THR 109          HG23      THR 109  11.855  -6.056  10.201
  936    H    ASP 110           H        ASP 110   8.818  -4.406   7.202
  937    HA   ASP 110           HA       ASP 110   8.747  -7.094   6.312
  938    HB2  ASP 110           HB2      ASP 110   6.935  -5.930   7.598
  939    HB3  ASP 110           HB3      ASP 110   6.543  -5.026   6.137
  940    H    MET 111           H        MET 111   8.573  -3.990   4.700
  941    HA   MET 111           HA       MET 111   7.951  -4.932   2.108
  942    HB2  MET 111           HB2      MET 111   7.639  -2.627   2.496
  943    HB3  MET 111           HB3      MET 111   9.254  -2.432   3.160
  944    HG2  MET 111           HG2      MET 111  10.175  -2.885   0.900
  945    HG3  MET 111           HG3      MET 111   8.525  -2.905   0.282
  946    HE1  MET 111           HE1      MET 111   9.232  -0.367   3.203
  947    HE2  MET 111           HE2      MET 111  10.820  -0.877   2.615
  948    HE3  MET 111           HE3      MET 111  10.278   0.786   2.375
  949    H    LEU 112           H        LEU 112  11.037  -4.189   3.701
  950    HA   LEU 112           HA       LEU 112  12.693  -4.697   1.492
  951    HB2  LEU 112           HB2      LEU 112  13.160  -3.678   3.893
  952    HB3  LEU 112           HB3      LEU 112  13.640  -5.325   4.250
  953    HG   LEU 112           HG       LEU 112  15.241  -5.190   2.305
  954   HD11  LEU 112          HD11      LEU 112  15.833  -2.949   1.515
  955   HD12  LEU 112          HD12      LEU 112  14.161  -3.351   1.122
  956   HD13  LEU 112          HD13      LEU 112  14.514  -2.268   2.469
  957   HD21  LEU 112          HD21      LEU 112  16.899  -3.895   3.526
  958   HD22  LEU 112          HD22      LEU 112  15.629  -3.194   4.529
  959   HD23  LEU 112          HD23      LEU 112  15.972  -4.920   4.622
  960    H    MET 113           H        MET 113  11.436  -6.796   4.020
  961    HA   MET 113           HA       MET 113  12.852  -9.143   3.425
  962    HB2  MET 113           HB2      MET 113  11.413  -8.751   5.431
  963    HB3  MET 113           HB3      MET 113   9.999  -8.914   4.403
  964    HG2  MET 113           HG2      MET 113  10.508 -11.205   3.946
  965    HG3  MET 113           HG3      MET 113  12.058 -11.074   4.776
  966    HE1  MET 113           HE1      MET 113   8.151 -11.102   5.180
  967    HE2  MET 113           HE2      MET 113   7.970 -10.833   6.914
  968    HE3  MET 113           HE3      MET 113   8.594  -9.545   5.882
  969    H    THR 114           H        THR 114   9.971  -7.744   2.083
  970    HA   THR 114           HA       THR 114   9.288  -9.923   0.384
  971    HB   THR 114           HB       THR 114   8.473  -7.020   0.360
  972    HG1  THR 114           HG1      THR 114   7.629  -7.950   2.153
  973   HG21  THR 114          HG21      THR 114   6.586  -7.740  -1.070
  974   HG22  THR 114          HG22      THR 114   7.309  -9.345  -1.187
  975   HG23  THR 114          HG23      THR 114   8.145  -7.949  -1.871
  976    H    ILE 115           H        ILE 115  11.242  -6.996   0.000
  977    HA   ILE 115           HA       ILE 115  11.397  -7.194  -2.857
  978    HB   ILE 115           HB       ILE 115  13.071  -5.571  -0.932
  979   HG12  ILE 115          HG12      ILE 115  10.706  -4.746  -2.632
  980   HG13  ILE 115          HG13      ILE 115  10.640  -5.045  -0.899
  981   HG21  ILE 115          HG21      ILE 115  13.656  -4.224  -2.901
  982   HG22  ILE 115          HG22      ILE 115  14.212  -5.891  -3.051
  983   HG23  ILE 115          HG23      ILE 115  12.777  -5.358  -3.927
  984   HD11  ILE 115          HD11      ILE 115  12.258  -2.905  -2.261
  985   HD12  ILE 115          HD12      ILE 115  10.746  -2.671  -1.384
  986   HD13  ILE 115          HD13      ILE 115  12.192  -3.200  -0.523
  987    H    CYS 116           H        CYS 116  13.579  -7.919  -0.151
  988    HA   CYS 116           HA       CYS 116  15.815  -8.639  -1.679
  989    HB2  CYS 116           HB2      CYS 116  14.952  -9.552   1.073
  990    HB3  CYS 116           HB3      CYS 116  16.540  -9.866   0.383
  991    HG   CYS 116           HG       CYS 116  17.510  -7.773   1.507
  992    H    ALA 117           H        ALA 117  12.997 -10.476  -0.694
  993    HA   ALA 117           HA       ALA 117  13.959 -13.042  -1.366
  994    HB1  ALA 117           HB1      ALA 117  11.113 -12.044  -1.315
  995    HB2  ALA 117           HB2      ALA 117  11.622 -13.734  -1.306
  996    HB3  ALA 117           HB3      ALA 117  12.008 -12.689   0.062
  997    H    ARG 118           H        ARG 118  12.738 -10.427  -3.275
  998    HA   ARG 118           HA       ARG 118  11.870 -11.897  -5.542
  999    HB2  ARG 118           HB2      ARG 118  12.946  -9.053  -5.492
 1000    HB3  ARG 118           HB3      ARG 118  11.905  -9.781  -6.722
 1001    HG2  ARG 118           HG2      ARG 118  11.178  -9.139  -3.879
 1002    HG3  ARG 118           HG3      ARG 118  10.563  -8.378  -5.343
 1003    HD2  ARG 118           HD2      ARG 118  10.142 -11.263  -4.582
 1004    HD3  ARG 118           HD3      ARG 118   8.972  -9.968  -4.343
 1005    HE   ARG 118           HE       ARG 118   9.842 -10.233  -7.076
 1006   HH11  ARG 118          HH11      ARG 118   7.601 -11.407  -4.642
 1007   HH12  ARG 118          HH12      ARG 118   6.412 -11.926  -5.803
 1008   HH21  ARG 118          HH21      ARG 118   8.277 -10.904  -8.602
 1009   HH22  ARG 118          HH22      ARG 118   6.805 -11.640  -8.059
 1010    H    ILE 119           H        ILE 119  14.910 -10.451  -4.594
 1011    HA   ILE 119           HA       ILE 119  16.212 -11.026  -7.105
 1012    HB   ILE 119           HB       ILE 119  17.513 -10.079  -4.559
 1013   HG12  ILE 119          HG12      ILE 119  16.412  -8.101  -6.464
 1014   HG13  ILE 119          HG13      ILE 119  15.246  -8.991  -5.488
 1015   HG21  ILE 119          HG21      ILE 119  18.037  -9.483  -7.474
 1016   HG22  ILE 119          HG22      ILE 119  18.955  -8.847  -6.110
 1017   HG23  ILE 119          HG23      ILE 119  18.980 -10.575  -6.459
 1018   HD11  ILE 119          HD11      ILE 119  16.571  -8.269  -3.486
 1019   HD12  ILE 119          HD12      ILE 119  17.425  -7.164  -4.561
 1020   HD13  ILE 119          HD13      ILE 119  15.678  -7.015  -4.344
 1021    H    GLY 120           H        GLY 120  15.946 -12.326  -3.904
 1022    HA2  GLY 120           HA2      GLY 120  16.401 -14.658  -3.539
 1023    HA3  GLY 120           HA3      GLY 120  17.716 -14.529  -4.698
 1024    H    ILE 121           H        ILE 121  17.329 -11.940  -2.519
 1025    HA   ILE 121           HA       ILE 121  19.858 -12.552  -1.252
 1026    HB   ILE 121           HB       ILE 121  18.001 -10.204  -0.818
 1027   HG12  ILE 121          HG12      ILE 121  20.533 -10.335  -2.468
 1028   HG13  ILE 121          HG13      ILE 121  18.909 -10.403  -3.143
 1029   HG21  ILE 121          HG21      ILE 121  20.873 -10.623  -0.009
 1030   HG22  ILE 121          HG22      ILE 121  19.957  -9.130   0.198
 1031   HG23  ILE 121          HG23      ILE 121  19.478 -10.587   1.071
 1032   HD11  ILE 121          HD11      ILE 121  20.083  -8.095  -1.599
 1033   HD12  ILE 121          HD12      ILE 121  19.857  -8.177  -3.347
 1034   HD13  ILE 121          HD13      ILE 121  18.456  -8.163  -2.278
 1035    H    THR 122           H        THR 122  19.763 -14.047   0.298
 1036    HA   THR 122           HA       THR 122  17.508 -14.779   1.766
 1037    HB   THR 122           HB       THR 122  20.361 -15.181   2.665
 1038    HG1  THR 122           HG1      THR 122  20.419 -16.943   1.267
 1039   HG21  THR 122          HG21      THR 122  17.866 -16.857   2.988
 1040   HG22  THR 122          HG22      THR 122  18.633 -15.891   4.248
 1041   HG23  THR 122          HG23      THR 122  19.475 -17.284   3.570
 1042    H    ASN 123           H        ASN 123  20.331 -12.874   2.812
 1043    HA   ASN 123           HA       ASN 123  19.124 -12.199   5.329
 1044    HB2  ASN 123           HB2      ASN 123  21.134 -10.684   5.544
 1045    HB3  ASN 123           HB3      ASN 123  21.508 -12.385   5.303
 1046   HD21  ASN 123          HD21      ASN 123  21.784  -9.210   4.057
 1047   HD22  ASN 123          HD22      ASN 123  22.718  -9.594   2.655
 1048    H    HIS 124           H        HIS 124  17.455 -10.820   5.416
 1049    HA   HIS 124           HA       HIS 124  17.164  -8.980   3.161
 1050    HB2  HIS 124           HB2      HIS 124  14.834  -8.907   3.598
 1051    HB3  HIS 124           HB3      HIS 124  15.321 -10.589   3.750
 1052    HD1  HIS 124           HD1      HIS 124  13.634  -7.885   5.535
 1053    HD2  HIS 124           HD2      HIS 124  15.459 -11.482   6.526
 1054    HE1  HIS 124           HE1      HIS 124  12.774  -8.466   7.820
 1055    HE2  HIS 124           HE2      HIS 124  13.843 -10.684   8.377
 1056    H    ASP 125           H        ASP 125  17.347  -8.863   6.709
 1057    HA   ASP 125           HA       ASP 125  16.608  -6.023   6.569
 1058    HB2  ASP 125           HB2      ASP 125  15.447  -7.725   8.129
 1059    HB3  ASP 125           HB3      ASP 125  16.908  -7.608   9.106
 1060    H    GLU 126           H        GLU 126  19.312  -7.595   6.213
 1061    HA   GLU 126           HA       GLU 126  20.980  -6.147   8.078
 1062    HB2  GLU 126           HB2      GLU 126  21.933  -7.675   5.660
 1063    HB3  GLU 126           HB3      GLU 126  22.831  -7.284   7.115
 1064    HG2  GLU 126           HG2      GLU 126  20.556  -9.233   6.871
 1065    HG3  GLU 126           HG3      GLU 126  22.255  -9.608   7.141
 1066    H    TYR 127           H        TYR 127  19.265  -5.310   5.513
 1067    HA   TYR 127           HA       TYR 127  21.181  -3.284   4.582
 1068    HB2  TYR 127           HB2      TYR 127  18.677  -4.287   3.206
 1069    HB3  TYR 127           HB3      TYR 127  19.809  -3.099   2.565
 1070    HD1  TYR 127           HD1      TYR 127  22.194  -3.853   2.147
 1071    HD2  TYR 127           HD2      TYR 127  18.991  -6.554   2.816
 1072    HE1  TYR 127           HE1      TYR 127  23.509  -5.643   1.125
 1073    HE2  TYR 127           HE2      TYR 127  20.293  -8.363   1.804
 1074    HH   TYR 127           HH       TYR 127  22.182  -8.629   0.221
 1075    H    SER 128           H        SER 128  20.439  -1.159   4.376
 1076    HA   SER 128           HA       SER 128  17.948  -0.554   5.808
 1077    HB2  SER 128           HB2      SER 128  18.961   1.764   5.973
 1078    HB3  SER 128           HB3      SER 128  19.820   0.522   6.882
 1079    HG   SER 128           HG       SER 128  21.333   1.690   5.750
 1080    H    LEU 129           H        LEU 129  16.727   1.345   4.790
 1081    HA   LEU 129           HA       LEU 129  17.040   1.062   1.877
 1082    HB2  LEU 129           HB2      LEU 129  14.859   0.343   3.163
 1083    HB3  LEU 129           HB3      LEU 129  14.506   2.059   3.114
 1084    HG   LEU 129           HG       LEU 129  15.176   0.568   0.594
 1085   HD11  LEU 129          HD11      LEU 129  13.376  -0.680   1.648
 1086   HD12  LEU 129          HD12      LEU 129  12.456   0.808   1.867
 1087   HD13  LEU 129          HD13      LEU 129  12.784   0.206   0.242
 1088   HD21  LEU 129          HD21      LEU 129  15.144   2.998   0.486
 1089   HD22  LEU 129          HD22      LEU 129  13.795   2.316  -0.422
 1090   HD23  LEU 129          HD23      LEU 129  13.519   3.021   1.171
 1091    H    VAL 130           H        VAL 130  17.049   2.891   0.595
 1092    HA   VAL 130           HA       VAL 130  16.948   5.473   1.975
 1093    HB   VAL 130           HB       VAL 130  19.293   5.000   1.994
 1094   HG11  VAL 130          HG11      VAL 130  19.049   4.366  -0.927
 1095   HG12  VAL 130          HG12      VAL 130  20.555   4.442  -0.015
 1096   HG13  VAL 130          HG13      VAL 130  19.349   3.219   0.378
 1097   HG21  VAL 130          HG21      VAL 130  18.724   6.820  -0.335
 1098   HG22  VAL 130          HG22      VAL 130  18.754   7.284   1.367
 1099   HG23  VAL 130          HG23      VAL 130  20.234   6.746   0.572
 1100    H    ARG 131           H        ARG 131  15.540   6.687   0.948
 1101    HA   ARG 131           HA       ARG 131  14.811   6.021  -1.813
 1102    HB2  ARG 131           HB2      ARG 131  13.511   7.927   0.143
 1103    HB3  ARG 131           HB3      ARG 131  12.868   7.454  -1.418
 1104    HG2  ARG 131           HG2      ARG 131  12.342   5.306  -0.662
 1105    HG3  ARG 131           HG3      ARG 131  13.358   5.474   0.776
 1106    HD2  ARG 131           HD2      ARG 131  10.863   5.727   1.139
 1107    HD3  ARG 131           HD3      ARG 131  11.883   7.024   1.762
 1108    HE   ARG 131           HE       ARG 131  10.718   7.395  -0.889
 1109   HH11  ARG 131          HH11      ARG 131  10.674   8.156   2.522
 1110   HH12  ARG 131          HH12      ARG 131   9.676   9.560   2.336
 1111   HH21  ARG 131          HH21      ARG 131   9.418   9.282  -1.156
 1112   HH22  ARG 131          HH22      ARG 131   8.944  10.178   0.255
 1113    H    GLU 132           H        GLU 132  16.303   7.016  -3.098
 1114    HA   GLU 132           HA       GLU 132  16.956   9.786  -2.664
 1115    HB2  GLU 132           HB2      GLU 132  17.646   7.892  -4.918
 1116    HB3  GLU 132           HB3      GLU 132  18.148   9.572  -4.887
 1117    HG2  GLU 132           HG2      GLU 132  19.136   8.914  -2.552
 1118    HG3  GLU 132           HG3      GLU 132  19.066   7.285  -3.228
 1119    H    LEU 133           H        LEU 133  15.657  11.396  -3.241
 1120    HA   LEU 133           HA       LEU 133  13.902  10.924  -5.545
 1121    HB2  LEU 133           HB2      LEU 133  12.978  12.835  -3.503
 1122    HB3  LEU 133           HB3      LEU 133  12.065  11.736  -4.505
 1123    HG   LEU 133           HG       LEU 133  13.614  10.881  -2.060
 1124   HD11  LEU 133          HD11      LEU 133  10.679  11.428  -2.442
 1125   HD12  LEU 133          HD12      LEU 133  11.407  10.703  -1.005
 1126   HD13  LEU 133          HD13      LEU 133  11.799  12.365  -1.453
 1127   HD21  LEU 133          HD21      LEU 133  11.561   9.440  -3.737
 1128   HD22  LEU 133          HD22      LEU 133  13.292   9.102  -3.710
 1129   HD23  LEU 133          HD23      LEU 133  12.315   8.824  -2.267
 1130    H    MET 134           H        MET 134  12.966  12.940  -6.347
 1131    HA   MET 134           HA       MET 134  14.937  15.124  -6.509
 1132    HB2  MET 134           HB2      MET 134  13.338  15.809  -8.435
 1133    HB3  MET 134           HB3      MET 134  14.378  14.409  -8.684
 1134    HG2  MET 134           HG2      MET 134  12.655  13.000  -8.818
 1135    HG3  MET 134           HG3      MET 134  11.829  13.745  -7.456
 1136    HE1  MET 134           HE1      MET 134  10.076  15.556  -7.589
 1137    HE2  MET 134           HE2      MET 134  11.280  16.683  -8.213
 1138    HE3  MET 134           HE3      MET 134   9.716  16.533  -9.015
 1139    H    GLU 135           H        GLU 135  12.898  14.406  -4.420
 1140    HA   GLU 135           HA       GLU 135  10.577  15.848  -4.452
 1141    HB2  GLU 135           HB2      GLU 135  12.139  14.410  -2.536
 1142    HB3  GLU 135           HB3      GLU 135  11.503  15.873  -1.799
 1143    HG2  GLU 135           HG2      GLU 135   9.895  13.764  -3.192
 1144    HG3  GLU 135           HG3      GLU 135  10.002  14.031  -1.452
 1145    H    GLU 136           H        GLU 136  10.065  17.875  -4.459
 1146    HA   GLU 136           HA       GLU 136  11.947  19.981  -4.160
 1147    HB2  GLU 136           HB2      GLU 136  10.018  21.442  -4.530
 1148    HB3  GLU 136           HB3      GLU 136  10.007  20.105  -5.675
 1149    HG2  GLU 136           HG2      GLU 136   8.354  18.940  -4.315
 1150    HG3  GLU 136           HG3      GLU 136   8.392  20.256  -3.152
 1151    H    LYS 137           H        LYS 137   9.685  18.397  -2.059
 1152    HA   LYS 137           HA       LYS 137   9.918  20.513  -0.040
 1153    HB2  LYS 137           HB2      LYS 137   8.164  18.051   0.031
 1154    HB3  LYS 137           HB3      LYS 137   8.063  19.449   1.089
 1155    HG2  LYS 137           HG2      LYS 137   7.380  20.832  -0.810
 1156    HG3  LYS 137           HG3      LYS 137   7.483  19.420  -1.860
 1157    HD2  LYS 137           HD2      LYS 137   5.767  18.303  -0.513
 1158    HD3  LYS 137           HD3      LYS 137   5.639  19.744   0.497
 1159    HE2  LYS 137           HE2      LYS 137   3.859  19.667  -1.180
 1160    HE3  LYS 137           HE3      LYS 137   4.925  21.049  -1.426
 1161    HZ1  LYS 137           HZ1      LYS 137   4.246  19.689  -3.452
 1162    HZ2  LYS 137           HZ2      LYS 137   5.352  18.525  -2.901
 1163    HZ3  LYS 137           HZ3      LYS 137   5.882  20.091  -3.285
 1164    H    LYS 138           H        LYS 138  10.021  16.992  -0.282
 1165    HA   LYS 138           HA       LYS 138  11.113  16.506   2.246
 1166    HB2  LYS 138           HB2      LYS 138   9.948  14.946   0.559
 1167    HB3  LYS 138           HB3      LYS 138  11.538  14.755  -0.161
 1168    HG2  LYS 138           HG2      LYS 138  12.387  13.681   1.726
 1169    HG3  LYS 138           HG3      LYS 138  11.045  14.218   2.741
 1170    HD2  LYS 138           HD2      LYS 138  10.783  12.316   0.410
 1171    HD3  LYS 138           HD3      LYS 138  10.906  11.820   2.098
 1172    HE2  LYS 138           HE2      LYS 138   8.646  11.829   1.939
 1173    HE3  LYS 138           HE3      LYS 138   8.882  13.539   2.319
 1174    HZ1  LYS 138           HZ1      LYS 138   8.840  13.989  -0.101
 1175    HZ2  LYS 138           HZ2      LYS 138   7.381  13.378   0.487
 1176    HZ3  LYS 138           HZ3      LYS 138   8.431  12.369  -0.386
 1177    H    ASP 169           H        ASP 169  12.777  16.410  -0.924
 1178    HA   ASP 169           HA       ASP 169  14.972  16.546  -1.520
 1179    HB2  ASP 169           HB2      ASP 169  14.434  18.903  -1.032
 1180    HB3  ASP 169           HB3      ASP 169  14.918  18.669   0.643
 1181    H    GLU 170           H        GLU 170  14.859  14.345  -0.250
 1182    HA   GLU 170           HA       GLU 170  17.135  14.355   1.573
 1183    HB2  GLU 170           HB2      GLU 170  14.460  13.092   2.160
 1184    HB3  GLU 170           HB3      GLU 170  15.929  12.702   3.036
 1185    HG2  GLU 170           HG2      GLU 170  16.120  14.981   3.797
 1186    HG3  GLU 170           HG3      GLU 170  14.688  15.429   2.869
 1187    H    LEU 171           H        LEU 171  18.070  12.308   1.936
 1188    HA   LEU 171           HA       LEU 171  18.068  10.509  -0.316
 1189    HB2  LEU 171           HB2      LEU 171  19.363  10.097   2.378
 1190    HB3  LEU 171           HB3      LEU 171  19.807   9.354   0.852
 1191    HG   LEU 171           HG       LEU 171  20.111  12.270   1.519
 1192   HD11  LEU 171          HD11      LEU 171  22.167  10.076   1.329
 1193   HD12  LEU 171          HD12      LEU 171  22.508  11.792   1.556
 1194   HD13  LEU 171          HD13      LEU 171  21.644  10.893   2.803
 1195   HD21  LEU 171          HD21      LEU 171  21.422  12.321  -0.573
 1196   HD22  LEU 171          HD22      LEU 171  20.944  10.650  -0.881
 1197   HD23  LEU 171          HD23      LEU 171  19.723  11.927  -0.838
 1198    H    ASN 172           H        ASN 172  16.547  10.886   2.692
 1199    HA   ASN 172           HA       ASN 172  14.950   9.722   3.809
 1200    HB2  ASN 172           HB2      ASN 172  14.541   8.916   0.959
 1201    HB3  ASN 172           HB3      ASN 172  13.532   8.226   2.215
 1202   HD21  ASN 172          HD21      ASN 172  14.136  10.904   0.215
 1203   HD22  ASN 172          HD22      ASN 172  12.899  11.938   0.838
 1204    H    TRP 173           H        TRP 173  16.709   8.513   4.970
 1205    HA   TRP 173           HA       TRP 173  17.222   5.820   4.017
 1206    HB2  TRP 173           HB2      TRP 173  18.270   7.487   6.304
 1207    HB3  TRP 173           HB3      TRP 173  18.594   5.761   6.193
 1208    HD1  TRP 173           HD1      TRP 173  19.180   8.963   4.071
 1209    HE1  TRP 173           HE1      TRP 173  21.395   8.670   2.815
 1210    HE3  TRP 173           HE3      TRP 173  20.308   4.199   5.531
 1211    HZ2  TRP 173           HZ2      TRP 173  23.377   6.681   2.485
 1212    HZ3  TRP 173           HZ3      TRP 173  22.385   3.177   4.704
 1213    HH2  TRP 173           HH2      TRP 173  23.886   4.393   3.213
 1214    H    LEU 174           H        LEU 174  15.536   4.490   4.395
 1215    HA   LEU 174           HA       LEU 174  13.588   4.965   6.387
 1216    HB2  LEU 174           HB2      LEU 174  14.131   2.421   4.867
 1217    HB3  LEU 174           HB3      LEU 174  12.693   2.770   5.803
 1218    HG   LEU 174           HG       LEU 174  13.520   3.873   3.152
 1219   HD11  LEU 174          HD11      LEU 174  11.126   3.318   2.687
 1220   HD12  LEU 174          HD12      LEU 174  12.131   1.933   3.123
 1221   HD13  LEU 174          HD13      LEU 174  11.034   2.630   4.314
 1222   HD21  LEU 174          HD21      LEU 174  11.492   5.110   5.007
 1223   HD22  LEU 174          HD22      LEU 174  13.035   5.828   4.542
 1224   HD23  LEU 174          HD23      LEU 174  11.781   5.572   3.326
 1225    H    ASP 175           H        ASP 175  13.423   4.394   8.359
 1226    HA   ASP 175           HA       ASP 175  15.740   3.460   9.759
 1227    HB2  ASP 175           HB2      ASP 175  14.254   3.981  11.760
 1228    HB3  ASP 175           HB3      ASP 175  14.606   5.324  10.675
 1229    H    HIS 176           H        HIS 176  13.025   1.868   8.538
 1230    HA   HIS 176           HA       HIS 176  12.386  -0.317   8.653
 1231    HB2  HIS 176           HB2      HIS 176  14.727  -0.526  10.524
 1232    HB3  HIS 176           HB3      HIS 176  13.658  -1.891  10.211
 1233    HD1  HIS 176           HD1      HIS 176  14.028  -3.182   8.092
 1234    HD2  HIS 176           HD2      HIS 176  16.202   0.349   8.240
 1235    HE1  HIS 176           HE1      HIS 176  15.465  -3.183   6.035
 1236    HE2  HIS 176           HE2      HIS 176  17.052  -1.275   6.420
 1237    H    GLY 177           H        GLY 177  11.219   1.771  10.317
 1238    HA2  GLY 177           HA2      GLY 177   9.784  -0.074  12.084
 1239    HA3  GLY 177           HA3      GLY 177  10.524   1.331  12.834
 1240    H    ARG 178           H        ARG 178  10.034   3.124  10.676
 1241    HA   ARG 178           HA       ARG 178   7.289   3.777  11.328
 1242    HB2  ARG 178           HB2      ARG 178   9.066   5.439  11.496
 1243    HB3  ARG 178           HB3      ARG 178   9.446   5.233   9.797
 1244    HG2  ARG 178           HG2      ARG 178   7.369   6.223   9.150
 1245    HG3  ARG 178           HG3      ARG 178   6.831   6.289  10.835
 1246    HD2  ARG 178           HD2      ARG 178   7.932   8.389   9.647
 1247    HD3  ARG 178           HD3      ARG 178   8.207   8.038  11.355
 1248    HE   ARG 178           HE       ARG 178  10.166   6.709   9.857
 1249   HH11  ARG 178          HH11      ARG 178   9.249  10.009  10.613
 1250   HH12  ARG 178          HH12      ARG 178  10.887  10.598  10.560
 1251   HH21  ARG 178          HH21      ARG 178  12.291   7.455   9.831
 1252   HH22  ARG 178          HH22      ARG 178  12.624   9.146  10.128
 1253    H    THR 179           H        THR 179   5.595   3.976   9.847
 1254    HA   THR 179           HA       THR 179   5.731   2.126   7.680
 1255    HB   THR 179           HB       THR 179   3.671   2.286   8.910
 1256    HG1  THR 179           HG1      THR 179   3.303   1.664   6.821
 1257   HG21  THR 179          HG21      THR 179   3.465   5.114   7.874
 1258   HG22  THR 179          HG22      THR 179   3.752   4.642   9.548
 1259   HG23  THR 179          HG23      THR 179   2.215   4.257   8.775
 1260    H    LEU 180           H        LEU 180   4.984   2.610   5.497
 1261    HA   LEU 180           HA       LEU 180   6.952   4.323   4.414
 1262    HB2  LEU 180           HB2      LEU 180   4.723   2.935   2.943
 1263    HB3  LEU 180           HB3      LEU 180   6.293   3.410   2.312
 1264    HG   LEU 180           HG       LEU 180   5.798   1.292   4.404
 1265   HD11  LEU 180          HD11      LEU 180   5.149   0.369   2.366
 1266   HD12  LEU 180          HD12      LEU 180   6.471   1.148   1.491
 1267   HD13  LEU 180          HD13      LEU 180   6.814  -0.174   2.610
 1268   HD21  LEU 180          HD21      LEU 180   8.194   0.806   4.166
 1269   HD22  LEU 180          HD22      LEU 180   8.363   2.239   3.148
 1270   HD23  LEU 180          HD23      LEU 180   7.884   2.412   4.838
 1271    H    ARG 181           H        ARG 181   3.444   4.599   4.703
 1272    HA   ARG 181           HA       ARG 181   3.269   6.941   3.082
 1273    HB2  ARG 181           HB2      ARG 181   1.440   5.352   4.730
 1274    HB3  ARG 181           HB3      ARG 181   1.076   7.072   4.722
 1275    HG2  ARG 181           HG2      ARG 181   0.834   7.094   2.355
 1276    HG3  ARG 181           HG3      ARG 181   1.462   5.449   2.218
 1277    HD2  ARG 181           HD2      ARG 181  -1.071   6.210   3.666
 1278    HD3  ARG 181           HD3      ARG 181  -1.007   5.579   2.019
 1279    HE   ARG 181           HE       ARG 181  -0.116   3.520   2.913
 1280   HH11  ARG 181          HH11      ARG 181  -1.635   5.715   5.192
 1281   HH12  ARG 181          HH12      ARG 181  -1.795   4.514   6.439
 1282   HH21  ARG 181          HH21      ARG 181  -0.320   1.945   4.558
 1283   HH22  ARG 181          HH22      ARG 181  -1.086   2.361   6.066
 1284    H    GLU 182           H        GLU 182   4.311   6.359   6.273
 1285    HA   GLU 182           HA       GLU 182   3.753   8.991   7.297
 1286    HB2  GLU 182           HB2      GLU 182   4.132   6.765   8.600
 1287    HB3  GLU 182           HB3      GLU 182   5.840   7.125   8.402
 1288    HG2  GLU 182           HG2      GLU 182   5.132   7.897  10.541
 1289    HG3  GLU 182           HG3      GLU 182   5.468   9.297   9.521
 1290    H    GLN 183           H        GLN 183   6.403   7.367   5.655
 1291    HA   GLN 183           HA       GLN 183   8.165   9.630   5.732
 1292    HB2  GLN 183           HB2      GLN 183   8.082   7.148   4.029
 1293    HB3  GLN 183           HB3      GLN 183   9.239   8.439   3.735
 1294    HG2  GLN 183           HG2      GLN 183  10.444   6.949   5.003
 1295    HG3  GLN 183           HG3      GLN 183   9.872   8.104   6.201
 1296   HE21  GLN 183          HE21      GLN 183   9.467   4.879   4.914
 1297   HE22  GLN 183          HE22      GLN 183   8.602   4.254   6.283
 1298    H    GLY 184           H        GLY 184   5.289   9.002   4.159
 1299    HA2  GLY 184           HA2      GLY 184   4.237   9.844   2.301
 1300    HA3  GLY 184           HA3      GLY 184   5.367  11.190   2.405
 1301    H    VAL 185           H        VAL 185   5.787   7.715   1.752
 1302    HA   VAL 185           HA       VAL 185   7.774   8.192  -0.216
 1303    HB   VAL 185           HB       VAL 185   7.684   5.813  -0.719
 1304   HG11  VAL 185          HG11      VAL 185   7.483   6.366   2.235
 1305   HG12  VAL 185          HG12      VAL 185   8.195   4.926   1.504
 1306   HG13  VAL 185          HG13      VAL 185   8.932   6.507   1.239
 1307   HG21  VAL 185          HG21      VAL 185   5.297   5.455  -0.675
 1308   HG22  VAL 185          HG22      VAL 185   6.095   4.334   0.428
 1309   HG23  VAL 185          HG23      VAL 185   5.257   5.750   1.064
 1310    H    GLU 186           H        GLU 186   7.689   8.248  -2.381
 1311    HA   GLU 186           HA       GLU 186   5.068   8.536  -3.601
 1312    HB2  GLU 186           HB2      GLU 186   7.761   9.045  -4.874
 1313    HB3  GLU 186           HB3      GLU 186   6.199   9.625  -5.404
 1314    HG2  GLU 186           HG2      GLU 186   7.316  11.465  -4.478
 1315    HG3  GLU 186           HG3      GLU 186   6.097  10.992  -3.305
 1316    H    GLU 187           H        GLU 187   4.706   7.500  -5.698
 1317    HA   GLU 187           HA       GLU 187   5.865   4.808  -5.730
 1318    HB2  GLU 187           HB2      GLU 187   3.385   6.010  -6.935
 1319    HB3  GLU 187           HB3      GLU 187   3.924   4.377  -7.301
 1320    HG2  GLU 187           HG2      GLU 187   3.564   3.659  -5.089
 1321    HG3  GLU 187           HG3      GLU 187   3.404   5.311  -4.496
 1322    H    HIS 188           H        HIS 188   6.895   7.495  -6.916
 1323    HA   HIS 188           HA       HIS 188   7.384   6.464  -9.631
 1324    HB2  HIS 188           HB2      HIS 188   7.278   8.785 -10.480
 1325    HB3  HIS 188           HB3      HIS 188   5.750   8.260  -9.784
 1326    HD1  HIS 188           HD1      HIS 188   4.915   9.477  -7.693
 1327    HD2  HIS 188           HD2      HIS 188   8.625  10.806  -9.018
 1328    HE1  HIS 188           HE1      HIS 188   5.424  11.537  -6.344
 1329    HE2  HIS 188           HE2      HIS 188   7.492  12.495  -7.418
 1330    H    GLU 189           H        GLU 189   8.890   7.019  -6.829
 1331    HA   GLU 189           HA       GLU 189  11.233   8.332  -8.043
 1332    HB2  GLU 189           HB2      GLU 189  10.244   8.219  -5.207
 1333    HB3  GLU 189           HB3      GLU 189  11.874   8.742  -5.607
 1334    HG2  GLU 189           HG2      GLU 189   9.313  10.010  -6.550
 1335    HG3  GLU 189           HG3      GLU 189  10.392  10.636  -5.302
 1336    H    THR 190           H        THR 190  13.367   7.527  -7.520
 1337    HA   THR 190           HA       THR 190  13.402   4.651  -7.390
 1338    HB   THR 190           HB       THR 190  15.774   6.524  -7.517
 1339    HG1  THR 190           HG1      THR 190  15.171   6.894  -9.506
 1340   HG21  THR 190          HG21      THR 190  15.454   3.619  -8.304
 1341   HG22  THR 190          HG22      THR 190  16.342   4.216  -6.904
 1342   HG23  THR 190          HG23      THR 190  16.909   4.588  -8.530
 1343    H    LEU 191           H        LEU 191  13.882   3.404  -5.731
 1344    HA   LEU 191           HA       LEU 191  14.939   4.673  -3.287
 1345    HB2  LEU 191           HB2      LEU 191  13.341   2.115  -3.296
 1346    HB3  LEU 191           HB3      LEU 191  13.713   3.152  -1.939
 1347    HG   LEU 191           HG       LEU 191  11.465   3.525  -2.242
 1348   HD11  LEU 191          HD11      LEU 191  12.583   5.663  -2.205
 1349   HD12  LEU 191          HD12      LEU 191  12.728   5.640  -3.962
 1350   HD13  LEU 191          HD13      LEU 191  11.135   5.734  -3.210
 1351   HD21  LEU 191          HD21      LEU 191  11.881   3.515  -5.221
 1352   HD22  LEU 191          HD22      LEU 191  11.167   2.224  -4.254
 1353   HD23  LEU 191          HD23      LEU 191  10.342   3.776  -4.401
 1354    H    LEU 192           H        LEU 192  16.663   3.544  -2.245
 1355    HA   LEU 192           HA       LEU 192  17.726   1.275  -3.802
 1356    HB2  LEU 192           HB2      LEU 192  19.557   3.062  -2.285
 1357    HB3  LEU 192           HB3      LEU 192  19.851   2.158  -3.755
 1358    HG   LEU 192           HG       LEU 192  18.118   4.617  -3.710
 1359   HD11  LEU 192          HD11      LEU 192  20.324   5.201  -2.848
 1360   HD12  LEU 192          HD12      LEU 192  21.076   4.448  -4.256
 1361   HD13  LEU 192          HD13      LEU 192  20.058   5.876  -4.456
 1362   HD21  LEU 192          HD21      LEU 192  19.617   3.207  -5.914
 1363   HD22  LEU 192          HD22      LEU 192  17.874   3.157  -5.647
 1364   HD23  LEU 192          HD23      LEU 192  18.655   4.675  -6.090
 1365    H    LEU 193           H        LEU 193  18.759  -0.361  -2.528
 1366    HA   LEU 193           HA       LEU 193  18.430   0.008   0.357
 1367    HB2  LEU 193           HB2      LEU 193  18.698  -2.383   0.603
 1368    HB3  LEU 193           HB3      LEU 193  17.425  -2.025  -0.544
 1369    HG   LEU 193           HG       LEU 193  19.436  -2.364  -2.269
 1370   HD11  LEU 193          HD11      LEU 193  20.777  -4.312  -1.534
 1371   HD12  LEU 193          HD12      LEU 193  21.141  -2.832  -0.639
 1372   HD13  LEU 193          HD13      LEU 193  20.142  -4.088   0.097
 1373   HD21  LEU 193          HD21      LEU 193  17.830  -4.553  -0.971
 1374   HD22  LEU 193          HD22      LEU 193  17.306  -3.527  -2.307
 1375   HD23  LEU 193          HD23      LEU 193  18.633  -4.667  -2.539
 1376    H    ARG 194           H        ARG 194  20.121  -0.312   1.759
 1377    HA   ARG 194           HA       ARG 194  22.818  -0.191   0.571
 1378    HB2  ARG 194           HB2      ARG 194  21.767   1.368   2.948
 1379    HB3  ARG 194           HB3      ARG 194  23.426   1.385   2.377
 1380    HG2  ARG 194           HG2      ARG 194  21.096   2.301   0.717
 1381    HG3  ARG 194           HG3      ARG 194  22.040   3.371   1.754
 1382    HD2  ARG 194           HD2      ARG 194  23.034   1.779  -0.605
 1383    HD3  ARG 194           HD3      ARG 194  22.855   3.535  -0.501
 1384    HE   ARG 194           HE       ARG 194  24.555   2.781   1.557
 1385   HH11  ARG 194          HH11      ARG 194  24.522   2.742  -1.943
 1386   HH12  ARG 194          HH12      ARG 194  26.259   2.773  -2.085
 1387   HH21  ARG 194          HH21      ARG 194  26.831   2.843   1.384
 1388   HH22  ARG 194          HH22      ARG 194  27.569   2.827  -0.191
 1389    H    ARG 195           H        ARG 195  24.209  -1.670   1.479
 1390    HA   ARG 195           HA       ARG 195  23.220  -3.410   3.509
 1391    HB2  ARG 195           HB2      ARG 195  24.982  -3.999   1.754
 1392    HB3  ARG 195           HB3      ARG 195  26.131  -3.148   2.782
 1393    HG2  ARG 195           HG2      ARG 195  25.697  -4.648   4.605
 1394    HG3  ARG 195           HG3      ARG 195  24.408  -5.438   3.697
 1395    HD2  ARG 195           HD2      ARG 195  26.236  -5.941   1.964
 1396    HD3  ARG 195           HD3      ARG 195  27.367  -5.549   3.259
 1397    HE   ARG 195           HE       ARG 195  25.572  -7.359   4.324
 1398   HH11  ARG 195          HH11      ARG 195  27.986  -7.253   1.807
 1399   HH12  ARG 195          HH12      ARG 195  28.228  -8.979   1.775
 1400   HH21  ARG 195          HH21      ARG 195  25.873  -9.648   4.291
 1401   HH22  ARG 195          HH22      ARG 195  27.043 -10.341   3.205
 1402    H    LYS 196           H        LYS 196  22.878  -2.726   5.488
 1403    HA   LYS 196           HA       LYS 196  24.403  -0.522   6.569
 1404    HB2  LYS 196           HB2      LYS 196  21.939  -0.679   6.859
 1405    HB3  LYS 196           HB3      LYS 196  22.174  -2.120   7.841
 1406    HG2  LYS 196           HG2      LYS 196  23.450  -0.805   9.460
 1407    HG3  LYS 196           HG3      LYS 196  23.200   0.638   8.477
 1408    HD2  LYS 196           HD2      LYS 196  20.746   0.321   8.754
 1409    HD3  LYS 196           HD3      LYS 196  21.090  -1.005   9.867
 1410    HE2  LYS 196           HE2      LYS 196  20.652   1.020  11.113
 1411    HE3  LYS 196           HE3      LYS 196  22.343   0.553  11.300
 1412    HZ1  LYS 196           HZ1      LYS 196  21.271   2.696   9.546
 1413    HZ2  LYS 196           HZ2      LYS 196  22.885   2.184   9.535
 1414    HZ3  LYS 196           HZ3      LYS 196  22.232   2.893  10.931
 1415    H    PHE 197           H        PHE 197  23.753  -3.909   7.427
 1416    HA   PHE 197           HA       PHE 197  25.869  -3.767   9.430
 1417    HB2  PHE 197           HB2      PHE 197  24.075  -6.111   8.793
 1418    HB3  PHE 197           HB3      PHE 197  25.128  -5.922  10.193
 1419    HD1  PHE 197           HD1      PHE 197  24.580  -3.331  11.240
 1420    HD2  PHE 197           HD2      PHE 197  21.892  -6.087   9.440
 1421    HE1  PHE 197           HE1      PHE 197  22.714  -2.311  12.478
 1422    HE2  PHE 197           HE2      PHE 197  20.015  -5.075  10.664
 1423    HZ   PHE 197           HZ       PHE 197  20.426  -3.183  12.192
 1424    H    PHE 198           H        PHE 198  27.724  -4.901   9.337
 1425    HA   PHE 198           HA       PHE 198  28.297  -6.216   6.760
 1426    HB2  PHE 198           HB2      PHE 198  30.187  -4.573   8.461
 1427    HB3  PHE 198           HB3      PHE 198  30.618  -5.418   6.978
 1428    HD1  PHE 198           HD1      PHE 198  29.264  -4.772   4.863
 1429    HD2  PHE 198           HD2      PHE 198  29.516  -2.369   8.366
 1430    HE1  PHE 198           HE1      PHE 198  28.622  -2.796   3.547
 1431    HE2  PHE 198           HE2      PHE 198  28.874  -0.389   7.056
 1432    HZ   PHE 198           HZ       PHE 198  28.428  -0.601   4.643
 1433    H    TYR 199           H        TYR 199  27.264  -7.785   8.576
 1434    HA   TYR 199           HA       TYR 199  28.936  -8.945  10.499
 1435    HB2  TYR 199           HB2      TYR 199  27.410 -10.876  10.385
 1436    HB3  TYR 199           HB3      TYR 199  26.519  -9.357  10.409
 1437    HD1  TYR 199           HD1      TYR 199  25.407  -8.540   8.367
 1438    HD2  TYR 199           HD2      TYR 199  27.343 -12.331   8.469
 1439    HE1  TYR 199           HE1      TYR 199  24.257  -9.182   6.292
 1440    HE2  TYR 199           HE2      TYR 199  26.198 -12.976   6.399
 1441    HH   TYR 199           HH       TYR 199  24.167 -12.362   5.147
 1442    H    SER 200           H        SER 200  29.030  -9.112   7.103
 1443    HA   SER 200           HA       SER 200  30.387 -10.102   5.615
 1444    HB2  SER 200           HB2      SER 200  31.974 -10.991   8.031
 1445    HB3  SER 200           HB3      SER 200  32.536 -11.001   6.359
 1446    HG   SER 200           HG       SER 200  31.975  -8.797   8.036
 1447    H    ASP 201           H        ASP 201  28.791 -11.511   4.912
 1448    HA   ASP 201           HA       ASP 201  28.411 -14.083   6.059
 1449    HB2  ASP 201           HB2      ASP 201  27.173 -14.588   3.999
 1450    HB3  ASP 201           HB3      ASP 201  26.683 -13.034   4.650
 1451    H    GLN 202           H        GLN 202  30.359 -12.704   3.518
 1452    HA   GLN 202           HA       GLN 202  32.175 -13.408   2.370
 1453    HB2  GLN 202           HB2      GLN 202  32.945 -13.148   4.755
 1454    HB3  GLN 202           HB3      GLN 202  32.801 -14.896   4.917
 1455    HG2  GLN 202           HG2      GLN 202  34.456 -15.228   3.183
 1456    HG3  GLN 202           HG3      GLN 202  34.567 -13.488   2.928
 1457   HE21  GLN 202          HE21      GLN 202  35.356 -16.136   5.019
 1458   HE22  GLN 202          HE22      GLN 202  36.511 -15.287   5.990
  Start of MODEL   12
    1    H1   GLY  -5           H1       GLY  -5 -36.051   0.906  -1.169
    2    H2   GLY  -5           H2       GLY  -5 -34.579   0.348  -0.531
    3    H3   GLY  -5           H3       GLY  -5 -36.028   0.020   0.279
    4    HA2  GLY  -5           HA2      GLY  -5 -36.780  -1.395  -1.494
    5    HA3  GLY  -5           HA3      GLY  -5 -35.337  -1.000  -2.420
    6    H    ILE  -4           H        ILE  -4 -34.253  -2.890  -2.509
    7    HA   ILE  -4           HA       ILE  -4 -33.980  -4.535  -0.136
    8    HB   ILE  -4           HB       ILE  -4 -32.521  -5.966  -1.594
    9   HG12  ILE  -4          HG12      ILE  -4 -33.455  -4.099  -3.789
   10   HG13  ILE  -4          HG13      ILE  -4 -31.815  -4.158  -3.157
   11   HG21  ILE  -4          HG21      ILE  -4 -34.873  -6.457  -1.282
   12   HG22  ILE  -4          HG22      ILE  -4 -35.297  -5.360  -2.597
   13   HG23  ILE  -4          HG23      ILE  -4 -34.385  -6.831  -2.935
   14   HD11  ILE  -4          HD11      ILE  -4 -31.601  -6.463  -3.932
   15   HD12  ILE  -4          HD12      ILE  -4 -33.246  -6.399  -4.566
   16   HD13  ILE  -4          HD13      ILE  -4 -31.995  -5.363  -5.252
   17    H    ASP  -3           H        ASP  -3 -33.061  -2.361   0.730
   18    HA   ASP  -3           HA       ASP  -3 -30.259  -1.924   0.115
   19    HB2  ASP  -3           HB2      ASP  -3 -31.961  -0.604   2.246
   20    HB3  ASP  -3           HB3      ASP  -3 -30.393  -0.055   1.666
   21    HA   PRO  -2           HA       PRO  -2 -28.855  -4.742   3.236
   22    HB2  PRO  -2           HB2      PRO  -2 -26.373  -3.155   3.197
   23    HB3  PRO  -2           HB3      PRO  -2 -26.620  -4.859   2.809
   24    HG2  PRO  -2           HG2      PRO  -2 -26.089  -3.044   0.905
   25    HG3  PRO  -2           HG3      PRO  -2 -27.174  -4.417   0.611
   26    HD2  PRO  -2           HD2      PRO  -2 -27.844  -1.555   1.187
   27    HD3  PRO  -2           HD3      PRO  -2 -28.596  -2.678   0.034
   28    H    PHE  -1           H        PHE  -1 -28.742  -4.741   5.426
   29    HA   PHE  -1           HA       PHE  -1 -28.957  -4.019   7.559
   30    HB2  PHE  -1           HB2      PHE  -1 -26.541  -3.375   6.739
   31    HB3  PHE  -1           HB3      PHE  -1 -27.144  -1.739   6.937
   32    HD1  PHE  -1           HD1      PHE  -1 -26.449  -4.902   8.679
   33    HD2  PHE  -1           HD2      PHE  -1 -27.379  -0.777   9.093
   34    HE1  PHE  -1           HE1      PHE  -1 -25.916  -5.028  11.075
   35    HE2  PHE  -1           HE2      PHE  -1 -26.847  -0.892  11.491
   36    HZ   PHE  -1           HZ       PHE  -1 -26.114  -3.022  12.486
   37    H    THR   0           H        THR   0 -31.188  -3.396   6.818
   38    HA   THR   0           HA       THR   0 -32.953  -1.978   6.617
   39    HB   THR   0           HB       THR   0 -33.105  -0.209   8.369
   40    HG1  THR   0           HG1      THR   0 -30.412  -0.680   8.479
   41   HG21  THR   0          HG21      THR   0 -33.119  -1.775  10.256
   42   HG22  THR   0          HG22      THR   0 -32.200  -2.934   9.296
   43   HG23  THR   0          HG23      THR   0 -33.838  -2.492   8.812
   44    H    MET   1           H        MET   1 -31.914   0.987   7.578
   45    HA   MET   1           HA       MET   1 -31.254   1.790   4.828
   46    HB2  MET   1           HB2      MET   1 -33.493   2.589   5.649
   47    HB3  MET   1           HB3      MET   1 -32.649   3.508   6.884
   48    HG2  MET   1           HG2      MET   1 -33.242   4.976   5.095
   49    HG3  MET   1           HG3      MET   1 -31.494   4.772   5.102
   50    HE1  MET   1           HE1      MET   1 -30.145   4.191   3.062
   51    HE2  MET   1           HE2      MET   1 -30.499   2.523   3.509
   52    HE3  MET   1           HE3      MET   1 -30.667   3.040   1.832
   53    H    VAL   2           H        VAL   2 -29.424   0.883   6.577
   54    HA   VAL   2           HA       VAL   2 -27.673   3.210   6.745
   55    HB   VAL   2           HB       VAL   2 -26.650   1.976   8.849
   56   HG11  VAL   2          HG11      VAL   2 -27.373   4.306   8.778
   57   HG12  VAL   2          HG12      VAL   2 -29.049   3.802   8.992
   58   HG13  VAL   2          HG13      VAL   2 -27.877   3.537  10.283
   59   HG21  VAL   2          HG21      VAL   2 -29.590   1.342   9.082
   60   HG22  VAL   2          HG22      VAL   2 -28.295   0.160   8.878
   61   HG23  VAL   2          HG23      VAL   2 -28.381   1.134  10.348
   62    H    ALA   3           H        ALA   3 -27.106   2.287   4.715
   63    HA   ALA   3           HA       ALA   3 -25.005   0.262   5.083
   64    HB1  ALA   3           HB1      ALA   3 -25.471  -0.709   2.940
   65    HB2  ALA   3           HB2      ALA   3 -26.946  -0.754   3.909
   66    HB3  ALA   3           HB3      ALA   3 -26.756   0.460   2.637
   67    H    LEU   4           H        LEU   4 -23.512   1.859   5.240
   68    HA   LEU   4           HA       LEU   4 -22.949   4.095   4.103
   69    HB2  LEU   4           HB2      LEU   4 -21.192   1.748   4.585
   70    HB3  LEU   4           HB3      LEU   4 -20.512   3.173   3.825
   71    HG   LEU   4           HG       LEU   4 -20.932   4.521   5.726
   72   HD11  LEU   4          HD11      LEU   4 -23.177   3.725   6.274
   73   HD12  LEU   4          HD12      LEU   4 -22.485   2.241   6.934
   74   HD13  LEU   4          HD13      LEU   4 -22.136   3.796   7.695
   75   HD21  LEU   4          HD21      LEU   4 -19.725   3.385   7.480
   76   HD22  LEU   4          HD22      LEU   4 -20.017   1.831   6.691
   77   HD23  LEU   4          HD23      LEU   4 -19.010   3.047   5.902
   78    H    SER   5           H        SER   5 -22.808   5.037   2.289
   79    HA   SER   5           HA       SER   5 -22.720   3.486  -0.187
   80    HB2  SER   5           HB2      SER   5 -23.579   5.519  -1.276
   81    HB3  SER   5           HB3      SER   5 -24.605   5.069   0.085
   82    HG   SER   5           HG       SER   5 -22.960   7.276  -0.259
   83    H    LEU   6           H        LEU   6 -20.680   3.154  -0.799
   84    HA   LEU   6           HA       LEU   6 -18.725   5.256  -0.160
   85    HB2  LEU   6           HB2      LEU   6 -18.159   2.315  -0.518
   86    HB3  LEU   6           HB3      LEU   6 -17.079   3.542   0.130
   87    HG   LEU   6           HG       LEU   6 -19.581   2.476   1.447
   88   HD11  LEU   6          HD11      LEU   6 -18.071   1.595   3.118
   89   HD12  LEU   6          HD12      LEU   6 -17.661   0.960   1.524
   90   HD13  LEU   6          HD13      LEU   6 -16.685   2.245   2.240
   91   HD21  LEU   6          HD21      LEU   6 -19.366   4.826   1.936
   92   HD22  LEU   6          HD22      LEU   6 -18.923   3.882   3.358
   93   HD23  LEU   6          HD23      LEU   6 -17.665   4.615   2.361
   94    H    LYS   7           H        LYS   7 -17.515   6.082  -1.722
   95    HA   LYS   7           HA       LYS   7 -17.910   5.168  -4.447
   96    HB2  LYS   7           HB2      LYS   7 -16.500   7.513  -3.206
   97    HB3  LYS   7           HB3      LYS   7 -16.235   7.096  -4.892
   98    HG2  LYS   7           HG2      LYS   7 -18.630   7.335  -5.323
   99    HG3  LYS   7           HG3      LYS   7 -18.882   7.775  -3.632
  100    HD2  LYS   7           HD2      LYS   7 -17.650   9.778  -3.872
  101    HD3  LYS   7           HD3      LYS   7 -17.000   9.277  -5.435
  102    HE2  LYS   7           HE2      LYS   7 -19.196   9.426  -6.434
  103    HE3  LYS   7           HE3      LYS   7 -19.911   9.825  -4.872
  104    HZ1  LYS   7           HZ1      LYS   7 -19.513  11.758  -6.361
  105    HZ2  LYS   7           HZ2      LYS   7 -17.845  11.488  -6.205
  106    HZ3  LYS   7           HZ3      LYS   7 -18.771  11.894  -4.840
  107    H    ILE   8           H        ILE   8 -16.810   3.379  -4.964
  108    HA   ILE   8           HA       ILE   8 -14.182   2.926  -3.815
  109    HB   ILE   8           HB       ILE   8 -16.073   1.210  -5.400
  110   HG12  ILE   8          HG12      ILE   8 -15.673  -0.364  -3.540
  111   HG13  ILE   8          HG13      ILE   8 -14.534   0.770  -2.828
  112   HG21  ILE   8          HG21      ILE   8 -13.156   0.599  -4.956
  113   HG22  ILE   8          HG22      ILE   8 -14.359  -0.527  -5.584
  114   HG23  ILE   8          HG23      ILE   8 -13.933   0.912  -6.508
  115   HD11  ILE   8          HD11      ILE   8 -17.460   1.307  -3.248
  116   HD12  ILE   8          HD12      ILE   8 -16.726   0.784  -1.732
  117   HD13  ILE   8          HD13      ILE   8 -16.304   2.349  -2.424
  118    H    SER   9           H        SER   9 -12.588   3.977  -4.733
  119    HA   SER   9           HA       SER   9 -12.579   4.375  -7.622
  120    HB2  SER   9           HB2      SER   9 -10.506   5.754  -7.084
  121    HB3  SER   9           HB3      SER   9 -12.023   6.352  -6.408
  122    HG   SER   9           HG       SER   9 -10.151   4.736  -5.010
  123    H    ILE  10           H        ILE  10 -11.528   3.005  -8.905
  124    HA   ILE  10           HA       ILE  10  -9.442   1.306  -7.694
  125    HB   ILE  10           HB       ILE  10 -11.179   0.652 -10.087
  126   HG12  ILE  10          HG12      ILE  10 -11.277  -0.479  -7.278
  127   HG13  ILE  10          HG13      ILE  10 -12.423   0.688  -7.930
  128   HG21  ILE  10          HG21      ILE  10 -10.221  -1.600  -9.868
  129   HG22  ILE  10          HG22      ILE  10  -8.982  -0.388 -10.198
  130   HG23  ILE  10          HG23      ILE  10  -9.183  -1.023  -8.565
  131   HD11  ILE  10          HD11      ILE  10 -13.319  -1.577  -7.948
  132   HD12  ILE  10          HD12      ILE  10 -13.152  -0.937  -9.585
  133   HD13  ILE  10          HD13      ILE  10 -11.979  -2.102  -8.969
  134    H    GLY  11           H        GLY  11  -7.623   2.441  -8.165
  135    HA2  GLY  11           HA2      GLY  11  -5.873   3.156  -9.498
  136    HA3  GLY  11           HA3      GLY  11  -6.784   2.633 -10.910
  137    H    ASN  12           H        ASN  12  -8.977   4.054 -10.961
  138    HA   ASN  12           HA       ASN  12  -8.580   6.846 -10.381
  139    HB2  ASN  12           HB2      ASN  12  -7.236   6.737 -12.388
  140    HB3  ASN  12           HB3      ASN  12  -8.496   5.844 -13.235
  141   HD21  ASN  12          HD21      ASN  12  -8.994   7.183 -14.822
  142   HD22  ASN  12          HD22      ASN  12  -9.596   8.792 -14.611
  143    H    VAL  13           H        VAL  13 -10.348   4.473 -12.333
  144    HA   VAL  13           HA       VAL  13 -12.744   5.887 -12.626
  145    HB   VAL  13           HB       VAL  13 -12.168   3.884 -13.928
  146   HG11  VAL  13          HG11      VAL  13 -12.437   1.652 -12.971
  147   HG12  VAL  13          HG12      VAL  13 -11.148   2.564 -12.182
  148   HG13  VAL  13          HG13      VAL  13 -12.708   2.372 -11.383
  149   HG21  VAL  13          HG21      VAL  13 -14.501   4.560 -13.853
  150   HG22  VAL  13          HG22      VAL  13 -14.369   2.803 -13.935
  151   HG23  VAL  13          HG23      VAL  13 -14.753   3.588 -12.403
  152    H    VAL  14           H        VAL  14 -14.840   5.443 -11.586
  153    HA   VAL  14           HA       VAL  14 -14.513   4.887  -8.722
  154    HB   VAL  14           HB       VAL  14 -14.645   7.312  -8.995
  155   HG11  VAL  14          HG11      VAL  14 -16.665   8.390  -9.854
  156   HG12  VAL  14          HG12      VAL  14 -15.858   7.431 -11.095
  157   HG13  VAL  14          HG13      VAL  14 -17.311   6.812 -10.309
  158   HG21  VAL  14          HG21      VAL  14 -16.583   7.743  -7.519
  159   HG22  VAL  14          HG22      VAL  14 -17.133   6.092  -7.807
  160   HG23  VAL  14          HG23      VAL  14 -15.598   6.379  -6.986
  161    H    LYS  15           H        LYS  15 -15.747   3.312  -8.076
  162    HA   LYS  15           HA       LYS  15 -18.282   2.795  -9.485
  163    HB2  LYS  15           HB2      LYS  15 -16.460   0.898  -7.988
  164    HB3  LYS  15           HB3      LYS  15 -18.033   0.457  -8.641
  165    HG2  LYS  15           HG2      LYS  15 -15.682   1.428 -10.257
  166    HG3  LYS  15           HG3      LYS  15 -16.188  -0.254 -10.089
  167    HD2  LYS  15           HD2      LYS  15 -18.353   0.308 -11.098
  168    HD3  LYS  15           HD3      LYS  15 -17.828   1.983 -11.277
  169    HE2  LYS  15           HE2      LYS  15 -15.999   1.236 -12.737
  170    HE3  LYS  15           HE3      LYS  15 -16.562  -0.427 -12.575
  171    HZ1  LYS  15           HZ1      LYS  15 -17.372   0.522 -14.617
  172    HZ2  LYS  15           HZ2      LYS  15 -18.069   1.828 -13.784
  173    HZ3  LYS  15           HZ3      LYS  15 -18.680   0.263 -13.564
  174    H    THR  16           H        THR  16 -20.137   2.730  -8.283
  175    HA   THR  16           HA       THR  16 -19.818   3.677  -5.528
  176    HB   THR  16           HB       THR  16 -22.320   3.691  -7.227
  177    HG1  THR  16           HG1      THR  16 -20.734   5.003  -8.188
  178   HG21  THR  16          HG21      THR  16 -23.090   5.378  -5.620
  179   HG22  THR  16          HG22      THR  16 -21.589   5.202  -4.712
  180   HG23  THR  16          HG23      THR  16 -22.722   3.854  -4.811
  181    H    MET  17           H        MET  17 -20.091   2.299  -3.915
  182    HA   MET  17           HA       MET  17 -21.842  -0.031  -4.292
  183    HB2  MET  17           HB2      MET  17 -18.978   0.029  -3.425
  184    HB3  MET  17           HB3      MET  17 -20.050  -1.178  -2.736
  185    HG2  MET  17           HG2      MET  17 -19.750  -0.816  -5.694
  186    HG3  MET  17           HG3      MET  17 -18.667  -1.841  -4.753
  187    HE1  MET  17           HE1      MET  17 -21.137  -4.538  -3.323
  188    HE2  MET  17           HE2      MET  17 -19.453  -4.029  -3.436
  189    HE3  MET  17           HE3      MET  17 -20.615  -3.043  -2.547
  190    H    GLN  18           H        GLN  18 -22.909  -0.707  -2.440
  191    HA   GLN  18           HA       GLN  18 -22.556   1.021  -0.087
  192    HB2  GLN  18           HB2      GLN  18 -24.970  -0.330  -1.244
  193    HB3  GLN  18           HB3      GLN  18 -24.914   0.074   0.469
  194    HG2  GLN  18           HG2      GLN  18 -24.873   2.337   0.078
  195    HG3  GLN  18           HG3      GLN  18 -24.275   2.147  -1.574
  196   HE21  GLN  18          HE21      GLN  18 -25.715   1.552  -3.212
  197   HE22  GLN  18          HE22      GLN  18 -27.429   1.759  -3.028
  198    H    PHE  19           H        PHE  19 -22.109   0.103   1.852
  199    HA   PHE  19           HA       PHE  19 -22.046  -2.823   1.985
  200    HB2  PHE  19           HB2      PHE  19 -19.856  -0.967   2.963
  201    HB3  PHE  19           HB3      PHE  19 -19.897  -2.711   3.182
  202    HD1  PHE  19           HD1      PHE  19 -19.705  -4.189   1.173
  203    HD2  PHE  19           HD2      PHE  19 -18.997  -0.002   1.011
  204    HE1  PHE  19           HE1      PHE  19 -18.509  -4.481  -0.954
  205    HE2  PHE  19           HE2      PHE  19 -17.802  -0.282  -1.121
  206    HZ   PHE  19           HZ       PHE  19 -17.471  -2.535  -2.056
  207    H    GLU  20           H        GLU  20 -22.451  -3.613   4.071
  208    HA   GLU  20           HA       GLU  20 -23.980  -1.892   5.744
  209    HB2  GLU  20           HB2      GLU  20 -22.873  -4.652   6.321
  210    HB3  GLU  20           HB3      GLU  20 -24.098  -3.815   7.267
  211    HG2  GLU  20           HG2      GLU  20 -25.675  -3.938   5.502
  212    HG3  GLU  20           HG3      GLU  20 -24.448  -4.485   4.361
  213    HA   PRO  21           HA       PRO  21 -20.890   0.172   8.084
  214    HB2  PRO  21           HB2      PRO  21 -22.372  -0.247  10.529
  215    HB3  PRO  21           HB3      PRO  21 -22.156   1.238   9.605
  216    HG2  PRO  21           HG2      PRO  21 -24.448  -0.532   9.701
  217    HG3  PRO  21           HG3      PRO  21 -24.320   1.068   8.941
  218    HD2  PRO  21           HD2      PRO  21 -24.547  -1.343   7.600
  219    HD3  PRO  21           HD3      PRO  21 -23.945   0.172   6.905
  220    H    SER  22           H        SER  22 -22.130  -2.958   9.149
  221    HA   SER  22           HA       SER  22 -19.664  -3.420  10.676
  222    HB2  SER  22           HB2      SER  22 -20.991  -5.380  11.610
  223    HB3  SER  22           HB3      SER  22 -21.586  -3.774  12.032
  224    HG   SER  22           HG       SER  22 -22.579  -5.406   9.911
  225    H    THR  23           H        THR  23 -20.292  -3.729   7.638
  226    HA   THR  23           HA       THR  23 -20.259  -6.436   6.948
  227    HB   THR  23           HB       THR  23 -19.493  -3.920   5.514
  228    HG1  THR  23           HG1      THR  23 -21.564  -5.817   5.481
  229   HG21  THR  23          HG21      THR  23 -19.136  -5.194   3.449
  230   HG22  THR  23          HG22      THR  23 -19.219  -6.696   4.368
  231   HG23  THR  23          HG23      THR  23 -17.905  -5.556   4.659
  232    H    MET  24           H        MET  24 -17.549  -4.221   7.483
  233    HA   MET  24           HA       MET  24 -15.335  -4.606   7.939
  234    HB2  MET  24           HB2      MET  24 -16.351  -7.273   8.253
  235    HB3  MET  24           HB3      MET  24 -14.853  -7.318   7.354
  236    HG2  MET  24           HG2      MET  24 -13.996  -7.461   9.405
  237    HG3  MET  24           HG3      MET  24 -14.080  -5.702   9.298
  238    HE1  MET  24           HE1      MET  24 -15.008  -6.677  13.052
  239    HE2  MET  24           HE2      MET  24 -13.887  -7.509  11.971
  240    HE3  MET  24           HE3      MET  24 -13.888  -5.746  12.057
  241    H    VAL  25           H        VAL  25 -13.516  -4.664   6.750
  242    HA   VAL  25           HA       VAL  25 -13.438  -4.445   4.043
  243    HB   VAL  25           HB       VAL  25 -11.278  -5.545   5.835
  244   HG11  VAL  25          HG11      VAL  25 -10.823  -6.204   3.531
  245   HG12  VAL  25          HG12      VAL  25 -11.049  -4.537   3.002
  246   HG13  VAL  25          HG13      VAL  25  -9.700  -4.951   4.061
  247   HG21  VAL  25          HG21      VAL  25 -10.409  -3.262   5.701
  248   HG22  VAL  25          HG22      VAL  25 -11.797  -2.798   4.716
  249   HG23  VAL  25          HG23      VAL  25 -12.031  -3.305   6.389
  250    H    TYR  26           H        TYR  26 -13.163  -7.503   5.880
  251    HA   TYR  26           HA       TYR  26 -12.358  -9.017   3.651
  252    HB2  TYR  26           HB2      TYR  26 -12.767 -11.027   4.947
  253    HB3  TYR  26           HB3      TYR  26 -11.924  -9.827   5.906
  254    HD1  TYR  26           HD1      TYR  26 -15.248 -11.396   5.353
  255    HD2  TYR  26           HD2      TYR  26 -12.794  -9.110   7.967
  256    HE1  TYR  26           HE1      TYR  26 -16.896 -11.695   7.152
  257    HE2  TYR  26           HE2      TYR  26 -14.434  -9.402   9.768
  258    HH   TYR  26           HH       TYR  26 -17.030 -11.626   9.571
  259    H    ASP  27           H        ASP  27 -15.526  -8.316   4.936
  260    HA   ASP  27           HA       ASP  27 -16.884 -10.093   3.119
  261    HB2  ASP  27           HB2      ASP  27 -17.841  -9.538   5.326
  262    HB3  ASP  27           HB3      ASP  27 -17.981  -7.856   4.841
  263    H    ALA  28           H        ALA  28 -16.245  -6.619   3.341
  264    HA   ALA  28           HA       ALA  28 -17.646  -5.747   1.115
  265    HB1  ALA  28           HB1      ALA  28 -16.140  -3.839   1.090
  266    HB2  ALA  28           HB2      ALA  28 -16.584  -4.254   2.745
  267    HB3  ALA  28           HB3      ALA  28 -14.999  -4.705   2.118
  268    H    CYS  29           H        CYS  29 -14.283  -6.858   1.304
  269    HA   CYS  29           HA       CYS  29 -13.579  -6.513  -1.357
  270    HB2  CYS  29           HB2      CYS  29 -12.031  -7.074   0.535
  271    HB3  CYS  29           HB3      CYS  29 -12.605  -8.737   0.443
  272    HG   CYS  29           HG       CYS  29  -9.994  -7.864  -0.876
  273    H    ARG  30           H        ARG  30 -15.352  -9.162   0.140
  274    HA   ARG  30           HA       ARG  30 -14.967 -10.875  -2.135
  275    HB2  ARG  30           HB2      ARG  30 -16.273 -12.509  -1.009
  276    HB3  ARG  30           HB3      ARG  30 -15.225 -11.752   0.176
  277    HG2  ARG  30           HG2      ARG  30 -17.189 -10.332   0.862
  278    HG3  ARG  30           HG3      ARG  30 -18.179 -11.356  -0.190
  279    HD2  ARG  30           HD2      ARG  30 -17.484 -13.336   1.060
  280    HD3  ARG  30           HD3      ARG  30 -16.483 -12.332   2.106
  281    HE   ARG  30           HE       ARG  30 -18.972 -11.251   2.342
  282   HH11  ARG  30          HH11      ARG  30 -17.589 -14.445   2.822
  283   HH12  ARG  30          HH12      ARG  30 -18.780 -14.918   4.003
  284   HH21  ARG  30          HH21      ARG  30 -20.517 -11.863   3.898
  285   HH22  ARG  30          HH22      ARG  30 -20.443 -13.443   4.626
  286    H    MET  31           H        MET  31 -17.463  -8.672  -1.061
  287    HA   MET  31           HA       MET  31 -19.328  -9.497  -3.081
  288    HB2  MET  31           HB2      MET  31 -19.303  -6.979  -1.412
  289    HB3  MET  31           HB3      MET  31 -20.658  -7.614  -2.334
  290    HG2  MET  31           HG2      MET  31 -20.773  -9.559  -0.931
  291    HG3  MET  31           HG3      MET  31 -19.340  -9.048  -0.052
  292    HE1  MET  31           HE1      MET  31 -20.469  -5.986   1.926
  293    HE2  MET  31           HE2      MET  31 -19.176  -7.128   1.533
  294    HE3  MET  31           HE3      MET  31 -19.728  -5.964   0.321
  295    H    ILE  32           H        ILE  32 -16.958  -6.889  -2.727
  296    HA   ILE  32           HA       ILE  32 -17.820  -5.435  -4.993
  297    HB   ILE  32           HB       ILE  32 -16.417  -4.400  -3.268
  298   HG12  ILE  32          HG12      ILE  32 -15.158  -4.414  -6.018
  299   HG13  ILE  32          HG13      ILE  32 -16.531  -3.430  -5.520
  300   HG21  ILE  32          HG21      ILE  32 -14.031  -4.805  -3.145
  301   HG22  ILE  32          HG22      ILE  32 -14.931  -6.283  -2.800
  302   HG23  ILE  32          HG23      ILE  32 -14.164  -6.065  -4.375
  303   HD11  ILE  32          HD11      ILE  32 -15.123  -2.263  -3.923
  304   HD12  ILE  32          HD12      ILE  32 -13.748  -3.258  -4.405
  305   HD13  ILE  32          HD13      ILE  32 -14.479  -2.146  -5.560
  306    H    ARG  33           H        ARG  33 -15.279  -7.886  -4.600
  307    HA   ARG  33           HA       ARG  33 -14.432  -7.964  -7.274
  308    HB2  ARG  33           HB2      ARG  33 -14.519 -10.201  -5.247
  309    HB3  ARG  33           HB3      ARG  33 -13.629 -10.254  -6.760
  310    HG2  ARG  33           HG2      ARG  33 -12.268  -8.355  -6.008
  311    HG3  ARG  33           HG3      ARG  33 -13.143  -8.354  -4.477
  312    HD2  ARG  33           HD2      ARG  33 -11.374 -10.534  -5.573
  313    HD3  ARG  33           HD3      ARG  33 -11.067  -9.516  -4.168
  314    HE   ARG  33           HE       ARG  33 -13.437 -11.220  -4.113
  315   HH11  ARG  33          HH11      ARG  33 -10.185 -10.602  -2.965
  316   HH12  ARG  33          HH12      ARG  33 -10.269 -11.797  -1.710
  317   HH21  ARG  33          HH21      ARG  33 -13.560 -12.764  -2.496
  318   HH22  ARG  33          HH22      ARG  33 -12.215 -13.023  -1.423
  319    H    GLU  34           H        GLU  34 -17.259  -9.149  -5.760
  320    HA   GLU  34           HA       GLU  34 -17.872 -11.230  -7.636
  321    HB2  GLU  34           HB2      GLU  34 -18.737 -11.262  -5.328
  322    HB3  GLU  34           HB3      GLU  34 -19.669  -9.803  -5.656
  323    HG2  GLU  34           HG2      GLU  34 -21.015 -11.866  -5.705
  324    HG3  GLU  34           HG3      GLU  34 -21.054 -10.964  -7.219
  325    H    ARG  35           H        ARG  35 -19.438  -8.108  -6.976
  326    HA   ARG  35           HA       ARG  35 -20.867  -8.283  -9.474
  327    HB2  ARG  35           HB2      ARG  35 -21.860  -6.083  -8.704
  328    HB3  ARG  35           HB3      ARG  35 -22.178  -7.498  -7.710
  329    HG2  ARG  35           HG2      ARG  35 -20.057  -6.643  -6.409
  330    HG3  ARG  35           HG3      ARG  35 -20.527  -5.102  -7.132
  331    HD2  ARG  35           HD2      ARG  35 -22.295  -6.897  -5.479
  332    HD3  ARG  35           HD3      ARG  35 -21.534  -5.407  -4.922
  333    HE   ARG  35           HE       ARG  35 -23.128  -4.963  -7.249
  334   HH11  ARG  35          HH11      ARG  35 -23.341  -5.412  -3.775
  335   HH12  ARG  35          HH12      ARG  35 -24.816  -4.501  -3.637
  336   HH21  ARG  35          HH21      ARG  35 -25.053  -3.792  -7.063
  337   HH22  ARG  35          HH22      ARG  35 -25.794  -3.590  -5.505
  338    H    ILE  36           H        ILE  36 -18.091  -6.509  -8.279
  339    HA   ILE  36           HA       ILE  36 -18.096  -4.903 -10.739
  340    HB   ILE  36           HB       ILE  36 -16.397  -4.553  -8.262
  341   HG12  ILE  36          HG12      ILE  36 -18.778  -2.969  -9.258
  342   HG13  ILE  36          HG13      ILE  36 -18.771  -4.045  -7.864
  343   HG21  ILE  36          HG21      ILE  36 -16.685  -2.817 -10.714
  344   HG22  ILE  36          HG22      ILE  36 -15.768  -2.400  -9.266
  345   HG23  ILE  36          HG23      ILE  36 -15.266  -3.764 -10.267
  346   HD11  ILE  36          HD11      ILE  36 -17.156  -2.589  -6.754
  347   HD12  ILE  36          HD12      ILE  36 -17.169  -1.513  -8.151
  348   HD13  ILE  36          HD13      ILE  36 -18.629  -1.721  -7.185
  349    HA   PRO  37           HA       PRO  37 -15.007  -7.939 -12.036
  350    HB2  PRO  37           HB2      PRO  37 -15.318  -6.697 -14.658
  351    HB3  PRO  37           HB3      PRO  37 -15.685  -8.349 -14.160
  352    HG2  PRO  37           HG2      PRO  37 -17.609  -6.555 -14.793
  353    HG3  PRO  37           HG3      PRO  37 -17.852  -7.836 -13.591
  354    HD2  PRO  37           HD2      PRO  37 -17.233  -4.933 -13.171
  355    HD3  PRO  37           HD3      PRO  37 -18.368  -5.982 -12.292
  356    H    GLU  38           H        GLU  38 -15.010  -4.534 -12.086
  357    HA   GLU  38           HA       GLU  38 -12.398  -4.208 -13.265
  358    HB2  GLU  38           HB2      GLU  38 -13.955  -2.188 -11.647
  359    HB3  GLU  38           HB3      GLU  38 -12.669  -1.871 -12.801
  360    HG2  GLU  38           HG2      GLU  38 -15.424  -2.906 -13.425
  361    HG3  GLU  38           HG3      GLU  38 -14.808  -1.287 -13.745
  362    H    ALA  39           H        ALA  39 -13.556  -5.197 -10.286
  363    HA   ALA  39           HA       ALA  39 -11.792  -3.846  -8.526
  364    HB1  ALA  39           HB1      ALA  39 -13.907  -4.826  -7.785
  365    HB2  ALA  39           HB2      ALA  39 -13.273  -6.440  -8.110
  366    HB3  ALA  39           HB3      ALA  39 -12.544  -5.442  -6.852
  367    H    LEU  40           H        LEU  40 -11.729  -7.155  -9.861
  368    HA   LEU  40           HA       LEU  40  -9.195  -7.624  -8.566
  369    HB2  LEU  40           HB2      LEU  40  -9.412  -9.896  -9.819
  370    HB3  LEU  40           HB3      LEU  40 -10.371  -9.561  -8.399
  371    HG   LEU  40           HG       LEU  40 -11.541 -10.745 -10.306
  372   HD11  LEU  40          HD11      LEU  40 -12.734  -8.149  -9.353
  373   HD12  LEU  40          HD12      LEU  40 -13.623  -9.510 -10.037
  374   HD13  LEU  40          HD13      LEU  40 -12.776  -9.692  -8.502
  375   HD21  LEU  40          HD21      LEU  40 -10.679  -9.535 -12.182
  376   HD22  LEU  40          HD22      LEU  40 -12.424  -9.286 -12.101
  377   HD23  LEU  40          HD23      LEU  40 -11.324  -8.017 -11.553
  378    H    ALA  41           H        ALA  41  -8.413  -5.725  -9.953
  379    HA   ALA  41           HA       ALA  41  -7.735  -6.158 -12.661
  380    HB1  ALA  41           HB1      ALA  41  -6.409  -4.361 -10.635
  381    HB2  ALA  41           HB2      ALA  41  -6.215  -4.265 -12.385
  382    HB3  ALA  41           HB3      ALA  41  -7.785  -3.935 -11.652
  383    H    GLY  42           H        GLY  42  -6.458  -7.367  -9.758
  384    HA2  GLY  42           HA2      GLY  42  -4.518  -8.938 -11.248
  385    HA3  GLY  42           HA3      GLY  42  -3.879  -7.945  -9.940
  386    HA   PRO  43           HA       PRO  43  -4.980 -12.067  -8.024
  387    HB2  PRO  43           HB2      PRO  43  -2.871 -11.049  -6.199
  388    HB3  PRO  43           HB3      PRO  43  -3.085 -12.664  -6.882
  389    HG2  PRO  43           HG2      PRO  43  -1.181 -11.030  -7.796
  390    HG3  PRO  43           HG3      PRO  43  -2.081 -12.098  -8.888
  391    HD2  PRO  43           HD2      PRO  43  -2.360  -9.157  -8.454
  392    HD3  PRO  43           HD3      PRO  43  -2.514 -10.097  -9.952
  393    HA   PRO  44           HA       PRO  44  -7.764  -9.557  -5.524
  394    HB2  PRO  44           HB2      PRO  44  -9.095 -11.736  -4.465
  395    HB3  PRO  44           HB3      PRO  44  -9.483 -10.967  -6.006
  396    HG2  PRO  44           HG2      PRO  44  -7.858 -13.418  -5.466
  397    HG3  PRO  44           HG3      PRO  44  -9.041 -13.117  -6.754
  398    HD2  PRO  44           HD2      PRO  44  -6.412 -13.002  -7.231
  399    HD3  PRO  44           HD3      PRO  44  -7.537 -11.870  -8.011
  400    H    ASN  45           H        ASN  45  -5.569 -11.979  -4.466
  401    HA   ASN  45           HA       ASN  45  -5.998 -11.767  -1.660
  402    HB2  ASN  45           HB2      ASN  45  -3.608 -12.695  -3.267
  403    HB3  ASN  45           HB3      ASN  45  -3.719 -12.818  -1.514
  404   HD21  ASN  45          HD21      ASN  45  -3.536 -14.839  -3.708
  405   HD22  ASN  45          HD22      ASN  45  -4.858 -15.923  -3.404
  406    H    ASP  46           H        ASP  46  -4.081 -10.052  -4.013
  407    HA   ASP  46           HA       ASP  46  -2.646  -8.551  -1.966
  408    HB2  ASP  46           HB2      ASP  46  -2.476  -8.539  -4.987
  409    HB3  ASP  46           HB3      ASP  46  -1.536  -7.470  -3.953
  410    H    PHE  47           H        PHE  47  -5.653  -8.329  -2.835
  411    HA   PHE  47           HA       PHE  47  -5.603  -5.428  -3.313
  412    HB2  PHE  47           HB2      PHE  47  -7.477  -7.561  -4.255
  413    HB3  PHE  47           HB3      PHE  47  -8.074  -5.917  -4.057
  414    HD1  PHE  47           HD1      PHE  47  -4.914  -7.398  -5.395
  415    HD2  PHE  47           HD2      PHE  47  -8.237  -4.829  -6.071
  416    HE1  PHE  47           HE1      PHE  47  -3.982  -6.774  -7.580
  417    HE2  PHE  47           HE2      PHE  47  -7.302  -4.193  -8.253
  418    HZ   PHE  47           HZ       PHE  47  -5.175  -5.166  -9.012
  419    H    GLY  48           H        GLY  48  -6.324  -4.141  -1.820
  420    HA2  GLY  48           HA2      GLY  48  -8.248  -5.140   0.174
  421    HA3  GLY  48           HA3      GLY  48  -6.749  -4.405   0.718
  422    H    LEU  49           H        LEU  49  -8.509  -3.067   1.818
  423    HA   LEU  49           HA       LEU  49  -9.634  -1.062   0.003
  424    HB2  LEU  49           HB2      LEU  49 -10.368  -1.713   2.856
  425    HB3  LEU  49           HB3      LEU  49 -11.166  -0.523   1.845
  426    HG   LEU  49           HG       LEU  49 -11.121  -3.505   1.368
  427   HD11  LEU  49          HD11      LEU  49 -13.342  -1.663   2.236
  428   HD12  LEU  49          HD12      LEU  49 -13.514  -3.377   1.856
  429   HD13  LEU  49          HD13      LEU  49 -12.538  -2.873   3.235
  430   HD21  LEU  49          HD21      LEU  49 -12.537  -1.322  -0.157
  431   HD22  LEU  49          HD22      LEU  49 -11.142  -2.238  -0.726
  432   HD23  LEU  49          HD23      LEU  49 -12.679  -3.057  -0.449
  433    H    PHE  50           H        PHE  50  -8.510   0.670  -0.193
  434    HA   PHE  50           HA       PHE  50  -7.135   1.854   2.124
  435    HB2  PHE  50           HB2      PHE  50  -5.721   1.622   0.167
  436    HB3  PHE  50           HB3      PHE  50  -6.909   2.442  -0.837
  437    HD1  PHE  50           HD1      PHE  50  -4.522   2.948   1.969
  438    HD2  PHE  50           HD2      PHE  50  -6.916   4.768  -1.050
  439    HE1  PHE  50           HE1      PHE  50  -3.421   5.099   2.393
  440    HE2  PHE  50           HE2      PHE  50  -5.814   6.923  -0.623
  441    HZ   PHE  50           HZ       PHE  50  -4.066   7.092   1.099
  442    H    LEU  51           H        LEU  51  -7.954   3.601   3.105
  443    HA   LEU  51           HA       LEU  51 -10.454   4.652   2.018
  444    HB2  LEU  51           HB2      LEU  51 -10.107   3.820   4.446
  445    HB3  LEU  51           HB3      LEU  51  -9.300   5.352   4.702
  446    HG   LEU  51           HG       LEU  51 -11.724   5.243   5.405
  447   HD11  LEU  51          HD11      LEU  51 -12.292   7.457   4.544
  448   HD12  LEU  51          HD12      LEU  51 -10.614   7.381   5.086
  449   HD13  LEU  51          HD13      LEU  51 -10.987   7.331   3.362
  450   HD21  LEU  51          HD21      LEU  51 -12.564   3.941   3.531
  451   HD22  LEU  51          HD22      LEU  51 -13.410   5.484   3.656
  452   HD23  LEU  51          HD23      LEU  51 -12.168   5.256   2.426
  453    H    SER  52           H        SER  52 -10.350   6.356   0.785
  454    HA   SER  52           HA       SER  52  -8.117   8.178   0.862
  455    HB2  SER  52           HB2      SER  52 -10.672   8.384  -0.754
  456    HB3  SER  52           HB3      SER  52  -9.143   9.205  -1.071
  457    HG   SER  52           HG       SER  52  -8.234   7.315  -1.706
  458    H    ASP  53           H        ASP  53  -8.199   9.251   2.796
  459    HA   ASP  53           HA       ASP  53 -10.631  10.316   3.871
  460    HB2  ASP  53           HB2      ASP  53  -8.756   9.597   5.322
  461    HB3  ASP  53           HB3      ASP  53  -7.765  10.889   4.656
  462    H    ASP  54           H        ASP  54  -7.733  11.698   2.376
  463    HA   ASP  54           HA       ASP  54  -9.016  13.891   1.187
  464    HB2  ASP  54           HB2      ASP  54  -9.447  14.683   3.447
  465    HB3  ASP  54           HB3      ASP  54  -7.751  14.490   3.872
  466    H    ASP  55           H        ASP  55  -6.120  12.681   2.738
  467    HA   ASP  55           HA       ASP  55  -4.468  13.691   0.548
  468    HB2  ASP  55           HB2      ASP  55  -4.460  15.454   2.275
  469    HB3  ASP  55           HB3      ASP  55  -3.938  14.283   3.473
  470    HA   PRO  56           HA       PRO  56  -2.366   9.755   0.844
  471    HB2  PRO  56           HB2      PRO  56   0.249  10.878   0.864
  472    HB3  PRO  56           HB3      PRO  56  -0.620  10.188  -0.508
  473    HG2  PRO  56           HG2      PRO  56  -0.305  13.020   0.298
  474    HG3  PRO  56           HG3      PRO  56  -0.545  12.325  -1.314
  475    HD2  PRO  56           HD2      PRO  56  -2.508  13.641  -0.053
  476    HD3  PRO  56           HD3      PRO  56  -2.849  12.217  -1.061
  477    H    LYS  57           H        LYS  57  -1.262  12.420   2.942
  478    HA   LYS  57           HA       LYS  57   0.084  10.718   4.803
  479    HB2  LYS  57           HB2      LYS  57  -1.030  13.484   5.313
  480    HB3  LYS  57           HB3      LYS  57   0.218  12.662   6.239
  481    HG2  LYS  57           HG2      LYS  57   0.466  13.558   3.374
  482    HG3  LYS  57           HG3      LYS  57   1.142  14.385   4.778
  483    HD2  LYS  57           HD2      LYS  57   1.828  11.576   3.919
  484    HD3  LYS  57           HD3      LYS  57   2.803  13.008   3.579
  485    HE2  LYS  57           HE2      LYS  57   2.084  12.006   6.330
  486    HE3  LYS  57           HE3      LYS  57   3.622  11.723   5.518
  487    HZ1  LYS  57           HZ1      LYS  57   2.515  14.359   6.325
  488    HZ2  LYS  57           HZ2      LYS  57   3.958  14.136   5.456
  489    HZ3  LYS  57           HZ3      LYS  57   3.820  13.549   7.035
  490    H    LYS  58           H        LYS  58  -3.181  11.792   4.399
  491    HA   LYS  58           HA       LYS  58  -4.003  10.893   7.052
  492    HB2  LYS  58           HB2      LYS  58  -5.598  12.163   4.812
  493    HB3  LYS  58           HB3      LYS  58  -6.168  11.879   6.452
  494    HG2  LYS  58           HG2      LYS  58  -4.870  13.561   7.341
  495    HG3  LYS  58           HG3      LYS  58  -3.726  13.531   6.000
  496    HD2  LYS  58           HD2      LYS  58  -5.547  14.437   4.539
  497    HD3  LYS  58           HD3      LYS  58  -6.534  14.632   5.990
  498    HE2  LYS  58           HE2      LYS  58  -4.954  16.169   6.932
  499    HE3  LYS  58           HE3      LYS  58  -3.804  15.861   5.632
  500    HZ1  LYS  58           HZ1      LYS  58  -4.706  17.690   4.745
  501    HZ2  LYS  58           HZ2      LYS  58  -6.107  17.600   5.687
  502    HZ3  LYS  58           HZ3      LYS  58  -5.981  16.671   4.272
  503    H    GLY  59           H        GLY  59  -3.577   9.676   3.991
  504    HA2  GLY  59           HA2      GLY  59  -5.806   7.976   3.670
  505    HA3  GLY  59           HA3      GLY  59  -4.234   7.761   2.915
  506    H    ILE  60           H        ILE  60  -6.230   5.930   4.316
  507    HA   ILE  60           HA       ILE  60  -4.313   4.700   6.169
  508    HB   ILE  60           HB       ILE  60  -6.279   3.999   7.591
  509   HG12  ILE  60          HG12      ILE  60  -7.670   6.236   6.100
  510   HG13  ILE  60          HG13      ILE  60  -8.021   4.523   5.895
  511   HG21  ILE  60          HG21      ILE  60  -4.731   5.710   8.326
  512   HG22  ILE  60          HG22      ILE  60  -5.630   6.939   7.435
  513   HG23  ILE  60          HG23      ILE  60  -6.373   6.129   8.814
  514   HD11  ILE  60          HD11      ILE  60  -9.650   5.615   7.328
  515   HD12  ILE  60          HD12      ILE  60  -8.741   4.388   8.212
  516   HD13  ILE  60          HD13      ILE  60  -8.363   6.096   8.435
  517    H    TRP  61           H        TRP  61  -4.259   2.493   6.161
  518    HA   TRP  61           HA       TRP  61  -5.730   1.175   4.029
  519    HB2  TRP  61           HB2      TRP  61  -3.404   0.348   5.751
  520    HB3  TRP  61           HB3      TRP  61  -4.282  -0.820   4.768
  521    HD1  TRP  61           HD1      TRP  61  -1.748   1.983   4.517
  522    HE1  TRP  61           HE1      TRP  61  -0.857   2.111   2.100
  523    HE3  TRP  61           HE3      TRP  61  -5.028  -1.247   2.296
  524    HZ2  TRP  61           HZ2      TRP  61  -1.483   0.984  -0.411
  525    HZ3  TRP  61           HZ3      TRP  61  -4.813  -1.664  -0.118
  526    HH2  TRP  61           HH2      TRP  61  -3.079  -0.572  -1.439
  527    H    LEU  62           H        LEU  62  -7.504   0.104   4.366
  528    HA   LEU  62           HA       LEU  62  -8.488  -0.256   7.061
  529    HB2  LEU  62           HB2      LEU  62  -9.760  -0.972   4.416
  530    HB3  LEU  62           HB3      LEU  62 -10.567  -0.917   5.970
  531    HG   LEU  62           HG       LEU  62  -9.373   1.482   4.581
  532   HD11  LEU  62          HD11      LEU  62 -11.286   0.587   3.354
  533   HD12  LEU  62          HD12      LEU  62 -12.246   0.618   4.833
  534   HD13  LEU  62          HD13      LEU  62 -11.672   2.127   4.123
  535   HD21  LEU  62          HD21      LEU  62  -9.440   1.679   7.006
  536   HD22  LEU  62          HD22      LEU  62 -10.621   2.747   6.246
  537   HD23  LEU  62          HD23      LEU  62 -11.149   1.238   6.996
  538    H    GLU  63           H        GLU  63  -7.812  -2.013   8.152
  539    HA   GLU  63           HA       GLU  63  -7.191  -4.463   6.749
  540    HB2  GLU  63           HB2      GLU  63  -6.501  -5.329   8.883
  541    HB3  GLU  63           HB3      GLU  63  -5.876  -3.695   8.723
  542    HG2  GLU  63           HG2      GLU  63  -7.563  -2.843  10.195
  543    HG3  GLU  63           HG3      GLU  63  -8.369  -4.411  10.246
  544    H    ALA  64           H        ALA  64  -8.161  -6.534   7.401
  545    HA   ALA  64           HA       ALA  64 -11.022  -6.331   7.273
  546    HB1  ALA  64           HB1      ALA  64  -9.811  -8.027   5.997
  547    HB2  ALA  64           HB2      ALA  64  -9.264  -8.769   7.501
  548    HB3  ALA  64           HB3      ALA  64 -10.980  -8.762   7.093
  549    H    GLY  65           H        GLY  65  -8.831  -6.341   9.796
  550    HA2  GLY  65           HA2      GLY  65 -10.280  -7.913  11.688
  551    HA3  GLY  65           HA3      GLY  65  -8.966  -6.804  12.048
  552    H    LYS  66           H        LYS  66 -10.701  -4.707  10.533
  553    HA   LYS  66           HA       LYS  66 -12.671  -4.313  12.678
  554    HB2  LYS  66           HB2      LYS  66 -12.035  -2.171  13.109
  555    HB3  LYS  66           HB3      LYS  66 -10.481  -2.766  12.550
  556    HG2  LYS  66           HG2      LYS  66 -12.456  -1.417  10.732
  557    HG3  LYS  66           HG3      LYS  66 -11.233  -0.537  11.646
  558    HD2  LYS  66           HD2      LYS  66  -9.490  -1.425  10.413
  559    HD3  LYS  66           HD3      LYS  66 -10.434  -2.828   9.902
  560    HE2  LYS  66           HE2      LYS  66 -11.045  -0.008   9.017
  561    HE3  LYS  66           HE3      LYS  66  -9.999  -1.102   8.112
  562    HZ1  LYS  66           HZ1      LYS  66 -12.171  -1.236   7.218
  563    HZ2  LYS  66           HZ2      LYS  66 -12.866  -1.460   8.746
  564    HZ3  LYS  66           HZ3      LYS  66 -11.896  -2.675   8.071
  565    H    ALA  67           H        ALA  67 -14.487  -2.906  12.052
  566    HA   ALA  67           HA       ALA  67 -15.351  -3.569   9.368
  567    HB1  ALA  67           HB1      ALA  67 -17.510  -2.701  10.063
  568    HB2  ALA  67           HB2      ALA  67 -16.876  -3.808  11.280
  569    HB3  ALA  67           HB3      ALA  67 -16.800  -2.066  11.548
  570    H    LEU  68           H        LEU  68 -16.869  -1.524   8.532
  571    HA   LEU  68           HA       LEU  68 -14.818   0.354   7.702
  572    HB2  LEU  68           HB2      LEU  68 -17.706   0.127   6.879
  573    HB3  LEU  68           HB3      LEU  68 -16.492   1.137   6.133
  574    HG   LEU  68           HG       LEU  68 -16.438  -1.876   6.191
  575   HD11  LEU  68          HD11      LEU  68 -18.226  -1.043   4.772
  576   HD12  LEU  68          HD12      LEU  68 -17.091   0.027   3.948
  577   HD13  LEU  68          HD13      LEU  68 -16.920  -1.721   3.799
  578   HD21  LEU  68          HD21      LEU  68 -14.213  -0.888   6.152
  579   HD22  LEU  68          HD22      LEU  68 -14.594  -1.645   4.606
  580   HD23  LEU  68          HD23      LEU  68 -14.670   0.109   4.772
  581    H    ASP  69           H        ASP  69 -18.014   0.467   9.167
  582    HA   ASP  69           HA       ASP  69 -18.038   3.280   9.600
  583    HB2  ASP  69           HB2      ASP  69 -20.124   2.096   9.336
  584    HB3  ASP  69           HB3      ASP  69 -19.753   1.038  10.690
  585    H    TYR  70           H        TYR  70 -16.571   0.705  11.205
  586    HA   TYR  70           HA       TYR  70 -16.360   1.555  13.823
  587    HB2  TYR  70           HB2      TYR  70 -15.478  -0.579  13.041
  588    HB3  TYR  70           HB3      TYR  70 -14.303   0.251  12.027
  589    HD1  TYR  70           HD1      TYR  70 -15.317  -0.259  15.548
  590    HD2  TYR  70           HD2      TYR  70 -12.213   0.815  12.861
  591    HE1  TYR  70           HE1      TYR  70 -13.711  -0.303  17.405
  592    HE2  TYR  70           HE2      TYR  70 -10.587   0.776  14.704
  593    HH   TYR  70           HH       TYR  70 -10.578   0.997  17.166
  594    H    TYR  71           H        TYR  71 -14.593   2.539  10.936
  595    HA   TYR  71           HA       TYR  71 -13.187   4.661  12.285
  596    HB2  TYR  71           HB2      TYR  71 -13.440   3.756   9.432
  597    HB3  TYR  71           HB3      TYR  71 -12.756   5.337   9.795
  598    HD1  TYR  71           HD1      TYR  71 -12.308   1.705  10.209
  599    HD2  TYR  71           HD2      TYR  71 -10.548   5.543  10.724
  600    HE1  TYR  71           HE1      TYR  71 -10.128   0.644  10.620
  601    HE2  TYR  71           HE2      TYR  71  -8.366   4.489  11.132
  602    HH   TYR  71           HH       TYR  71  -7.712   1.257  10.455
  603    H    MET  72           H        MET  72 -13.741   6.505   9.945
  604    HA   MET  72           HA       MET  72 -16.259   7.573  11.038
  605    HB2  MET  72           HB2      MET  72 -13.928   8.963   9.712
  606    HB3  MET  72           HB3      MET  72 -15.420   9.767  10.184
  607    HG2  MET  72           HG2      MET  72 -15.005   9.279  12.504
  608    HG3  MET  72           HG3      MET  72 -13.577   8.337  12.082
  609    HE1  MET  72           HE1      MET  72 -13.871  12.897  11.422
  610    HE2  MET  72           HE2      MET  72 -14.705  11.712  10.417
  611    HE3  MET  72           HE3      MET  72 -15.183  11.933  12.099
  612    H    LEU  73           H        LEU  73 -16.220   5.573   8.934
  613    HA   LEU  73           HA       LEU  73 -16.815   7.124   6.518
  614    HB2  LEU  73           HB2      LEU  73 -17.189   4.225   6.371
  615    HB3  LEU  73           HB3      LEU  73 -16.381   5.311   5.267
  616    HG   LEU  73           HG       LEU  73 -15.192   4.099   7.760
  617   HD11  LEU  73          HD11      LEU  73 -13.763   2.939   6.127
  618   HD12  LEU  73          HD12      LEU  73 -15.470   2.523   5.956
  619   HD13  LEU  73          HD13      LEU  73 -14.721   3.647   4.824
  620   HD21  LEU  73          HD21      LEU  73 -14.293   6.328   7.387
  621   HD22  LEU  73          HD22      LEU  73 -13.093   5.094   7.001
  622   HD23  LEU  73          HD23      LEU  73 -13.953   5.922   5.703
  623    H    ARG  74           H        ARG  74 -18.715   7.192   5.565
  624    HA   ARG  74           HA       ARG  74 -20.948   5.576   6.449
  625    HB2  ARG  74           HB2      ARG  74 -21.112   8.590   6.714
  626    HB3  ARG  74           HB3      ARG  74 -22.413   7.444   6.986
  627    HG2  ARG  74           HG2      ARG  74 -21.578   6.772   9.001
  628    HG3  ARG  74           HG3      ARG  74 -19.922   7.234   8.593
  629    HD2  ARG  74           HD2      ARG  74 -22.199   9.134   9.079
  630    HD3  ARG  74           HD3      ARG  74 -20.939   8.740  10.234
  631    HE   ARG  74           HE       ARG  74 -19.913   9.706   7.736
  632   HH11  ARG  74          HH11      ARG  74 -21.204  10.721  10.839
  633   HH12  ARG  74          HH12      ARG  74 -20.336  12.231  10.830
  634   HH21  ARG  74          HH21      ARG  74 -18.791  11.658   7.730
  635   HH22  ARG  74          HH22      ARG  74 -18.954  12.761   9.065
  636    H    ASN  75           H        ASN  75 -22.768   7.686   5.261
  637    HA   ASN  75           HA       ASN  75 -22.525   6.744   2.546
  638    HB2  ASN  75           HB2      ASN  75 -24.537   8.504   3.945
  639    HB3  ASN  75           HB3      ASN  75 -24.587   8.226   2.210
  640   HD21  ASN  75          HD21      ASN  75 -23.619   5.794   4.531
  641   HD22  ASN  75          HD22      ASN  75 -24.993   4.768   4.312
  642    H    GLY  76           H        GLY  76 -20.912   7.658   1.408
  643    HA2  GLY  76           HA2      GLY  76 -20.730   9.601  -0.130
  644    HA3  GLY  76           HA3      GLY  76 -20.917  10.613   1.290
  645    H    ASP  77           H        ASP  77 -18.986   7.866   1.890
  646    HA   ASP  77           HA       ASP  77 -16.589   9.544   1.719
  647    HB2  ASP  77           HB2      ASP  77 -17.138   6.966   3.189
  648    HB3  ASP  77           HB3      ASP  77 -15.524   7.656   3.046
  649    H    THR  78           H        THR  78 -14.875   9.075   0.432
  650    HA   THR  78           HA       THR  78 -15.284   7.068  -1.619
  651    HB   THR  78           HB       THR  78 -12.980   9.000  -1.252
  652    HG1  THR  78           HG1      THR  78 -15.231   9.866  -1.596
  653   HG21  THR  78          HG21      THR  78 -13.891   7.440  -3.676
  654   HG22  THR  78          HG22      THR  78 -12.449   7.101  -2.716
  655   HG23  THR  78          HG23      THR  78 -12.565   8.604  -3.633
  656    H    MET  79           H        MET  79 -14.317   5.135  -1.694
  657    HA   MET  79           HA       MET  79 -12.087   4.609   0.143
  658    HB2  MET  79           HB2      MET  79 -14.284   3.726   1.033
  659    HB3  MET  79           HB3      MET  79 -14.337   2.658  -0.362
  660    HG2  MET  79           HG2      MET  79 -12.210   1.658   0.340
  661    HG3  MET  79           HG3      MET  79 -12.206   2.700   1.761
  662    HE1  MET  79           HE1      MET  79 -15.161  -0.735   0.972
  663    HE2  MET  79           HE2      MET  79 -15.160   0.738   0.000
  664    HE3  MET  79           HE3      MET  79 -13.764  -0.345  -0.039
  665    H    GLU  80           H        GLU  80 -10.428   4.103  -1.051
  666    HA   GLU  80           HA       GLU  80 -10.708   3.297  -3.796
  667    HB2  GLU  80           HB2      GLU  80  -8.904   4.816  -2.726
  668    HB3  GLU  80           HB3      GLU  80  -8.153   3.319  -2.194
  669    HG2  GLU  80           HG2      GLU  80  -7.897   2.590  -4.480
  670    HG3  GLU  80           HG3      GLU  80  -8.747   4.026  -5.054
  671    H    TYR  81           H        TYR  81 -10.879   1.185  -4.487
  672    HA   TYR  81           HA       TYR  81  -9.932  -0.909  -2.681
  673    HB2  TYR  81           HB2      TYR  81 -12.220  -1.195  -3.586
  674    HB3  TYR  81           HB3      TYR  81 -11.578  -1.117  -5.224
  675    HD1  TYR  81           HD1      TYR  81 -11.689  -3.157  -2.144
  676    HD2  TYR  81           HD2      TYR  81 -10.558  -3.021  -6.240
  677    HE1  TYR  81           HE1      TYR  81 -11.357  -5.593  -2.130
  678    HE2  TYR  81           HE2      TYR  81 -10.231  -5.454  -6.238
  679    HH   TYR  81           HH       TYR  81  -9.904  -7.263  -4.820
  680    H    ARG  82           H        ARG  82  -7.851  -1.294  -2.967
  681    HA   ARG  82           HA       ARG  82  -6.791  -1.203  -5.697
  682    HB2  ARG  82           HB2      ARG  82  -4.890   0.170  -4.999
  683    HB3  ARG  82           HB3      ARG  82  -6.415   1.021  -4.794
  684    HG2  ARG  82           HG2      ARG  82  -6.355   0.787  -2.458
  685    HG3  ARG  82           HG3      ARG  82  -5.079  -0.433  -2.535
  686    HD2  ARG  82           HD2      ARG  82  -4.808   2.468  -3.302
  687    HD3  ARG  82           HD3      ARG  82  -4.206   1.732  -1.817
  688    HE   ARG  82           HE       ARG  82  -2.764   0.337  -3.312
  689   HH11  ARG  82          HH11      ARG  82  -4.041   3.394  -4.444
  690   HH12  ARG  82          HH12      ARG  82  -2.692   3.710  -5.499
  691   HH21  ARG  82          HH21      ARG  82  -1.007   0.729  -4.736
  692   HH22  ARG  82          HH22      ARG  82  -0.966   2.198  -5.670
  693    H    LYS  83           H        LYS  83  -4.457  -1.848  -5.735
  694    HA   LYS  83           HA       LYS  83  -4.043  -4.327  -4.402
  695    HB2  LYS  83           HB2      LYS  83  -3.149  -3.680  -6.665
  696    HB3  LYS  83           HB3      LYS  83  -2.047  -2.576  -5.861
  697    HG2  LYS  83           HG2      LYS  83  -0.875  -4.384  -4.834
  698    HG3  LYS  83           HG3      LYS  83  -2.078  -5.553  -5.399
  699    HD2  LYS  83           HD2      LYS  83  -1.472  -4.885  -7.739
  700    HD3  LYS  83           HD3      LYS  83  -0.157  -3.927  -7.059
  701    HE2  LYS  83           HE2      LYS  83   0.799  -5.987  -7.709
  702    HE3  LYS  83           HE3      LYS  83   0.651  -6.045  -5.953
  703    HZ1  LYS  83           HZ1      LYS  83  -1.339  -7.371  -6.190
  704    HZ2  LYS  83           HZ2      LYS  83  -0.053  -8.115  -7.003
  705    HZ3  LYS  83           HZ3      LYS  83  -1.245  -7.280  -7.879
  706    H    LYS  84           H        LYS  84  -3.087  -4.700  -2.484
  707    HA   LYS  84           HA       LYS  84  -2.585  -2.766  -0.555
  708    HB2  LYS  84           HB2      LYS  84  -1.464  -5.550  -0.885
  709    HB3  LYS  84           HB3      LYS  84  -1.123  -4.558   0.522
  710    HG2  LYS  84           HG2      LYS  84  -3.894  -5.343  -0.341
  711    HG3  LYS  84           HG3      LYS  84  -2.924  -6.238   0.830
  712    HD2  LYS  84           HD2      LYS  84  -2.741  -4.054   2.119
  713    HD3  LYS  84           HD3      LYS  84  -4.021  -3.450   1.062
  714    HE2  LYS  84           HE2      LYS  84  -5.475  -5.283   1.779
  715    HE3  LYS  84           HE3      LYS  84  -4.196  -5.891   2.820
  716    HZ1  LYS  84           HZ1      LYS  84  -5.821  -4.610   4.061
  717    HZ2  LYS  84           HZ2      LYS  84  -5.507  -3.246   3.105
  718    HZ3  LYS  84           HZ3      LYS  84  -4.296  -3.870   4.112
  719    H    GLN  85           H        GLN  85  -0.587  -3.980  -3.096
  720    HA   GLN  85           HA       GLN  85   1.775  -2.642  -2.047
  721    HB2  GLN  85           HB2      GLN  85   2.189  -4.194  -4.450
  722    HB3  GLN  85           HB3      GLN  85   2.939  -4.371  -2.868
  723    HG2  GLN  85           HG2      GLN  85   0.911  -5.617  -2.145
  724    HG3  GLN  85           HG3      GLN  85   0.358  -5.584  -3.815
  725   HE21  GLN  85          HE21      GLN  85   2.549  -6.953  -1.546
  726   HE22  GLN  85          HE22      GLN  85   3.210  -8.162  -2.590
  727    H    ARG  86           H        ARG  86   3.048  -1.385  -3.487
  728    HA   ARG  86           HA       ARG  86   1.824  -0.640  -6.023
  729    HB2  ARG  86           HB2      ARG  86   2.586   1.801  -5.411
  730    HB3  ARG  86           HB3      ARG  86   1.013   1.197  -4.922
  731    HG2  ARG  86           HG2      ARG  86   1.834   2.295  -3.055
  732    HG3  ARG  86           HG3      ARG  86   2.115   0.588  -2.721
  733    HD2  ARG  86           HD2      ARG  86   4.414   0.774  -3.071
  734    HD3  ARG  86           HD3      ARG  86   4.248   2.297  -3.954
  735    HE   ARG  86           HE       ARG  86   3.651   2.074  -1.087
  736   HH11  ARG  86          HH11      ARG  86   5.349   3.600  -3.707
  737   HH12  ARG  86          HH12      ARG  86   5.743   5.029  -2.806
  738   HH21  ARG  86          HH21      ARG  86   4.107   3.941   0.123
  739   HH22  ARG  86          HH22      ARG  86   5.049   5.214  -0.604
  740    HA   PRO  87           HA       PRO  87   5.675  -1.156  -7.756
  741    HB2  PRO  87           HB2      PRO  87   5.644   1.442  -9.153
  742    HB3  PRO  87           HB3      PRO  87   5.615  -0.194  -9.817
  743    HG2  PRO  87           HG2      PRO  87   3.444   1.370  -9.871
  744    HG3  PRO  87           HG3      PRO  87   3.320  -0.380  -9.609
  745    HD2  PRO  87           HD2      PRO  87   3.176   1.850  -7.613
  746    HD3  PRO  87           HD3      PRO  87   2.187   0.378  -7.730
  747    H    LEU  88           H        LEU  88   7.368  -1.113  -6.438
  748    HA   LEU  88           HA       LEU  88   8.570   1.496  -5.797
  749    HB2  LEU  88           HB2      LEU  88   8.343  -0.943  -4.263
  750    HB3  LEU  88           HB3      LEU  88  10.009  -0.405  -4.400
  751    HG   LEU  88           HG       LEU  88   8.892   1.931  -3.770
  752   HD11  LEU  88          HD11      LEU  88   6.627   1.069  -3.651
  753   HD12  LEU  88          HD12      LEU  88   7.121  -0.102  -2.428
  754   HD13  LEU  88          HD13      LEU  88   7.172   1.625  -2.069
  755   HD21  LEU  88          HD21      LEU  88  10.739   0.885  -2.639
  756   HD22  LEU  88          HD22      LEU  88   9.569   1.495  -1.468
  757   HD23  LEU  88          HD23      LEU  88   9.645  -0.232  -1.824
  758    H    LYS  89           H        LYS  89  10.402   2.048  -6.797
  759    HA   LYS  89           HA       LYS  89  11.667   0.028  -8.486
  760    HB2  LYS  89           HB2      LYS  89  11.906   3.029  -8.441
  761    HB3  LYS  89           HB3      LYS  89  12.891   1.987  -9.463
  762    HG2  LYS  89           HG2      LYS  89  10.657   1.046 -10.297
  763    HG3  LYS  89           HG3      LYS  89   9.950   2.492  -9.572
  764    HD2  LYS  89           HD2      LYS  89  12.166   2.479 -11.604
  765    HD3  LYS  89           HD3      LYS  89  10.466   2.756 -11.956
  766    HE2  LYS  89           HE2      LYS  89  10.500   4.711 -10.448
  767    HE3  LYS  89           HE3      LYS  89  12.220   4.443 -10.177
  768    HZ1  LYS  89           HZ1      LYS  89  12.021   6.111 -11.813
  769    HZ2  LYS  89           HZ2      LYS  89  10.888   5.223 -12.707
  770    HZ3  LYS  89           HZ3      LYS  89  12.503   4.706 -12.637
  771    H    ILE  90           H        ILE  90  13.565  -0.810  -8.020
  772    HA   ILE  90           HA       ILE  90  15.032   0.293  -5.712
  773    HB   ILE  90           HB       ILE  90  14.272  -2.614  -6.073
  774   HG12  ILE  90          HG12      ILE  90  12.395  -1.214  -5.296
  775   HG13  ILE  90          HG13      ILE  90  12.927  -2.344  -4.056
  776   HG21  ILE  90          HG21      ILE  90  16.459  -2.459  -5.102
  777   HG22  ILE  90          HG22      ILE  90  15.901  -1.257  -3.935
  778   HG23  ILE  90          HG23      ILE  90  15.311  -2.916  -3.843
  779   HD11  ILE  90          HD11      ILE  90  14.136  -0.549  -2.935
  780   HD12  ILE  90          HD12      ILE  90  13.617   0.583  -4.183
  781   HD13  ILE  90          HD13      ILE  90  12.426  -0.160  -3.117
  782    H    ARG  91           H        ARG  91  17.235   0.257  -5.961
  783    HA   ARG  91           HA       ARG  91  18.276  -1.301  -8.228
  784    HB2  ARG  91           HB2      ARG  91  18.625   1.202  -8.264
  785    HB3  ARG  91           HB3      ARG  91  19.621   1.008  -6.829
  786    HG2  ARG  91           HG2      ARG  91  21.172  -0.395  -8.053
  787    HG3  ARG  91           HG3      ARG  91  20.166  -0.266  -9.498
  788    HD2  ARG  91           HD2      ARG  91  21.464   2.059  -8.083
  789    HD3  ARG  91           HD3      ARG  91  22.117   1.263  -9.515
  790    HE   ARG  91           HE       ARG  91  19.855   1.947 -10.541
  791   HH11  ARG  91          HH11      ARG  91  21.665   3.813  -8.191
  792   HH12  ARG  91          HH12      ARG  91  21.024   5.341  -8.724
  793   HH21  ARG  91          HH21      ARG  91  19.014   3.951 -11.241
  794   HH22  ARG  91          HH22      ARG  91  19.500   5.419 -10.435
  795    H    MET  92           H        MET  92  19.482  -2.994  -7.764
  796    HA   MET  92           HA       MET  92  20.005  -3.656  -5.011
  797    HB2  MET  92           HB2      MET  92  19.920  -5.044  -7.606
  798    HB3  MET  92           HB3      MET  92  21.082  -5.687  -6.458
  799    HG2  MET  92           HG2      MET  92  18.729  -6.670  -6.518
  800    HG3  MET  92           HG3      MET  92  19.446  -6.311  -4.951
  801    HE1  MET  92           HE1      MET  92  17.757  -4.074  -7.687
  802    HE2  MET  92           HE2      MET  92  16.670  -5.454  -7.548
  803    HE3  MET  92           HE3      MET  92  16.142  -3.858  -7.011
  804    H    LEU  93           H        LEU  93  22.161  -4.872  -4.640
  805    HA   LEU  93           HA       LEU  93  24.057  -2.854  -4.341
  806    HB2  LEU  93           HB2      LEU  93  24.541  -5.832  -4.209
  807    HB3  LEU  93           HB3      LEU  93  25.585  -4.595  -3.550
  808    HG   LEU  93           HG       LEU  93  24.507  -5.388  -1.677
  809   HD11  LEU  93          HD11      LEU  93  22.763  -3.115  -2.594
  810   HD12  LEU  93          HD12      LEU  93  22.921  -3.692  -0.934
  811   HD13  LEU  93          HD13      LEU  93  24.310  -2.979  -1.755
  812   HD21  LEU  93          HD21      LEU  93  21.857  -5.428  -3.104
  813   HD22  LEU  93          HD22      LEU  93  22.920  -6.825  -2.934
  814   HD23  LEU  93          HD23      LEU  93  22.226  -6.064  -1.504
  815    H    ASP  94           H        ASP  94  23.791  -5.383  -6.762
  816    HA   ASP  94           HA       ASP  94  26.401  -4.956  -7.861
  817    HB2  ASP  94           HB2      ASP  94  25.744  -6.517  -9.582
  818    HB3  ASP  94           HB3      ASP  94  25.168  -7.121  -8.032
  819    H    GLY  95           H        GLY  95  23.498  -3.279  -8.028
  820    HA2  GLY  95           HA2      GLY  95  23.494  -1.099  -9.016
  821    HA3  GLY  95           HA3      GLY  95  24.575  -1.701 -10.265
  822    H    THR  96           H        THR  96  22.083  -3.874  -9.537
  823    HA   THR  96           HA       THR  96  20.832  -3.235 -12.096
  824    HB   THR  96           HB       THR  96  20.630  -5.680 -10.323
  825    HG1  THR  96           HG1      THR  96  22.384  -6.163 -11.395
  826   HG21  THR  96          HG21      THR  96  18.522  -5.315 -11.524
  827   HG22  THR  96          HG22      THR  96  19.383  -6.720 -12.150
  828   HG23  THR  96          HG23      THR  96  19.408  -5.201 -13.045
  829    H    VAL  97           H        VAL  97  18.780  -2.504 -12.280
  830    HA   VAL  97           HA       VAL  97  17.396  -1.984  -9.738
  831    HB   VAL  97           HB       VAL  97  18.057   0.057 -10.878
  832   HG11  VAL  97          HG11      VAL  97  18.184  -0.763 -13.150
  833   HG12  VAL  97          HG12      VAL  97  16.431  -0.947 -13.203
  834   HG13  VAL  97          HG13      VAL  97  17.145   0.659 -13.065
  835   HG21  VAL  97          HG21      VAL  97  15.084  -0.409 -11.060
  836   HG22  VAL  97          HG22      VAL  97  15.975   0.124  -9.635
  837   HG23  VAL  97          HG23      VAL  97  15.878   1.166 -11.054
  838    H    LYS  98           H        LYS  98  15.329  -2.530  -9.467
  839    HA   LYS  98           HA       LYS  98  13.816  -3.620 -11.722
  840    HB2  LYS  98           HB2      LYS  98  13.154  -5.628 -10.650
  841    HB3  LYS  98           HB3      LYS  98  14.900  -5.553 -10.487
  842    HG2  LYS  98           HG2      LYS  98  14.777  -5.037  -8.201
  843    HG3  LYS  98           HG3      LYS  98  13.067  -4.610  -8.308
  844    HD2  LYS  98           HD2      LYS  98  14.031  -7.392  -8.901
  845    HD3  LYS  98           HD3      LYS  98  13.676  -6.877  -7.249
  846    HE2  LYS  98           HE2      LYS  98  11.712  -7.903  -8.021
  847    HE3  LYS  98           HE3      LYS  98  11.399  -6.168  -8.114
  848    HZ1  LYS  98           HZ1      LYS  98  12.263  -7.811 -10.438
  849    HZ2  LYS  98           HZ2      LYS  98  11.703  -6.212 -10.462
  850    HZ3  LYS  98           HZ3      LYS  98  10.639  -7.473 -10.073
  851    H    THR  99           H        THR  99  11.499  -3.690 -11.311
  852    HA   THR  99           HA       THR  99  10.699  -1.905  -9.113
  853    HB   THR  99           HB       THR  99   9.155  -2.534 -11.639
  854    HG1  THR  99           HG1      THR  99  11.023  -1.311 -12.125
  855   HG21  THR  99          HG21      THR  99   7.761  -0.641 -10.967
  856   HG22  THR  99          HG22      THR  99   8.745  -0.423  -9.519
  857   HG23  THR  99          HG23      THR  99   7.778  -1.885  -9.714
  858    H    ILE 100           H        ILE 100   9.570  -2.858  -7.483
  859    HA   ILE 100           HA       ILE 100   8.184  -5.377  -8.074
  860    HB   ILE 100           HB       ILE 100  10.393  -5.766  -6.974
  861   HG12  ILE 100          HG12      ILE 100   8.157  -7.127  -6.591
  862   HG13  ILE 100          HG13      ILE 100   9.631  -7.525  -5.721
  863   HG21  ILE 100          HG21      ILE 100   9.176  -4.270  -4.662
  864   HG22  ILE 100          HG22      ILE 100  10.686  -5.181  -4.614
  865   HG23  ILE 100          HG23      ILE 100  10.547  -3.757  -5.646
  866   HD11  ILE 100          HD11      ILE 100   8.815  -6.277  -3.785
  867   HD12  ILE 100          HD12      ILE 100   7.335  -5.892  -4.663
  868   HD13  ILE 100          HD13      ILE 100   7.708  -7.567  -4.253
  869    H    MET 101           H        MET 101   6.268  -5.697  -6.869
  870    HA   MET 101           HA       MET 101   5.097  -3.223  -5.924
  871    HB2  MET 101           HB2      MET 101   3.894  -5.995  -6.026
  872    HB3  MET 101           HB3      MET 101   3.021  -4.483  -5.840
  873    HG2  MET 101           HG2      MET 101   4.631  -5.226  -8.268
  874    HG3  MET 101           HG3      MET 101   2.891  -5.457  -8.110
  875    HE1  MET 101           HE1      MET 101   1.165  -3.452  -7.800
  876    HE2  MET 101           HE2      MET 101   2.106  -2.844  -6.438
  877    HE3  MET 101           HE3      MET 101   1.644  -1.755  -7.748
  878    H    VAL 102           H        VAL 102   5.501  -2.583  -3.981
  879    HA   VAL 102           HA       VAL 102   5.794  -4.509  -1.789
  880    HB   VAL 102           HB       VAL 102   6.288  -1.551  -1.615
  881   HG11  VAL 102          HG11      VAL 102   6.113  -2.880   0.457
  882   HG12  VAL 102          HG12      VAL 102   7.483  -3.851  -0.087
  883   HG13  VAL 102          HG13      VAL 102   7.690  -2.127   0.237
  884   HG21  VAL 102          HG21      VAL 102   8.241  -3.661  -2.502
  885   HG22  VAL 102          HG22      VAL 102   7.618  -2.316  -3.463
  886   HG23  VAL 102          HG23      VAL 102   8.654  -2.000  -2.073
  887    H    ASP 103           H        ASP 103   4.218  -4.781  -0.365
  888    HA   ASP 103           HA       ASP 103   1.775  -3.455  -0.345
  889    HB2  ASP 103           HB2      ASP 103   3.108  -4.697   2.075
  890    HB3  ASP 103           HB3      ASP 103   1.382  -4.466   1.814
  891    H    ASP 104           H        ASP 104   1.314  -1.420   0.130
  892    HA   ASP 104           HA       ASP 104   3.261   0.279   1.406
  893    HB2  ASP 104           HB2      ASP 104   1.856   1.081  -0.466
  894    HB3  ASP 104           HB3      ASP 104   0.421   0.882   0.535
  895    H    SER 105           H        SER 105   0.774  -1.725   2.432
  896    HA   SER 105           HA       SER 105  -0.058  -0.192   4.717
  897    HB2  SER 105           HB2      SER 105  -1.142  -2.517   5.250
  898    HB3  SER 105           HB3      SER 105  -1.748  -1.557   3.900
  899    HG   SER 105           HG       SER 105  -0.135  -3.874   3.872
  900    H    LYS 106           H        LYS 106   2.821  -1.606   4.192
  901    HA   LYS 106           HA       LYS 106   3.098  -2.306   7.022
  902    HB2  LYS 106           HB2      LYS 106   4.723  -4.119   6.326
  903    HB3  LYS 106           HB3      LYS 106   3.023  -4.435   6.045
  904    HG2  LYS 106           HG2      LYS 106   3.952  -5.189   4.099
  905    HG3  LYS 106           HG3      LYS 106   3.545  -3.538   3.651
  906    HD2  LYS 106           HD2      LYS 106   5.790  -2.835   3.850
  907    HD3  LYS 106           HD3      LYS 106   6.256  -4.316   4.692
  908    HE2  LYS 106           HE2      LYS 106   5.353  -4.125   1.818
  909    HE3  LYS 106           HE3      LYS 106   7.017  -4.326   2.365
  910    HZ1  LYS 106           HZ1      LYS 106   6.275  -6.466   1.795
  911    HZ2  LYS 106           HZ2      LYS 106   4.784  -6.264   2.565
  912    HZ3  LYS 106           HZ3      LYS 106   6.193  -6.428   3.489
  913    H    THR 107           H        THR 107   5.492  -2.512   7.631
  914    HA   THR 107           HA       THR 107   6.636   0.058   6.950
  915    HB   THR 107           HB       THR 107   8.303  -0.699   8.812
  916    HG1  THR 107           HG1      THR 107   6.081  -2.391   9.413
  917   HG21  THR 107          HG21      THR 107   6.673   1.084   9.093
  918   HG22  THR 107          HG22      THR 107   6.720   0.070  10.536
  919   HG23  THR 107          HG23      THR 107   5.398  -0.101   9.381
  920    H    VAL 108           H        VAL 108   9.332  -0.302   7.425
  921    HA   VAL 108           HA       VAL 108   9.997  -0.981   4.718
  922    HB   VAL 108           HB       VAL 108  11.803   0.045   6.876
  923   HG11  VAL 108          HG11      VAL 108  13.167   0.883   5.021
  924   HG12  VAL 108          HG12      VAL 108  13.002  -0.872   4.967
  925   HG13  VAL 108          HG13      VAL 108  12.053   0.137   3.877
  926   HG21  VAL 108          HG21      VAL 108  11.381   2.273   5.964
  927   HG22  VAL 108          HG22      VAL 108  10.176   1.585   4.875
  928   HG23  VAL 108          HG23      VAL 108   9.919   1.536   6.619
  929    H    THR 109           H        THR 109  11.152  -2.132   7.921
  930    HA   THR 109           HA       THR 109  12.928  -4.047   7.094
  931    HB   THR 109           HB       THR 109  10.934  -4.327   9.347
  932    HG1  THR 109           HG1      THR 109  13.170  -3.664  10.378
  933   HG21  THR 109          HG21      THR 109  13.594  -5.698   8.909
  934   HG22  THR 109          HG22      THR 109  12.009  -6.462   8.777
  935   HG23  THR 109          HG23      THR 109  12.569  -5.858  10.337
  936    H    ASP 110           H        ASP 110   9.397  -4.457   7.419
  937    HA   ASP 110           HA       ASP 110   9.288  -7.095   6.422
  938    HB2  ASP 110           HB2      ASP 110   7.471  -5.881   7.674
  939    HB3  ASP 110           HB3      ASP 110   7.158  -4.951   6.215
  940    H    MET 111           H        MET 111   9.037  -3.934   4.893
  941    HA   MET 111           HA       MET 111   8.515  -4.584   2.261
  942    HB2  MET 111           HB2      MET 111   8.567  -2.310   2.863
  943    HB3  MET 111           HB3      MET 111  10.189  -2.435   3.522
  944    HG2  MET 111           HG2      MET 111  10.985  -2.874   1.177
  945    HG3  MET 111           HG3      MET 111   9.372  -2.421   0.635
  946    HE1  MET 111           HE1      MET 111   9.387   1.128   2.654
  947    HE2  MET 111           HE2      MET 111   8.293   0.037   1.797
  948    HE3  MET 111           HE3      MET 111   9.063  -0.480   3.297
  949    H    LEU 112           H        LEU 112  11.689  -4.338   3.832
  950    HA   LEU 112           HA       LEU 112  13.165  -4.895   1.497
  951    HB2  LEU 112           HB2      LEU 112  13.807  -4.028   3.980
  952    HB3  LEU 112           HB3      LEU 112  14.375  -5.688   4.061
  953    HG   LEU 112           HG       LEU 112  15.708  -5.290   2.003
  954   HD11  LEU 112          HD11      LEU 112  14.805  -2.446   2.417
  955   HD12  LEU 112          HD12      LEU 112  16.069  -2.963   1.300
  956   HD13  LEU 112          HD13      LEU 112  14.404  -3.487   1.050
  957   HD21  LEU 112          HD21      LEU 112  16.211  -3.490   4.360
  958   HD22  LEU 112          HD22      LEU 112  16.807  -5.133   4.123
  959   HD23  LEU 112          HD23      LEU 112  17.387  -3.826   3.090
  960    H    MET 113           H        MET 113  11.868  -6.932   4.041
  961    HA   MET 113           HA       MET 113  12.944  -9.395   3.311
  962    HB2  MET 113           HB2      MET 113  11.558  -9.046   5.309
  963    HB3  MET 113           HB3      MET 113  10.156  -8.759   4.296
  964    HG2  MET 113           HG2      MET 113  10.294 -11.053   3.460
  965    HG3  MET 113           HG3      MET 113  11.684 -11.340   4.506
  966    HE1  MET 113           HE1      MET 113   7.880 -10.350   4.422
  967    HE2  MET 113           HE2      MET 113   7.488 -10.326   6.144
  968    HE3  MET 113           HE3      MET 113   8.585  -9.119   5.472
  969    H    THR 114           H        THR 114  10.081  -7.712   2.161
  970    HA   THR 114           HA       THR 114   9.249  -9.541   0.216
  971    HB   THR 114           HB       THR 114   8.910  -6.545   0.410
  972    HG1  THR 114           HG1      THR 114   7.413  -8.773   1.333
  973   HG21  THR 114          HG21      THR 114   8.501  -7.347  -1.894
  974   HG22  THR 114          HG22      THR 114   7.041  -6.739  -1.114
  975   HG23  THR 114          HG23      THR 114   7.303  -8.479  -1.262
  976    H    ILE 115           H        ILE 115  11.507  -6.779   0.004
  977    HA   ILE 115           HA       ILE 115  11.642  -6.905  -2.859
  978    HB   ILE 115           HB       ILE 115  13.351  -5.364  -0.900
  979   HG12  ILE 115          HG12      ILE 115  11.005  -4.486  -2.602
  980   HG13  ILE 115          HG13      ILE 115  10.952  -4.762  -0.864
  981   HG21  ILE 115          HG21      ILE 115  14.505  -5.687  -3.021
  982   HG22  ILE 115          HG22      ILE 115  13.095  -5.090  -3.895
  983   HG23  ILE 115          HG23      ILE 115  14.002  -4.007  -2.839
  984   HD11  ILE 115          HD11      ILE 115  12.589  -2.671  -2.277
  985   HD12  ILE 115          HD12      ILE 115  11.104  -2.399  -1.367
  986   HD13  ILE 115          HD13      ILE 115  12.560  -2.950  -0.536
  987    H    CYS 116           H        CYS 116  13.922  -7.721  -0.224
  988    HA   CYS 116           HA       CYS 116  16.027  -8.413  -1.997
  989    HB2  CYS 116           HB2      CYS 116  15.664  -9.307   0.877
  990    HB3  CYS 116           HB3      CYS 116  17.156  -9.329  -0.050
  991    HG   CYS 116           HG       CYS 116  16.622  -6.342  -0.384
  992    H    ALA 117           H        ALA 117  13.283 -10.127  -0.758
  993    HA   ALA 117           HA       ALA 117  14.156 -12.766  -1.286
  994    HB1  ALA 117           HB1      ALA 117  11.343 -11.689  -1.203
  995    HB2  ALA 117           HB2      ALA 117  11.810 -13.387  -1.110
  996    HB3  ALA 117           HB3      ALA 117  12.263 -12.275   0.182
  997    H    ARG 118           H        ARG 118  12.933 -10.226  -3.311
  998    HA   ARG 118           HA       ARG 118  12.047 -11.884  -5.460
  999    HB2  ARG 118           HB2      ARG 118  12.996  -9.023  -5.721
 1000    HB3  ARG 118           HB3      ARG 118  11.878  -9.891  -6.768
 1001    HG2  ARG 118           HG2      ARG 118  11.371  -9.005  -3.941
 1002    HG3  ARG 118           HG3      ARG 118  10.664  -8.336  -5.411
 1003    HD2  ARG 118           HD2      ARG 118  10.284 -11.170  -4.466
 1004    HD3  ARG 118           HD3      ARG 118   9.157  -9.852  -4.162
 1005    HE   ARG 118           HE       ARG 118   9.731 -10.200  -6.951
 1006   HH11  ARG 118          HH11      ARG 118   7.813 -11.396  -4.277
 1007   HH12  ARG 118          HH12      ARG 118   6.502 -11.928  -5.283
 1008   HH21  ARG 118          HH21      ARG 118   7.985 -10.903  -8.284
 1009   HH22  ARG 118          HH22      ARG 118   6.606 -11.659  -7.544
 1010    H    ILE 119           H        ILE 119  15.078 -10.383  -4.566
 1011    HA   ILE 119           HA       ILE 119  16.376 -11.003  -7.059
 1012    HB   ILE 119           HB       ILE 119  17.912 -10.377  -4.573
 1013   HG12  ILE 119          HG12      ILE 119  15.962  -8.868  -4.491
 1014   HG13  ILE 119          HG13      ILE 119  17.456  -7.990  -4.797
 1015   HG21  ILE 119          HG21      ILE 119  18.137  -9.488  -7.442
 1016   HG22  ILE 119          HG22      ILE 119  19.261  -9.071  -6.148
 1017   HG23  ILE 119          HG23      ILE 119  19.092 -10.750  -6.662
 1018   HD11  ILE 119          HD11      ILE 119  15.389  -8.731  -6.854
 1019   HD12  ILE 119          HD12      ILE 119  15.644  -7.133  -6.153
 1020   HD13  ILE 119          HD13      ILE 119  16.890  -7.860  -7.167
 1021    H    GLY 120           H        GLY 120  16.099 -12.378  -3.857
 1022    HA2  GLY 120           HA2      GLY 120  16.401 -14.796  -3.650
 1023    HA3  GLY 120           HA3      GLY 120  17.764 -14.639  -4.749
 1024    H    ILE 121           H        ILE 121  17.305 -12.217  -2.361
 1025    HA   ILE 121           HA       ILE 121  19.700 -13.134  -0.947
 1026    HB   ILE 121           HB       ILE 121  18.224 -10.517  -0.643
 1027   HG12  ILE 121          HG12      ILE 121  20.741 -11.022  -2.239
 1028   HG13  ILE 121          HG13      ILE 121  19.139 -10.866  -2.954
 1029   HG21  ILE 121          HG21      ILE 121  19.592 -11.106   1.273
 1030   HG22  ILE 121          HG22      ILE 121  20.981 -11.365   0.219
 1031   HG23  ILE 121          HG23      ILE 121  20.304  -9.748   0.402
 1032   HD11  ILE 121          HD11      ILE 121  18.980  -8.581  -2.118
 1033   HD12  ILE 121          HD12      ILE 121  20.571  -8.736  -1.371
 1034   HD13  ILE 121          HD13      ILE 121  20.409  -8.794  -3.128
 1035    H    THR 122           H        THR 122  19.510 -14.095   0.997
 1036    HA   THR 122           HA       THR 122  16.853 -14.304   2.157
 1037    HB   THR 122           HB       THR 122  19.417 -15.642   3.042
 1038    HG1  THR 122           HG1      THR 122  19.025 -17.124   1.547
 1039   HG21  THR 122          HG21      THR 122  17.660 -15.607   4.759
 1040   HG22  THR 122          HG22      THR 122  17.917 -17.239   4.141
 1041   HG23  THR 122          HG23      THR 122  16.520 -16.303   3.608
 1042    H    ASN 123           H        ASN 123  20.078 -13.161   3.111
 1043    HA   ASN 123           HA       ASN 123  19.059 -12.208   5.655
 1044    HB2  ASN 123           HB2      ASN 123  21.366 -13.194   5.397
 1045    HB3  ASN 123           HB3      ASN 123  21.807 -11.753   4.486
 1046   HD21  ASN 123          HD21      ASN 123  23.369 -11.210   6.027
 1047   HD22  ASN 123          HD22      ASN 123  22.938 -10.560   7.571
 1048    H    HIS 124           H        HIS 124  17.692 -10.565   5.372
 1049    HA   HIS 124           HA       HIS 124  18.488  -8.380   3.571
 1050    HB2  HIS 124           HB2      HIS 124  16.134  -7.708   3.568
 1051    HB3  HIS 124           HB3      HIS 124  16.298  -9.393   3.092
 1052    HD1  HIS 124           HD1      HIS 124  14.831  -7.195   5.712
 1053    HD2  HIS 124           HD2      HIS 124  15.298 -11.260   4.977
 1054    HE1  HIS 124           HE1      HIS 124  13.279  -8.357   7.310
 1055    HE2  HIS 124           HE2      HIS 124  13.813 -10.804   7.039
 1056    H    ASP 125           H        ASP 125  18.586  -9.165   6.775
 1057    HA   ASP 125           HA       ASP 125  17.738  -6.656   7.879
 1058    HB2  ASP 125           HB2      ASP 125  17.663  -8.808   9.149
 1059    HB3  ASP 125           HB3      ASP 125  19.424  -8.799   9.188
 1060    H    GLU 126           H        GLU 126  20.518  -7.772   6.317
 1061    HA   GLU 126           HA       GLU 126  22.316  -5.937   7.666
 1062    HB2  GLU 126           HB2      GLU 126  24.031  -6.850   6.128
 1063    HB3  GLU 126           HB3      GLU 126  23.224  -8.094   7.070
 1064    HG2  GLU 126           HG2      GLU 126  21.913  -8.760   5.187
 1065    HG3  GLU 126           HG3      GLU 126  22.502  -7.404   4.235
 1066    H    TYR 127           H        TYR 127  19.945  -5.255   5.772
 1067    HA   TYR 127           HA       TYR 127  21.457  -3.299   4.169
 1068    HB2  TYR 127           HB2      TYR 127  18.873  -4.640   3.371
 1069    HB3  TYR 127           HB3      TYR 127  19.751  -3.441   2.434
 1070    HD1  TYR 127           HD1      TYR 127  22.256  -4.124   1.909
 1071    HD2  TYR 127           HD2      TYR 127  19.122  -6.832   2.841
 1072    HE1  TYR 127           HE1      TYR 127  23.478  -5.907   0.775
 1073    HE2  TYR 127           HE2      TYR 127  20.322  -8.639   1.713
 1074    HH   TYR 127           HH       TYR 127  23.608  -8.340   0.762
 1075    H    SER 128           H        SER 128  20.587  -1.242   4.016
 1076    HA   SER 128           HA       SER 128  18.103  -0.742   5.520
 1077    HB2  SER 128           HB2      SER 128  20.288   1.234   4.815
 1078    HB3  SER 128           HB3      SER 128  18.864   1.549   5.807
 1079    HG   SER 128           HG       SER 128  21.002   1.009   6.853
 1080    H    LEU 129           H        LEU 129  17.143   1.506   4.523
 1081    HA   LEU 129           HA       LEU 129  17.084   1.087   1.604
 1082    HB2  LEU 129           HB2      LEU 129  14.986   0.561   3.183
 1083    HB3  LEU 129           HB3      LEU 129  14.733   2.283   2.997
 1084    HG   LEU 129           HG       LEU 129  13.407   0.913   1.408
 1085   HD11  LEU 129          HD11      LEU 129  14.034   3.223   0.845
 1086   HD12  LEU 129          HD12      LEU 129  15.476   2.610   0.034
 1087   HD13  LEU 129          HD13      LEU 129  13.877   2.192  -0.579
 1088   HD21  LEU 129          HD21      LEU 129  16.088   0.192   0.238
 1089   HD22  LEU 129          HD22      LEU 129  15.005  -0.904   1.095
 1090   HD23  LEU 129          HD23      LEU 129  14.512  -0.204  -0.446
 1091    H    VAL 130           H        VAL 130  17.214   2.922   0.333
 1092    HA   VAL 130           HA       VAL 130  17.113   5.511   1.687
 1093    HB   VAL 130           HB       VAL 130  19.448   5.205   1.686
 1094   HG11  VAL 130          HG11      VAL 130  19.575   3.252   0.287
 1095   HG12  VAL 130          HG12      VAL 130  19.214   4.222  -1.139
 1096   HG13  VAL 130          HG13      VAL 130  20.724   4.471  -0.266
 1097   HG21  VAL 130          HG21      VAL 130  18.812   7.381   0.799
 1098   HG22  VAL 130          HG22      VAL 130  20.316   6.815   0.069
 1099   HG23  VAL 130          HG23      VAL 130  18.806   6.722  -0.838
 1100    H    ARG 131           H        ARG 131  15.675   6.699   0.693
 1101    HA   ARG 131           HA       ARG 131  14.965   6.039  -2.076
 1102    HB2  ARG 131           HB2      ARG 131  13.539   7.865  -0.138
 1103    HB3  ARG 131           HB3      ARG 131  12.930   7.283  -1.681
 1104    HG2  ARG 131           HG2      ARG 131  12.909   4.996  -0.779
 1105    HG3  ARG 131           HG3      ARG 131  13.445   5.631   0.782
 1106    HD2  ARG 131           HD2      ARG 131  11.032   5.336   0.778
 1107    HD3  ARG 131           HD3      ARG 131  11.453   7.051   0.878
 1108    HE   ARG 131           HE       ARG 131  10.757   7.327  -1.371
 1109   HH11  ARG 131          HH11      ARG 131  10.105   4.135  -0.106
 1110   HH12  ARG 131          HH12      ARG 131   8.917   3.760  -1.308
 1111   HH21  ARG 131          HH21      ARG 131   9.182   6.868  -2.949
 1112   HH22  ARG 131          HH22      ARG 131   8.383   5.325  -2.931
 1113    H    GLU 132           H        GLU 132  16.425   7.141  -3.339
 1114    HA   GLU 132           HA       GLU 132  16.771   9.967  -2.906
 1115    HB2  GLU 132           HB2      GLU 132  17.682   8.189  -5.180
 1116    HB3  GLU 132           HB3      GLU 132  18.054   9.904  -5.055
 1117    HG2  GLU 132           HG2      GLU 132  18.963   9.180  -2.688
 1118    HG3  GLU 132           HG3      GLU 132  19.092   7.611  -3.487
 1119    H    LEU 133           H        LEU 133  15.146  11.226  -3.270
 1120    HA   LEU 133           HA       LEU 133  13.029  10.331  -5.040
 1121    HB2  LEU 133           HB2      LEU 133  13.062  12.771  -3.278
 1122    HB3  LEU 133           HB3      LEU 133  11.670  12.059  -4.059
 1123    HG   LEU 133           HG       LEU 133  13.205  11.019  -1.694
 1124   HD11  LEU 133          HD11      LEU 133  10.313  11.708  -2.187
 1125   HD12  LEU 133          HD12      LEU 133  10.963  11.048  -0.683
 1126   HD13  LEU 133          HD13      LEU 133  11.471  12.643  -1.239
 1127   HD21  LEU 133          HD21      LEU 133  12.837   9.126  -3.175
 1128   HD22  LEU 133          HD22      LEU 133  11.781   9.031  -1.766
 1129   HD23  LEU 133          HD23      LEU 133  11.132   9.554  -3.320
 1130    H    MET 134           H        MET 134  11.785  12.434  -5.800
 1131    HA   MET 134           HA       MET 134  13.570  13.991  -7.551
 1132    HB2  MET 134           HB2      MET 134  11.314  14.043  -8.942
 1133    HB3  MET 134           HB3      MET 134  12.410  12.672  -9.072
 1134    HG2  MET 134           HG2      MET 134  10.038  12.012  -8.835
 1135    HG3  MET 134           HG3      MET 134  11.071  11.375  -7.562
 1136    HE1  MET 134           HE1      MET 134   9.340  10.839  -5.754
 1137    HE2  MET 134           HE2      MET 134   7.946  11.855  -5.389
 1138    HE3  MET 134           HE3      MET 134   8.105  11.118  -6.984
 1139    H    GLU 135           H        GLU 135  12.232  14.285  -4.829
 1140    HA   GLU 135           HA       GLU 135   9.981  15.934  -4.994
 1141    HB2  GLU 135           HB2      GLU 135  11.881  15.132  -2.850
 1142    HB3  GLU 135           HB3      GLU 135  10.817  16.498  -2.542
 1143    HG2  GLU 135           HG2      GLU 135   9.897  13.770  -3.401
 1144    HG3  GLU 135           HG3      GLU 135   9.927  14.351  -1.735
 1145    H    GLU 136           H        GLU 136   9.732  18.001  -5.390
 1146    HA   GLU 136           HA       GLU 136  11.944  19.856  -5.393
 1147    HB2  GLU 136           HB2      GLU 136  10.278  21.501  -6.040
 1148    HB3  GLU 136           HB3      GLU 136  10.017  20.026  -6.964
 1149    HG2  GLU 136           HG2      GLU 136   8.198  19.395  -5.479
 1150    HG3  GLU 136           HG3      GLU 136   8.462  20.854  -4.526
 1151    H    LYS 137           H        LYS 137   9.530  18.704  -3.238
 1152    HA   LYS 137           HA       LYS 137   9.673  20.921  -1.395
 1153    HB2  LYS 137           HB2      LYS 137   8.431  18.193  -1.005
 1154    HB3  LYS 137           HB3      LYS 137   8.159  19.616  -0.011
 1155    HG2  LYS 137           HG2      LYS 137   7.097  20.734  -1.914
 1156    HG3  LYS 137           HG3      LYS 137   7.353  19.287  -2.894
 1157    HD2  LYS 137           HD2      LYS 137   6.002  17.996  -1.278
 1158    HD3  LYS 137           HD3      LYS 137   5.698  19.483  -0.378
 1159    HE2  LYS 137           HE2      LYS 137   3.807  19.018  -1.785
 1160    HE3  LYS 137           HE3      LYS 137   4.645  20.442  -2.398
 1161    HZ1  LYS 137           HZ1      LYS 137   3.948  18.828  -4.130
 1162    HZ2  LYS 137           HZ2      LYS 137   5.040  17.704  -3.479
 1163    HZ3  LYS 137           HZ3      LYS 137   5.609  19.157  -4.137
 1164    H    LYS 138           H        LYS 138  10.190  17.439  -0.881
 1165    HA   LYS 138           HA       LYS 138  11.786  17.904   1.431
 1166    HB2  LYS 138           HB2      LYS 138  10.347  15.860   1.008
 1167    HB3  LYS 138           HB3      LYS 138  11.568  15.328  -0.132
 1168    HG2  LYS 138           HG2      LYS 138  13.223  15.253   1.646
 1169    HG3  LYS 138           HG3      LYS 138  12.022  15.834   2.801
 1170    HD2  LYS 138           HD2      LYS 138  11.742  13.289   1.212
 1171    HD3  LYS 138           HD3      LYS 138  12.407  13.360   2.842
 1172    HE2  LYS 138           HE2      LYS 138   9.644  14.289   2.068
 1173    HE3  LYS 138           HE3      LYS 138  10.012  12.715   2.770
 1174    HZ1  LYS 138           HZ1      LYS 138  10.295  15.381   4.038
 1175    HZ2  LYS 138           HZ2      LYS 138  11.006  13.984   4.681
 1176    HZ3  LYS 138           HZ3      LYS 138   9.321  14.083   4.534
 1177    H    ASP 169           H        ASP 169  12.628  16.266  -1.624
 1178    HA   ASP 169           HA       ASP 169  14.603  15.862  -2.657
 1179    HB2  ASP 169           HB2      ASP 169  14.478  18.295  -3.107
 1180    HB3  ASP 169           HB3      ASP 169  15.359  18.605  -1.613
 1181    H    GLU 170           H        GLU 170  14.986  14.184  -1.227
 1182    HA   GLU 170           HA       GLU 170  17.219  14.637   0.582
 1183    HB2  GLU 170           HB2      GLU 170  14.612  14.522   1.525
 1184    HB3  GLU 170           HB3      GLU 170  15.205  12.882   1.748
 1185    HG2  GLU 170           HG2      GLU 170  16.624  15.329   2.752
 1186    HG3  GLU 170           HG3      GLU 170  15.499  14.370   3.714
 1187    H    LEU 171           H        LEU 171  18.134  12.619   1.362
 1188    HA   LEU 171           HA       LEU 171  18.279  10.611  -0.695
 1189    HB2  LEU 171           HB2      LEU 171  19.476  10.582   2.079
 1190    HB3  LEU 171           HB3      LEU 171  19.948   9.576   0.722
 1191    HG   LEU 171           HG       LEU 171  20.310  12.551   0.950
 1192   HD11  LEU 171          HD11      LEU 171  21.870  11.281   2.316
 1193   HD12  LEU 171          HD12      LEU 171  22.305  10.293   0.922
 1194   HD13  LEU 171          HD13      LEU 171  22.695  12.013   0.941
 1195   HD21  LEU 171          HD21      LEU 171  20.990  10.645  -1.279
 1196   HD22  LEU 171          HD22      LEU 171  19.797  11.947  -1.328
 1197   HD23  LEU 171          HD23      LEU 171  21.515  12.328  -1.190
 1198    H    ASN 172           H        ASN 172  16.669  11.134   2.290
 1199    HA   ASN 172           HA       ASN 172  15.256   9.909   3.564
 1200    HB2  ASN 172           HB2      ASN 172  14.523   9.100   0.766
 1201    HB3  ASN 172           HB3      ASN 172  13.672   8.424   2.144
 1202   HD21  ASN 172          HD21      ASN 172  13.999  11.053   0.054
 1203   HD22  ASN 172          HD22      ASN 172  12.851  12.106   0.800
 1204    H    TRP 173           H        TRP 173  17.122   8.751   4.526
 1205    HA   TRP 173           HA       TRP 173  17.590   6.070   3.498
 1206    HB2  TRP 173           HB2      TRP 173  18.906   7.845   5.532
 1207    HB3  TRP 173           HB3      TRP 173  19.124   6.103   5.652
 1208    HD1  TRP 173           HD1      TRP 173  19.965   9.084   3.370
 1209    HE1  TRP 173           HE1      TRP 173  21.963   8.434   1.895
 1210    HE3  TRP 173           HE3      TRP 173  20.346   4.149   4.654
 1211    HZ2  TRP 173           HZ2      TRP 173  23.505   6.137   1.346
 1212    HZ3  TRP 173           HZ3      TRP 173  22.114   2.796   3.607
 1213    HH2  TRP 173           HH2      TRP 173  23.658   3.771   1.989
 1214    H    LEU 174           H        LEU 174  15.670   5.066   3.939
 1215    HA   LEU 174           HA       LEU 174  14.038   5.517   6.153
 1216    HB2  LEU 174           HB2      LEU 174  14.255   2.989   4.528
 1217    HB3  LEU 174           HB3      LEU 174  12.938   3.401   5.603
 1218    HG   LEU 174           HG       LEU 174  13.623   4.637   2.950
 1219   HD11  LEU 174          HD11      LEU 174  11.239   3.215   4.109
 1220   HD12  LEU 174          HD12      LEU 174  11.230   4.039   2.543
 1221   HD13  LEU 174          HD13      LEU 174  12.302   2.664   2.813
 1222   HD21  LEU 174          HD21      LEU 174  11.685   5.673   5.022
 1223   HD22  LEU 174          HD22      LEU 174  13.124   6.498   4.427
 1224   HD23  LEU 174          HD23      LEU 174  11.756   6.220   3.344
 1225    H    ASP 175           H        ASP 175  14.154   5.002   8.154
 1226    HA   ASP 175           HA       ASP 175  16.411   3.708   9.299
 1227    HB2  ASP 175           HB2      ASP 175  13.842   4.302  10.756
 1228    HB3  ASP 175           HB3      ASP 175  15.484   4.322  11.386
 1229    H    HIS 176           H        HIS 176  14.090   2.261   7.711
 1230    HA   HIS 176           HA       HIS 176  13.026   0.295   7.675
 1231    HB2  HIS 176           HB2      HIS 176  15.124  -0.291   9.686
 1232    HB3  HIS 176           HB3      HIS 176  13.777  -1.422   9.539
 1233    HD1  HIS 176           HD1      HIS 176  13.333  -2.233   6.970
 1234    HD2  HIS 176           HD2      HIS 176  17.072  -0.710   7.867
 1235    HE1  HIS 176           HE1      HIS 176  14.779  -2.855   5.025
 1236    HE2  HIS 176           HE2      HIS 176  17.115  -2.239   5.784
 1237    H    GLY 177           H        GLY 177  12.308   2.574   9.532
 1238    HA2  GLY 177           HA2      GLY 177  10.191   1.124  10.965
 1239    HA3  GLY 177           HA3      GLY 177  11.227   2.215  11.879
 1240    H    ARG 178           H        ARG 178  10.466   2.907   8.608
 1241    HA   ARG 178           HA       ARG 178   8.813   5.166   9.504
 1242    HB2  ARG 178           HB2      ARG 178  11.096   5.613   8.440
 1243    HB3  ARG 178           HB3      ARG 178  10.404   5.004   6.943
 1244    HG2  ARG 178           HG2      ARG 178  10.244   7.341   6.824
 1245    HG3  ARG 178           HG3      ARG 178   8.618   6.766   7.204
 1246    HD2  ARG 178           HD2      ARG 178   9.280   8.738   8.547
 1247    HD3  ARG 178           HD3      ARG 178   8.930   7.320   9.539
 1248    HE   ARG 178           HE       ARG 178  11.564   7.097   9.225
 1249   HH11  ARG 178          HH11      ARG 178   9.603   9.842  10.157
 1250   HH12  ARG 178          HH12      ARG 178  10.883  10.602  11.056
 1251   HH21  ARG 178          HH21      ARG 178  13.234   8.072  10.418
 1252   HH22  ARG 178          HH22      ARG 178  12.937   9.592  11.215
 1253    H    THR 179           H        THR 179   6.731   5.069   8.891
 1254    HA   THR 179           HA       THR 179   5.923   3.172   6.868
 1255    HB   THR 179           HB       THR 179   4.439   3.384   8.718
 1256    HG1  THR 179           HG1      THR 179   3.517   3.172   6.550
 1257   HG21  THR 179          HG21      THR 179   4.162   6.308   8.028
 1258   HG22  THR 179          HG22      THR 179   5.042   5.662   9.414
 1259   HG23  THR 179          HG23      THR 179   3.292   5.455   9.304
 1260    H    LEU 180           H        LEU 180   4.939   3.661   4.918
 1261    HA   LEU 180           HA       LEU 180   6.555   5.540   3.551
 1262    HB2  LEU 180           HB2      LEU 180   4.230   3.993   2.450
 1263    HB3  LEU 180           HB3      LEU 180   5.640   4.582   1.583
 1264    HG   LEU 180           HG       LEU 180   5.782   2.524   3.779
 1265   HD11  LEU 180          HD11      LEU 180   5.698   2.124   0.800
 1266   HD12  LEU 180          HD12      LEU 180   6.101   0.881   1.987
 1267   HD13  LEU 180          HD13      LEU 180   4.492   1.603   1.978
 1268   HD21  LEU 180          HD21      LEU 180   8.009   2.123   2.913
 1269   HD22  LEU 180          HD22      LEU 180   7.779   3.373   1.690
 1270   HD23  LEU 180          HD23      LEU 180   7.824   3.809   3.400
 1271    H    ARG 181           H        ARG 181   3.126   5.509   4.386
 1272    HA   ARG 181           HA       ARG 181   2.563   7.815   2.766
 1273    HB2  ARG 181           HB2      ARG 181   0.920   6.413   4.871
 1274    HB3  ARG 181           HB3      ARG 181   0.335   7.758   3.897
 1275    HG2  ARG 181           HG2      ARG 181   0.739   6.412   1.869
 1276    HG3  ARG 181           HG3      ARG 181   1.220   5.060   2.895
 1277    HD2  ARG 181           HD2      ARG 181  -1.481   6.371   2.699
 1278    HD3  ARG 181           HD3      ARG 181  -1.055   4.713   2.278
 1279    HE   ARG 181           HE       ARG 181  -1.933   5.593   4.768
 1280   HH11  ARG 181          HH11      ARG 181   0.537   3.470   3.432
 1281   HH12  ARG 181          HH12      ARG 181   0.765   2.615   4.932
 1282   HH21  ARG 181          HH21      ARG 181  -1.624   4.462   6.710
 1283   HH22  ARG 181          HH22      ARG 181  -0.439   3.192   6.802
 1284    H    GLU 182           H        GLU 182   4.222   7.476   5.566
 1285    HA   GLU 182           HA       GLU 182   3.418  10.087   6.626
 1286    HB2  GLU 182           HB2      GLU 182   3.758   8.225   8.224
 1287    HB3  GLU 182           HB3      GLU 182   5.422   8.076   7.683
 1288    HG2  GLU 182           HG2      GLU 182   5.364   9.252   9.764
 1289    HG3  GLU 182           HG3      GLU 182   5.857  10.361   8.487
 1290    H    GLN 183           H        GLN 183   5.667   8.591   4.580
 1291    HA   GLN 183           HA       GLN 183   7.799  10.517   4.923
 1292    HB2  GLN 183           HB2      GLN 183   7.556   8.603   2.624
 1293    HB3  GLN 183           HB3      GLN 183   9.012   9.220   3.398
 1294    HG2  GLN 183           HG2      GLN 183   8.620   7.874   5.335
 1295    HG3  GLN 183           HG3      GLN 183   7.055   7.358   4.711
 1296   HE21  GLN 183          HE21      GLN 183   9.144   5.680   5.529
 1297   HE22  GLN 183          HE22      GLN 183   9.664   4.772   4.154
 1298    H    GLY 184           H        GLY 184   4.945  10.136   3.078
 1299    HA2  GLY 184           HA2      GLY 184   3.921  11.517   1.550
 1300    HA3  GLY 184           HA3      GLY 184   5.213  12.679   1.812
 1301    H    VAL 185           H        VAL 185   6.212   9.516   1.004
 1302    HA   VAL 185           HA       VAL 185   7.361  10.444  -1.455
 1303    HB   VAL 185           HB       VAL 185   8.266   8.152  -1.626
 1304   HG11  VAL 185          HG11      VAL 185   9.684   8.264   0.367
 1305   HG12  VAL 185          HG12      VAL 185   9.472   9.854  -0.365
 1306   HG13  VAL 185          HG13      VAL 185   8.573   9.427   1.091
 1307   HG21  VAL 185          HG21      VAL 185   6.384   6.942  -0.647
 1308   HG22  VAL 185          HG22      VAL 185   7.883   6.562   0.201
 1309   HG23  VAL 185          HG23      VAL 185   6.719   7.673   0.922
 1310    H    GLU 186           H        GLU 186   7.253   8.928  -3.398
 1311    HA   GLU 186           HA       GLU 186   4.423   8.319  -3.969
 1312    HB2  GLU 186           HB2      GLU 186   6.633   9.185  -5.852
 1313    HB3  GLU 186           HB3      GLU 186   4.997   8.776  -6.337
 1314    HG2  GLU 186           HG2      GLU 186   5.649  11.012  -4.442
 1315    HG3  GLU 186           HG3      GLU 186   5.509  11.217  -6.186
 1316    H    GLU 187           H        GLU 187   4.809   6.919  -6.331
 1317    HA   GLU 187           HA       GLU 187   6.632   4.730  -5.588
 1318    HB2  GLU 187           HB2      GLU 187   4.456   3.852  -7.297
 1319    HB3  GLU 187           HB3      GLU 187   5.044   3.166  -5.796
 1320    HG2  GLU 187           HG2      GLU 187   2.833   3.651  -5.348
 1321    HG3  GLU 187           HG3      GLU 187   3.691   5.022  -4.648
 1322    H    HIS 188           H        HIS 188   7.423   6.897  -7.198
 1323    HA   HIS 188           HA       HIS 188   7.909   5.438  -9.692
 1324    HB2  HIS 188           HB2      HIS 188   7.514   7.460 -11.071
 1325    HB3  HIS 188           HB3      HIS 188   6.061   6.834 -10.307
 1326    HD1  HIS 188           HD1      HIS 188   4.660   8.501  -9.146
 1327    HD2  HIS 188           HD2      HIS 188   8.578   9.824  -9.598
 1328    HE1  HIS 188           HE1      HIS 188   4.667  10.892  -8.375
 1329    HE2  HIS 188           HE2      HIS 188   6.989  11.734  -8.862
 1330    H    GLU 189           H        GLU 189   9.220   7.043  -7.164
 1331    HA   GLU 189           HA       GLU 189  11.465   8.190  -8.625
 1332    HB2  GLU 189           HB2      GLU 189  12.247   8.905  -6.406
 1333    HB3  GLU 189           HB3      GLU 189  10.587   9.414  -6.689
 1334    HG2  GLU 189           HG2      GLU 189  11.048   6.838  -5.292
 1335    HG3  GLU 189           HG3      GLU 189  11.349   8.332  -4.412
 1336    H    THR 190           H        THR 190  13.707   7.518  -8.050
 1337    HA   THR 190           HA       THR 190  13.821   4.641  -7.923
 1338    HB   THR 190           HB       THR 190  16.100   6.616  -8.155
 1339    HG1  THR 190           HG1      THR 190  14.342   6.481  -9.870
 1340   HG21  THR 190          HG21      THR 190  16.804   4.389  -7.404
 1341   HG22  THR 190          HG22      THR 190  17.348   4.706  -9.052
 1342   HG23  THR 190          HG23      THR 190  15.958   3.658  -8.768
 1343    H    LEU 191           H        LEU 191  14.115   3.478  -6.213
 1344    HA   LEU 191           HA       LEU 191  15.226   4.729  -3.783
 1345    HB2  LEU 191           HB2      LEU 191  13.562   2.203  -3.887
 1346    HB3  LEU 191           HB3      LEU 191  14.060   3.082  -2.459
 1347    HG   LEU 191           HG       LEU 191  11.888   3.741  -2.551
 1348   HD11  LEU 191          HD11      LEU 191  13.108   5.693  -4.485
 1349   HD12  LEU 191          HD12      LEU 191  11.643   5.944  -3.536
 1350   HD13  LEU 191          HD13      LEU 191  13.200   5.773  -2.726
 1351   HD21  LEU 191          HD21      LEU 191  10.565   4.021  -4.587
 1352   HD22  LEU 191          HD22      LEU 191  11.985   3.631  -5.558
 1353   HD23  LEU 191          HD23      LEU 191  11.289   2.415  -4.486
 1354    H    LEU 192           H        LEU 192  16.997   3.648  -2.768
 1355    HA   LEU 192           HA       LEU 192  18.177   1.606  -4.530
 1356    HB2  LEU 192           HB2      LEU 192  19.793   3.352  -2.721
 1357    HB3  LEU 192           HB3      LEU 192  20.273   2.557  -4.205
 1358    HG   LEU 192           HG       LEU 192  18.380   4.904  -4.112
 1359   HD11  LEU 192          HD11      LEU 192  20.574   5.541  -3.259
 1360   HD12  LEU 192          HD12      LEU 192  21.328   4.874  -4.709
 1361   HD13  LEU 192          HD13      LEU 192  20.249   6.266  -4.834
 1362   HD21  LEU 192          HD21      LEU 192  19.907   3.640  -6.384
 1363   HD22  LEU 192          HD22      LEU 192  18.170   3.508  -6.099
 1364   HD23  LEU 192          HD23      LEU 192  18.882   5.074  -6.488
 1365    H    LEU 193           H        LEU 193  18.766  -0.287  -3.629
 1366    HA   LEU 193           HA       LEU 193  18.400  -0.656  -0.780
 1367    HB2  LEU 193           HB2      LEU 193  17.620  -2.305  -2.499
 1368    HB3  LEU 193           HB3      LEU 193  19.294  -2.621  -2.899
 1369    HG   LEU 193           HG       LEU 193  18.406  -3.017  -0.073
 1370   HD11  LEU 193          HD11      LEU 193  17.932  -4.961  -2.330
 1371   HD12  LEU 193          HD12      LEU 193  17.717  -5.300  -0.613
 1372   HD13  LEU 193          HD13      LEU 193  16.683  -4.117  -1.414
 1373   HD21  LEU 193          HD21      LEU 193  20.066  -4.811  -0.177
 1374   HD22  LEU 193          HD22      LEU 193  20.345  -4.461  -1.882
 1375   HD23  LEU 193          HD23      LEU 193  20.769  -3.265  -0.655
 1376    H    ARG 194           H        ARG 194  20.030  -0.599   0.663
 1377    HA   ARG 194           HA       ARG 194  22.788  -0.550  -0.368
 1378    HB2  ARG 194           HB2      ARG 194  21.513   1.276   1.670
 1379    HB3  ARG 194           HB3      ARG 194  23.249   1.143   1.448
 1380    HG2  ARG 194           HG2      ARG 194  21.339   1.956  -0.725
 1381    HG3  ARG 194           HG3      ARG 194  22.199   3.090   0.317
 1382    HD2  ARG 194           HD2      ARG 194  23.418   1.097  -1.585
 1383    HD3  ARG 194           HD3      ARG 194  23.376   2.851  -1.773
 1384    HE   ARG 194           HE       ARG 194  24.680   1.967   0.647
 1385   HH11  ARG 194          HH11      ARG 194  25.090   2.680  -2.760
 1386   HH12  ARG 194          HH12      ARG 194  26.801   2.958  -2.621
 1387   HH21  ARG 194          HH21      ARG 194  26.924   2.339   0.831
 1388   HH22  ARG 194          HH22      ARG 194  27.844   2.779  -0.576
 1389    H    ARG 195           H        ARG 195  24.334  -1.499   0.904
 1390    HA   ARG 195           HA       ARG 195  23.358  -3.338   2.903
 1391    HB2  ARG 195           HB2      ARG 195  25.226  -3.746   1.160
 1392    HB3  ARG 195           HB3      ARG 195  26.255  -2.841   2.263
 1393    HG2  ARG 195           HG2      ARG 195  25.880  -4.449   4.010
 1394    HG3  ARG 195           HG3      ARG 195  24.711  -5.314   3.010
 1395    HD2  ARG 195           HD2      ARG 195  26.604  -5.607   1.336
 1396    HD3  ARG 195           HD3      ARG 195  27.681  -5.070   2.625
 1397    HE   ARG 195           HE       ARG 195  26.130  -7.109   3.686
 1398   HH11  ARG 195          HH11      ARG 195  28.457  -6.738   1.087
 1399   HH12  ARG 195          HH12      ARG 195  29.002  -8.387   1.181
 1400   HH21  ARG 195          HH21      ARG 195  26.815  -9.253   3.790
 1401   HH22  ARG 195          HH22      ARG 195  28.069  -9.827   2.719
 1402    H    LYS 196           H        LYS 196  23.358  -3.021   5.020
 1403    HA   LYS 196           HA       LYS 196  24.351  -0.472   6.030
 1404    HB2  LYS 196           HB2      LYS 196  22.035  -1.178   6.544
 1405    HB3  LYS 196           HB3      LYS 196  22.666  -2.584   7.389
 1406    HG2  LYS 196           HG2      LYS 196  23.778  -1.114   9.000
 1407    HG3  LYS 196           HG3      LYS 196  23.126   0.292   8.156
 1408    HD2  LYS 196           HD2      LYS 196  20.838  -0.581   8.600
 1409    HD3  LYS 196           HD3      LYS 196  21.562  -1.867   9.567
 1410    HE2  LYS 196           HE2      LYS 196  20.797  -0.069  10.999
 1411    HE3  LYS 196           HE3      LYS 196  22.556  -0.174  11.042
 1412    HZ1  LYS 196           HZ1      LYS 196  22.690   1.687   9.531
 1413    HZ2  LYS 196           HZ2      LYS 196  21.760   2.119  10.877
 1414    HZ3  LYS 196           HZ3      LYS 196  21.003   1.761   9.404
 1415    H    PHE 197           H        PHE 197  24.605  -3.940   6.739
 1416    HA   PHE 197           HA       PHE 197  26.859  -3.335   8.513
 1417    HB2  PHE 197           HB2      PHE 197  25.385  -5.957   8.239
 1418    HB3  PHE 197           HB3      PHE 197  26.589  -5.534   9.454
 1419    HD1  PHE 197           HD1      PHE 197  25.901  -3.168  10.655
 1420    HD2  PHE 197           HD2      PHE 197  23.238  -6.060   9.037
 1421    HE1  PHE 197           HE1      PHE 197  24.132  -2.359  12.155
 1422    HE2  PHE 197           HE2      PHE 197  21.454  -5.255  10.530
 1423    HZ   PHE 197           HZ       PHE 197  21.865  -3.438  12.069
 1424    H    PHE 198           H        PHE 198  28.824  -4.149   8.186
 1425    HA   PHE 198           HA       PHE 198  29.229  -5.838   5.810
 1426    HB2  PHE 198           HB2      PHE 198  31.079  -3.647   6.794
 1427    HB3  PHE 198           HB3      PHE 198  31.362  -4.694   5.409
 1428    HD1  PHE 198           HD1      PHE 198  30.093  -4.409   3.349
 1429    HD2  PHE 198           HD2      PHE 198  29.545  -1.803   6.667
 1430    HE1  PHE 198           HE1      PHE 198  28.936  -2.802   1.889
 1431    HE2  PHE 198           HE2      PHE 198  28.386  -0.191   5.213
 1432    HZ   PHE 198           HZ       PHE 198  28.081  -0.687   2.825
 1433    H    TYR 199           H        TYR 199  28.919  -7.471   7.467
 1434    HA   TYR 199           HA       TYR 199  30.781  -7.625   9.650
 1435    HB2  TYR 199           HB2      TYR 199  29.551  -9.802  10.102
 1436    HB3  TYR 199           HB3      TYR 199  28.583  -8.334  10.150
 1437    HD1  TYR 199           HD1      TYR 199  29.387 -11.324   8.107
 1438    HD2  TYR 199           HD2      TYR 199  26.757  -8.028   8.668
 1439    HE1  TYR 199           HE1      TYR 199  27.829 -12.292   6.473
 1440    HE2  TYR 199           HE2      TYR 199  25.195  -8.991   7.040
 1441    HH   TYR 199           HH       TYR 199  25.478 -12.195   5.882
 1442    H    SER 200           H        SER 200  31.460  -8.051   6.626
 1443    HA   SER 200           HA       SER 200  33.156  -9.074   5.526
 1444    HB2  SER 200           HB2      SER 200  34.292  -8.621   7.785
 1445    HB3  SER 200           HB3      SER 200  34.002 -10.320   8.143
 1446    HG   SER 200           HG       SER 200  35.194 -10.807   6.200
 1447    H    ASP 201           H        ASP 201  30.606 -10.300   5.786
 1448    HA   ASP 201           HA       ASP 201  29.512 -12.156   5.116
 1449    HB2  ASP 201           HB2      ASP 201  31.272 -12.254   3.400
 1450    HB3  ASP 201           HB3      ASP 201  32.268 -13.213   4.484
 1451    H    GLN 202           H        GLN 202  31.188 -12.005   7.851
 1452    HA   GLN 202           HA       GLN 202  30.794 -14.793   8.624
 1453    HB2  GLN 202           HB2      GLN 202  32.888 -13.764   9.335
 1454    HB3  GLN 202           HB3      GLN 202  32.005 -12.477  10.146
 1455    HG2  GLN 202           HG2      GLN 202  31.084 -14.045  11.728
 1456    HG3  GLN 202           HG3      GLN 202  31.834 -15.391  10.873
 1457   HE21  GLN 202          HE21      GLN 202  34.026 -15.733  11.065
 1458   HE22  GLN 202          HE22      GLN 202  34.975 -14.983  12.304
  Start of MODEL   13
    1    H1   GLY  -5           H1       GLY  -5 -26.303  -7.373  16.626
    2    H2   GLY  -5           H2       GLY  -5 -27.489  -8.274  17.439
    3    H3   GLY  -5           H3       GLY  -5 -27.784  -7.696  15.870
    4    HA2  GLY  -5           HA2      GLY  -5 -25.681  -9.669  16.561
    5    HA3  GLY  -5           HA3      GLY  -5 -27.263 -10.086  15.911
    6    H    ILE  -4           H        ILE  -4 -26.371 -10.996  14.019
    7    HA   ILE  -4           HA       ILE  -4 -24.854  -9.266  12.250
    8    HB   ILE  -4           HB       ILE  -4 -26.070 -11.952  11.569
    9   HG12  ILE  -4          HG12      ILE  -4 -23.294 -11.334  12.609
   10   HG13  ILE  -4          HG13      ILE  -4 -24.566 -12.140  13.521
   11   HG21  ILE  -4          HG21      ILE  -4 -25.420 -10.608   9.642
   12   HG22  ILE  -4          HG22      ILE  -4 -23.811 -10.381  10.326
   13   HG23  ILE  -4          HG23      ILE  -4 -24.337 -11.988   9.827
   14   HD11  ILE  -4          HD11      ILE  -4 -23.253 -13.182  11.021
   15   HD12  ILE  -4          HD12      ILE  -4 -22.946 -13.732  12.670
   16   HD13  ILE  -4          HD13      ILE  -4 -24.528 -13.992  11.932
   17    H    ASP  -3           H        ASP  -3 -26.473  -7.610  12.296
   18    HA   ASP  -3           HA       ASP  -3 -29.054  -8.174  11.093
   19    HB2  ASP  -3           HB2      ASP  -3 -27.878  -5.612  12.205
   20    HB3  ASP  -3           HB3      ASP  -3 -29.522  -5.778  11.596
   21    HA   PRO  -2           HA       PRO  -2 -27.783  -6.940   7.054
   22    HB2  PRO  -2           HB2      PRO  -2 -30.214  -6.535   5.946
   23    HB3  PRO  -2           HB3      PRO  -2 -29.601  -8.151   6.319
   24    HG2  PRO  -2           HG2      PRO  -2 -31.524  -6.452   7.859
   25    HG3  PRO  -2           HG3      PRO  -2 -31.587  -8.191   7.524
   26    HD2  PRO  -2           HD2      PRO  -2 -30.725  -7.155   9.892
   27    HD3  PRO  -2           HD3      PRO  -2 -30.143  -8.700   9.238
   28    H    PHE  -1           H        PHE  -1 -28.375  -5.163   5.427
   29    HA   PHE  -1           HA       PHE  -1 -28.033  -2.663   6.771
   30    HB2  PHE  -1           HB2      PHE  -1 -27.757  -1.742   4.461
   31    HB3  PHE  -1           HB3      PHE  -1 -26.632  -3.023   4.876
   32    HD1  PHE  -1           HD1      PHE  -1 -27.235  -5.394   4.062
   33    HD2  PHE  -1           HD2      PHE  -1 -28.979  -1.846   2.500
   34    HE1  PHE  -1           HE1      PHE  -1 -27.869  -6.610   2.018
   35    HE2  PHE  -1           HE2      PHE  -1 -29.614  -3.051   0.451
   36    HZ   PHE  -1           HZ       PHE  -1 -29.059  -5.437   0.209
   37    H    THR   0           H        THR   0 -30.248  -3.034   7.710
   38    HA   THR   0           HA       THR   0 -32.589  -2.470   6.294
   39    HB   THR   0           HB       THR   0 -33.397  -1.559   8.544
   40    HG1  THR   0           HG1      THR   0 -31.614  -2.654  10.098
   41   HG21  THR   0          HG21      THR   0 -33.831  -3.848   7.814
   42   HG22  THR   0          HG22      THR   0 -33.474  -3.804   9.540
   43   HG23  THR   0          HG23      THR   0 -32.244  -4.347   8.399
   44    H    MET   1           H        MET   1 -31.702  -0.136   8.635
   45    HA   MET   1           HA       MET   1 -31.516   1.909   6.538
   46    HB2  MET   1           HB2      MET   1 -33.447   2.161   8.143
   47    HB3  MET   1           HB3      MET   1 -32.271   2.377   9.430
   48    HG2  MET   1           HG2      MET   1 -33.150   4.507   8.709
   49    HG3  MET   1           HG3      MET   1 -31.433   4.393   8.338
   50    HE1  MET   1           HE1      MET   1 -31.233   4.454   4.536
   51    HE2  MET   1           HE2      MET   1 -30.453   4.919   6.048
   52    HE3  MET   1           HE3      MET   1 -30.815   3.223   5.727
   53    H    VAL   2           H        VAL   2 -29.553   0.165   7.367
   54    HA   VAL   2           HA       VAL   2 -27.527   2.050   8.300
   55    HB   VAL   2           HB       VAL   2 -26.356   0.098   9.436
   56   HG11  VAL   2          HG11      VAL   2 -28.975   1.050  10.590
   57   HG12  VAL   2          HG12      VAL   2 -27.655   0.320  11.505
   58   HG13  VAL   2          HG13      VAL   2 -27.421   1.875  10.706
   59   HG21  VAL   2          HG21      VAL   2 -29.108  -1.123   9.231
   60   HG22  VAL   2          HG22      VAL   2 -27.640  -1.715   8.449
   61   HG23  VAL   2          HG23      VAL   2 -27.777  -1.746  10.208
   62    H    ALA   3           H        ALA   3 -27.318   2.223   5.969
   63    HA   ALA   3           HA       ALA   3 -25.389   0.223   5.025
   64    HB1  ALA   3           HB1      ALA   3 -27.496  -0.119   3.801
   65    HB2  ALA   3           HB2      ALA   3 -27.483   1.573   3.311
   66    HB3  ALA   3           HB3      ALA   3 -26.224   0.480   2.738
   67    H    LEU   4           H        LEU   4 -23.653   1.047   3.950
   68    HA   LEU   4           HA       LEU   4 -23.343   3.957   4.251
   69    HB2  LEU   4           HB2      LEU   4 -21.474   1.665   4.606
   70    HB3  LEU   4           HB3      LEU   4 -20.815   3.170   4.003
   71    HG   LEU   4           HG       LEU   4 -21.465   4.339   6.004
   72   HD11  LEU   4          HD11      LEU   4 -23.593   3.205   6.418
   73   HD12  LEU   4          HD12      LEU   4 -22.711   1.778   6.962
   74   HD13  LEU   4          HD13      LEU   4 -22.580   3.292   7.859
   75   HD21  LEU   4          HD21      LEU   4 -20.234   1.694   6.712
   76   HD22  LEU   4          HD22      LEU   4 -19.373   3.084   6.045
   77   HD23  LEU   4          HD23      LEU   4 -20.114   3.189   7.642
   78    H    SER   5           H        SER   5 -23.002   5.137   2.499
   79    HA   SER   5           HA       SER   5 -22.936   3.727  -0.058
   80    HB2  SER   5           HB2      SER   5 -23.660   5.876  -1.029
   81    HB3  SER   5           HB3      SER   5 -24.732   5.364   0.272
   82    HG   SER   5           HG       SER   5 -23.070   7.553   0.111
   83    H    LEU   6           H        LEU   6 -20.895   3.277  -0.638
   84    HA   LEU   6           HA       LEU   6 -18.856   5.317  -0.051
   85    HB2  LEU   6           HB2      LEU   6 -18.427   2.340  -0.314
   86    HB3  LEU   6           HB3      LEU   6 -17.252   3.537   0.215
   87    HG   LEU   6           HG       LEU   6 -19.734   2.670   1.705
   88   HD11  LEU   6          HD11      LEU   6 -17.867   1.080   1.780
   89   HD12  LEU   6          HD12      LEU   6 -16.819   2.358   2.396
   90   HD13  LEU   6          HD13      LEU   6 -18.197   1.808   3.353
   91   HD21  LEU   6          HD21      LEU   6 -19.389   5.034   2.043
   92   HD22  LEU   6          HD22      LEU   6 -18.944   4.146   3.500
   93   HD23  LEU   6          HD23      LEU   6 -17.688   4.761   2.423
   94    H    LYS   7           H        LYS   7 -17.883   6.212  -1.703
   95    HA   LYS   7           HA       LYS   7 -18.270   5.277  -4.390
   96    HB2  LYS   7           HB2      LYS   7 -16.837   7.569  -3.116
   97    HB3  LYS   7           HB3      LYS   7 -16.421   7.127  -4.765
   98    HG2  LYS   7           HG2      LYS   7 -18.722   7.453  -5.457
   99    HG3  LYS   7           HG3      LYS   7 -19.179   7.838  -3.796
  100    HD2  LYS   7           HD2      LYS   7 -17.986   9.849  -3.812
  101    HD3  LYS   7           HD3      LYS   7 -17.036   9.376  -5.222
  102    HE2  LYS   7           HE2      LYS   7 -18.935   9.592  -6.655
  103    HE3  LYS   7           HE3      LYS   7 -20.008   9.854  -5.278
  104    HZ1  LYS   7           HZ1      LYS   7 -17.800  11.670  -6.097
  105    HZ2  LYS   7           HZ2      LYS   7 -18.883  11.925  -4.815
  106    HZ3  LYS   7           HZ3      LYS   7 -19.450  11.925  -6.414
  107    H    ILE   8           H        ILE   8 -17.224   3.522  -5.073
  108    HA   ILE   8           HA       ILE   8 -14.603   2.892  -3.959
  109    HB   ILE   8           HB       ILE   8 -16.281   1.273  -5.880
  110   HG12  ILE   8          HG12      ILE   8 -17.485   1.551  -3.780
  111   HG13  ILE   8          HG13      ILE   8 -16.878  -0.096  -3.906
  112   HG21  ILE   8          HG21      ILE   8 -13.916   0.724  -5.941
  113   HG22  ILE   8          HG22      ILE   8 -13.902   0.525  -4.189
  114   HG23  ILE   8          HG23      ILE   8 -14.837  -0.581  -5.194
  115   HD11  ILE   8          HD11      ILE   8 -16.606   0.769  -1.660
  116   HD12  ILE   8          HD12      ILE   8 -15.037   0.472  -2.408
  117   HD13  ILE   8          HD13      ILE   8 -15.654   2.118  -2.280
  118    H    SER   9           H        SER   9 -13.034   4.024  -4.953
  119    HA   SER   9           HA       SER   9 -13.146   4.267  -7.871
  120    HB2  SER   9           HB2      SER   9 -12.700   6.317  -6.477
  121    HB3  SER   9           HB3      SER   9 -11.180   5.580  -5.978
  122    HG   SER   9           HG       SER   9 -11.850   5.913  -8.705
  123    H    ILE  10           H        ILE  10 -11.854   3.091  -9.150
  124    HA   ILE  10           HA       ILE  10  -9.622   1.632  -7.898
  125    HB   ILE  10           HB       ILE  10 -11.392   0.535 -10.093
  126   HG12  ILE  10          HG12      ILE  10 -11.351  -0.242  -7.167
  127   HG13  ILE  10          HG13      ILE  10 -12.581   0.779  -7.902
  128   HG21  ILE  10          HG21      ILE  10  -9.112  -0.324 -10.107
  129   HG22  ILE  10          HG22      ILE  10  -9.250  -0.757  -8.404
  130   HG23  ILE  10          HG23      ILE  10 -10.245  -1.579  -9.605
  131   HD11  ILE  10          HD11      ILE  10 -12.003  -2.084  -8.618
  132   HD12  ILE  10          HD12      ILE  10 -13.361  -1.501  -7.657
  133   HD13  ILE  10          HD13      ILE  10 -13.234  -1.063  -9.361
  134    H    GLY  11           H        GLY  11  -8.014   2.952  -8.642
  135    HA2  GLY  11           HA2      GLY  11  -6.470   3.721 -10.171
  136    HA3  GLY  11           HA3      GLY  11  -7.286   2.768 -11.402
  137    H    ASN  12           H        ASN  12  -8.686   3.739 -12.784
  138    HA   ASN  12           HA       ASN  12  -8.926   6.657 -12.492
  139    HB2  ASN  12           HB2      ASN  12  -9.143   6.754 -14.929
  140    HB3  ASN  12           HB3      ASN  12  -7.650   5.954 -14.458
  141   HD21  ASN  12          HD21      ASN  12  -7.407   4.863 -16.354
  142   HD22  ASN  12          HD22      ASN  12  -8.446   3.578 -16.865
  143    H    VAL  13           H        VAL  13 -10.729   3.942 -12.081
  144    HA   VAL  13           HA       VAL  13 -13.183   5.160 -13.150
  145    HB   VAL  13           HB       VAL  13 -12.623   2.903 -14.000
  146   HG11  VAL  13          HG11      VAL  13 -12.867   0.952 -12.537
  147   HG12  VAL  13          HG12      VAL  13 -11.512   1.980 -12.072
  148   HG13  VAL  13          HG13      VAL  13 -13.014   2.029 -11.148
  149   HG21  VAL  13          HG21      VAL  13 -15.127   3.012 -12.327
  150   HG22  VAL  13          HG22      VAL  13 -14.943   3.595 -13.981
  151   HG23  VAL  13          HG23      VAL  13 -14.817   1.869 -13.635
  152    H    VAL  14           H        VAL  14 -15.126   5.027 -11.854
  153    HA   VAL  14           HA       VAL  14 -14.715   4.580  -8.996
  154    HB   VAL  14           HB       VAL  14 -14.469   6.981  -9.196
  155   HG11  VAL  14          HG11      VAL  14 -15.585   7.335 -11.322
  156   HG12  VAL  14          HG12      VAL  14 -17.145   6.982 -10.579
  157   HG13  VAL  14          HG13      VAL  14 -16.237   8.412 -10.087
  158   HG21  VAL  14          HG21      VAL  14 -15.615   6.235  -7.221
  159   HG22  VAL  14          HG22      VAL  14 -16.363   7.735  -7.771
  160   HG23  VAL  14          HG23      VAL  14 -17.154   6.187  -8.078
  161    H    LYS  15           H        LYS  15 -16.229   3.327  -8.205
  162    HA   LYS  15           HA       LYS  15 -18.819   3.182  -9.591
  163    HB2  LYS  15           HB2      LYS  15 -17.146   0.929  -8.476
  164    HB3  LYS  15           HB3      LYS  15 -18.849   0.749  -8.883
  165    HG2  LYS  15           HG2      LYS  15 -16.676   1.558 -10.806
  166    HG3  LYS  15           HG3      LYS  15 -17.377  -0.058 -10.665
  167    HD2  LYS  15           HD2      LYS  15 -19.564   0.821 -11.280
  168    HD3  LYS  15           HD3      LYS  15 -18.901   2.453 -11.365
  169    HE2  LYS  15           HE2      LYS  15 -19.156   1.411 -13.583
  170    HE3  LYS  15           HE3      LYS  15 -17.484   1.824 -13.214
  171    HZ1  LYS  15           HZ1      LYS  15 -16.948  -0.409 -12.823
  172    HZ2  LYS  15           HZ2      LYS  15 -17.890  -0.430 -14.236
  173    HZ3  LYS  15           HZ3      LYS  15 -18.576  -0.888 -12.755
  174    H    THR  16           H        THR  16 -20.622   2.805  -8.277
  175    HA   THR  16           HA       THR  16 -20.151   3.750  -5.538
  176    HB   THR  16           HB       THR  16 -22.676   3.843  -7.202
  177    HG1  THR  16           HG1      THR  16 -21.958   5.732  -7.824
  178   HG21  THR  16          HG21      THR  16 -23.176   3.625  -4.813
  179   HG22  THR  16          HG22      THR  16 -23.579   5.240  -5.397
  180   HG23  THR  16          HG23      THR  16 -22.107   4.982  -4.460
  181    H    MET  17           H        MET  17 -20.372   2.356  -3.921
  182    HA   MET  17           HA       MET  17 -22.242   0.127  -4.238
  183    HB2  MET  17           HB2      MET  17 -19.361  -0.035  -3.401
  184    HB3  MET  17           HB3      MET  17 -20.531  -1.200  -2.802
  185    HG2  MET  17           HG2      MET  17 -21.096  -1.688  -5.208
  186    HG3  MET  17           HG3      MET  17 -19.681  -0.726  -5.640
  187    HE1  MET  17           HE1      MET  17 -20.063  -2.959  -2.457
  188    HE2  MET  17           HE2      MET  17 -20.949  -3.891  -3.663
  189    HE3  MET  17           HE3      MET  17 -19.431  -4.512  -3.010
  190    H    GLN  18           H        GLN  18 -23.252  -0.512  -2.347
  191    HA   GLN  18           HA       GLN  18 -22.684   1.171  -0.006
  192    HB2  GLN  18           HB2      GLN  18 -25.228  -0.061  -1.009
  193    HB3  GLN  18           HB3      GLN  18 -25.046   0.370   0.691
  194    HG2  GLN  18           HG2      GLN  18 -24.891   2.629   0.242
  195    HG3  GLN  18           HG3      GLN  18 -24.425   2.364  -1.439
  196   HE21  GLN  18          HE21      GLN  18 -25.980   1.982  -2.963
  197   HE22  GLN  18          HE22      GLN  18 -27.665   2.227  -2.674
  198    H    PHE  19           H        PHE  19 -22.214   0.224   1.910
  199    HA   PHE  19           HA       PHE  19 -22.091  -2.711   1.944
  200    HB2  PHE  19           HB2      PHE  19 -20.063  -0.770   3.094
  201    HB3  PHE  19           HB3      PHE  19 -20.024  -2.516   3.291
  202    HD1  PHE  19           HD1      PHE  19 -19.410  -3.958   1.428
  203    HD2  PHE  19           HD2      PHE  19 -19.378   0.279   1.052
  204    HE1  PHE  19           HE1      PHE  19 -18.092  -4.159  -0.637
  205    HE2  PHE  19           HE2      PHE  19 -18.062   0.087  -1.017
  206    HZ   PHE  19           HZ       PHE  19 -17.305  -2.118  -1.792
  207    H    GLU  20           H        GLU  20 -22.228  -3.584   4.123
  208    HA   GLU  20           HA       GLU  20 -23.952  -2.013   5.826
  209    HB2  GLU  20           HB2      GLU  20 -22.767  -4.752   6.331
  210    HB3  GLU  20           HB3      GLU  20 -24.143  -4.025   7.151
  211    HG2  GLU  20           HG2      GLU  20 -25.474  -4.141   5.172
  212    HG3  GLU  20           HG3      GLU  20 -24.088  -4.653   4.211
  213    HA   PRO  21           HA       PRO  21 -20.880   0.000   8.223
  214    HB2  PRO  21           HB2      PRO  21 -22.139  -0.666  10.721
  215    HB3  PRO  21           HB3      PRO  21 -22.128   0.877   9.871
  216    HG2  PRO  21           HG2      PRO  21 -24.224  -1.139  10.005
  217    HG3  PRO  21           HG3      PRO  21 -24.315   0.540   9.445
  218    HD2  PRO  21           HD2      PRO  21 -24.487  -1.662   7.813
  219    HD3  PRO  21           HD3      PRO  21 -23.986  -0.047   7.277
  220    H    SER  22           H        SER  22 -22.003  -3.147   9.451
  221    HA   SER  22           HA       SER  22 -19.372  -3.582  10.660
  222    HB2  SER  22           HB2      SER  22 -21.930  -5.167  10.973
  223    HB3  SER  22           HB3      SER  22 -20.446  -5.393  11.897
  224    HG   SER  22           HG       SER  22 -20.815  -2.986  12.368
  225    H    THR  23           H        THR  23 -20.260  -3.890   7.690
  226    HA   THR  23           HA       THR  23 -20.116  -6.531   6.883
  227    HB   THR  23           HB       THR  23 -19.197  -3.987   5.577
  228    HG1  THR  23           HG1      THR  23 -21.366  -5.769   5.388
  229   HG21  THR  23          HG21      THR  23 -18.825  -5.218   3.492
  230   HG22  THR  23          HG22      THR  23 -19.046  -6.741   4.354
  231   HG23  THR  23          HG23      THR  23 -17.678  -5.698   4.742
  232    H    MET  24           H        MET  24 -17.436  -4.292   7.465
  233    HA   MET  24           HA       MET  24 -15.284  -4.640   8.122
  234    HB2  MET  24           HB2      MET  24 -16.472  -6.778   9.207
  235    HB3  MET  24           HB3      MET  24 -15.466  -7.607   8.032
  236    HG2  MET  24           HG2      MET  24 -13.498  -6.877   9.035
  237    HG3  MET  24           HG3      MET  24 -14.322  -5.596   9.927
  238    HE1  MET  24           HE1      MET  24 -13.300  -7.664  12.978
  239    HE2  MET  24           HE2      MET  24 -12.382  -7.082  11.590
  240    HE3  MET  24           HE3      MET  24 -13.594  -6.043  12.342
  241    H    VAL  25           H        VAL  25 -13.425  -4.757   7.028
  242    HA   VAL  25           HA       VAL  25 -13.338  -4.490   4.363
  243    HB   VAL  25           HB       VAL  25 -11.144  -5.565   6.111
  244   HG11  VAL  25          HG11      VAL  25 -10.674  -6.219   3.799
  245   HG12  VAL  25          HG12      VAL  25 -10.937  -4.557   3.272
  246   HG13  VAL  25          HG13      VAL  25  -9.579  -4.943   4.330
  247   HG21  VAL  25          HG21      VAL  25 -11.960  -3.334   6.639
  248   HG22  VAL  25          HG22      VAL  25 -10.330  -3.264   5.968
  249   HG23  VAL  25          HG23      VAL  25 -11.715  -2.841   4.964
  250    H    TYR  26           H        TYR  26 -12.584  -7.621   5.922
  251    HA   TYR  26           HA       TYR  26 -11.954  -8.987   3.587
  252    HB2  TYR  26           HB2      TYR  26 -12.274 -11.065   4.798
  253    HB3  TYR  26           HB3      TYR  26 -11.456  -9.887   5.811
  254    HD1  TYR  26           HD1      TYR  26 -14.586 -11.741   5.277
  255    HD2  TYR  26           HD2      TYR  26 -12.490  -9.052   7.820
  256    HE1  TYR  26           HE1      TYR  26 -16.238 -12.141   7.052
  257    HE2  TYR  26           HE2      TYR  26 -14.139  -9.443   9.597
  258    HH   TYR  26           HH       TYR  26 -16.368 -11.979   9.520
  259    H    ASP  27           H        ASP  27 -15.120  -8.403   4.987
  260    HA   ASP  27           HA       ASP  27 -16.444 -10.221   3.174
  261    HB2  ASP  27           HB2      ASP  27 -17.381  -9.834   5.406
  262    HB3  ASP  27           HB3      ASP  27 -17.616  -8.133   5.018
  263    H    ALA  28           H        ALA  28 -15.973  -6.726   3.446
  264    HA   ALA  28           HA       ALA  28 -17.485  -5.908   1.268
  265    HB1  ALA  28           HB1      ALA  28 -16.421  -4.363   2.843
  266    HB2  ALA  28           HB2      ALA  28 -14.840  -4.786   2.189
  267    HB3  ALA  28           HB3      ALA  28 -16.021  -3.959   1.173
  268    H    CYS  29           H        CYS  29 -14.104  -6.931   1.381
  269    HA   CYS  29           HA       CYS  29 -13.450  -6.652  -1.294
  270    HB2  CYS  29           HB2      CYS  29 -11.809  -7.097   0.468
  271    HB3  CYS  29           HB3      CYS  29 -12.442  -8.726   0.663
  272    HG   CYS  29           HG       CYS  29 -10.761  -7.494  -2.054
  273    H    ARG  30           H        ARG  30 -15.180  -9.299   0.270
  274    HA   ARG  30           HA       ARG  30 -14.844 -11.064  -1.969
  275    HB2  ARG  30           HB2      ARG  30 -16.252 -12.627  -0.817
  276    HB3  ARG  30           HB3      ARG  30 -15.149 -11.913   0.345
  277    HG2  ARG  30           HG2      ARG  30 -16.885 -11.456   1.632
  278    HG3  ARG  30           HG3      ARG  30 -17.472 -10.325   0.405
  279    HD2  ARG  30           HD2      ARG  30 -18.642 -12.190  -0.703
  280    HD3  ARG  30           HD3      ARG  30 -18.086 -13.279   0.567
  281    HE   ARG  30           HE       ARG  30 -19.372 -11.331   1.952
  282   HH11  ARG  30          HH11      ARG  30 -20.267 -13.343  -0.785
  283   HH12  ARG  30          HH12      ARG  30 -21.959 -13.364  -0.375
  284   HH21  ARG  30          HH21      ARG  30 -21.603 -11.348   2.473
  285   HH22  ARG  30          HH22      ARG  30 -22.716 -12.229   1.470
  286    H    MET  31           H        MET  31 -17.274  -8.773  -0.946
  287    HA   MET  31           HA       MET  31 -19.191  -9.589  -2.916
  288    HB2  MET  31           HB2      MET  31 -19.042  -7.080  -1.248
  289    HB3  MET  31           HB3      MET  31 -20.426  -7.600  -2.199
  290    HG2  MET  31           HG2      MET  31 -20.619  -9.600  -0.827
  291    HG3  MET  31           HG3      MET  31 -19.238  -9.078   0.127
  292    HE1  MET  31           HE1      MET  31 -19.141  -7.087   1.628
  293    HE2  MET  31           HE2      MET  31 -19.662  -5.960   0.373
  294    HE3  MET  31           HE3      MET  31 -20.459  -5.951   1.951
  295    H    ILE  32           H        ILE  32 -16.820  -6.956  -2.625
  296    HA   ILE  32           HA       ILE  32 -17.725  -5.578  -4.927
  297    HB   ILE  32           HB       ILE  32 -16.396  -4.434  -3.243
  298   HG12  ILE  32          HG12      ILE  32 -15.045  -4.546  -5.949
  299   HG13  ILE  32          HG13      ILE  32 -16.423  -3.538  -5.517
  300   HG21  ILE  32          HG21      ILE  32 -13.973  -4.792  -3.062
  301   HG22  ILE  32          HG22      ILE  32 -14.894  -6.219  -2.586
  302   HG23  ILE  32          HG23      ILE  32 -14.105  -6.165  -4.163
  303   HD11  ILE  32          HD11      ILE  32 -13.660  -3.340  -4.349
  304   HD12  ILE  32          HD12      ILE  32 -14.359  -2.264  -5.559
  305   HD13  ILE  32          HD13      ILE  32 -15.038  -2.320  -3.932
  306    H    ARG  33           H        ARG  33 -15.069  -7.886  -4.450
  307    HA   ARG  33           HA       ARG  33 -14.176  -8.022  -7.094
  308    HB2  ARG  33           HB2      ARG  33 -14.191 -10.084  -4.894
  309    HB3  ARG  33           HB3      ARG  33 -13.450 -10.379  -6.460
  310    HG2  ARG  33           HG2      ARG  33 -11.993  -8.411  -6.093
  311    HG3  ARG  33           HG3      ARG  33 -12.680  -8.253  -4.475
  312    HD2  ARG  33           HD2      ARG  33 -11.315 -10.741  -5.486
  313    HD3  ARG  33           HD3      ARG  33 -10.487  -9.468  -4.591
  314    HE   ARG  33           HE       ARG  33 -11.906  -9.987  -2.695
  315   HH11  ARG  33          HH11      ARG  33 -11.919 -12.320  -5.311
  316   HH12  ARG  33          HH12      ARG  33 -12.362 -13.655  -4.286
  317   HH21  ARG  33          HH21      ARG  33 -12.474 -11.749  -1.337
  318   HH22  ARG  33          HH22      ARG  33 -12.657 -13.329  -2.037
  319    H    GLU  34           H        GLU  34 -16.987  -9.261  -5.614
  320    HA   GLU  34           HA       GLU  34 -17.573 -11.357  -7.467
  321    HB2  GLU  34           HB2      GLU  34 -18.495 -11.291  -5.176
  322    HB3  GLU  34           HB3      GLU  34 -19.408  -9.843  -5.592
  323    HG2  GLU  34           HG2      GLU  34 -20.810 -11.821  -5.616
  324    HG3  GLU  34           HG3      GLU  34 -20.688 -11.098  -7.221
  325    H    ARG  35           H        ARG  35 -19.053  -8.179  -6.935
  326    HA   ARG  35           HA       ARG  35 -20.533  -8.383  -9.395
  327    HB2  ARG  35           HB2      ARG  35 -21.378  -6.095  -8.692
  328    HB3  ARG  35           HB3      ARG  35 -21.736  -7.440  -7.619
  329    HG2  ARG  35           HG2      ARG  35 -19.475  -6.624  -6.482
  330    HG3  ARG  35           HG3      ARG  35 -19.978  -5.097  -7.209
  331    HD2  ARG  35           HD2      ARG  35 -21.790  -6.795  -5.516
  332    HD3  ARG  35           HD3      ARG  35 -20.769  -5.524  -4.852
  333    HE   ARG  35           HE       ARG  35 -22.163  -4.281  -6.846
  334   HH11  ARG  35          HH11      ARG  35 -23.106  -6.200  -4.057
  335   HH12  ARG  35          HH12      ARG  35 -24.584  -5.315  -3.798
  336   HH21  ARG  35          HH21      ARG  35 -24.071  -3.107  -6.485
  337   HH22  ARG  35          HH22      ARG  35 -25.121  -3.533  -5.164
  338    H    ILE  36           H        ILE  36 -17.840  -6.369  -8.229
  339    HA   ILE  36           HA       ILE  36 -17.791  -5.044 -10.851
  340    HB   ILE  36           HB       ILE  36 -16.282  -4.243  -8.356
  341   HG12  ILE  36          HG12      ILE  36 -18.890  -3.173  -9.465
  342   HG13  ILE  36          HG13      ILE  36 -18.711  -4.114  -7.987
  343   HG21  ILE  36          HG21      ILE  36 -16.840  -2.773 -10.932
  344   HG22  ILE  36          HG22      ILE  36 -16.039  -2.088  -9.519
  345   HG23  ILE  36          HG23      ILE  36 -15.281  -3.410 -10.407
  346   HD11  ILE  36          HD11      ILE  36 -17.387  -2.317  -7.006
  347   HD12  ILE  36          HD12      ILE  36 -17.565  -1.378  -8.488
  348   HD13  ILE  36          HD13      ILE  36 -18.980  -1.753  -7.505
  349    HA   PRO  37           HA       PRO  37 -14.360  -7.892 -11.537
  350    HB2  PRO  37           HB2      PRO  37 -14.569  -7.130 -14.329
  351    HB3  PRO  37           HB3      PRO  37 -14.934  -8.682 -13.575
  352    HG2  PRO  37           HG2      PRO  37 -16.838  -7.051 -14.632
  353    HG3  PRO  37           HG3      PRO  37 -17.147  -8.173 -13.294
  354    HD2  PRO  37           HD2      PRO  37 -16.653  -5.219 -13.217
  355    HD3  PRO  37           HD3      PRO  37 -17.819  -6.192 -12.293
  356    H    GLU  38           H        GLU  38 -14.489  -4.606 -11.661
  357    HA   GLU  38           HA       GLU  38 -11.920  -4.158 -12.928
  358    HB2  GLU  38           HB2      GLU  38 -13.616  -2.226 -11.342
  359    HB3  GLU  38           HB3      GLU  38 -12.296  -1.823 -12.432
  360    HG2  GLU  38           HG2      GLU  38 -13.577  -2.656 -14.318
  361    HG3  GLU  38           HG3      GLU  38 -14.895  -3.105 -13.235
  362    H    ALA  39           H        ALA  39 -13.130  -4.989  -9.880
  363    HA   ALA  39           HA       ALA  39 -11.277  -3.644  -8.214
  364    HB1  ALA  39           HB1      ALA  39 -12.085  -5.114  -6.453
  365    HB2  ALA  39           HB2      ALA  39 -13.430  -4.484  -7.404
  366    HB3  ALA  39           HB3      ALA  39 -12.874  -6.140  -7.653
  367    H    LEU  40           H        LEU  40 -11.338  -6.889  -9.630
  368    HA   LEU  40           HA       LEU  40  -8.839  -7.488  -8.286
  369    HB2  LEU  40           HB2      LEU  40  -9.224  -9.802  -9.411
  370    HB3  LEU  40           HB3      LEU  40 -10.113  -9.339  -7.979
  371    HG   LEU  40           HG       LEU  40 -11.424 -10.547  -9.764
  372   HD11  LEU  40          HD11      LEU  40 -13.407  -9.152  -9.525
  373   HD12  LEU  40          HD12      LEU  40 -12.525  -9.298  -8.004
  374   HD13  LEU  40          HD13      LEU  40 -12.401  -7.819  -8.957
  375   HD21  LEU  40          HD21      LEU  40 -10.556  -9.532 -11.745
  376   HD22  LEU  40          HD22      LEU  40 -12.275  -9.151 -11.627
  377   HD23  LEU  40          HD23      LEU  40 -11.066  -7.933 -11.205
  378    H    ALA  41           H        ALA  41  -7.875  -5.779  -9.724
  379    HA   ALA  41           HA       ALA  41  -7.187  -6.593 -12.384
  380    HB1  ALA  41           HB1      ALA  41  -5.663  -4.677 -12.355
  381    HB2  ALA  41           HB2      ALA  41  -7.265  -4.227 -11.772
  382    HB3  ALA  41           HB3      ALA  41  -5.947  -4.473 -10.627
  383    H    GLY  42           H        GLY  42  -6.558  -8.146  -9.794
  384    HA2  GLY  42           HA2      GLY  42  -4.309  -9.541 -10.686
  385    HA3  GLY  42           HA3      GLY  42  -3.790  -8.391  -9.456
  386    HA   PRO  43           HA       PRO  43  -5.218 -12.169  -7.164
  387    HB2  PRO  43           HB2      PRO  43  -3.225 -12.086  -5.321
  388    HB3  PRO  43           HB3      PRO  43  -3.060 -12.904  -6.879
  389    HG2  PRO  43           HG2      PRO  43  -2.105 -10.191  -6.051
  390    HG3  PRO  43           HG3      PRO  43  -1.266 -11.432  -7.001
  391    HD2  PRO  43           HD2      PRO  43  -2.464  -9.292  -8.143
  392    HD3  PRO  43           HD3      PRO  43  -2.373 -10.874  -8.944
  393    HA   PRO  44           HA       PRO  44  -7.455  -9.595  -4.248
  394    HB2  PRO  44           HB2      PRO  44  -8.195 -11.683  -2.580
  395    HB3  PRO  44           HB3      PRO  44  -9.075 -11.176  -4.024
  396    HG2  PRO  44           HG2      PRO  44  -7.117 -13.407  -3.682
  397    HG3  PRO  44           HG3      PRO  44  -8.622 -13.367  -4.620
  398    HD2  PRO  44           HD2      PRO  44  -6.239 -13.150  -5.816
  399    HD3  PRO  44           HD3      PRO  44  -7.641 -12.213  -6.381
  400    H    ASN  45           H        ASN  45  -4.890 -11.783  -3.441
  401    HA   ASN  45           HA       ASN  45  -4.511 -11.087  -0.722
  402    HB2  ASN  45           HB2      ASN  45  -2.490 -12.044  -2.767
  403    HB3  ASN  45           HB3      ASN  45  -2.256 -12.043  -1.023
  404   HD21  ASN  45          HD21      ASN  45  -2.353 -14.179  -3.124
  405   HD22  ASN  45          HD22      ASN  45  -3.477 -15.345  -2.500
  406    H    ASP  46           H        ASP  46  -3.885  -9.476  -3.660
  407    HA   ASP  46           HA       ASP  46  -1.962  -7.638  -2.404
  408    HB2  ASP  46           HB2      ASP  46  -2.430  -8.495  -5.239
  409    HB3  ASP  46           HB3      ASP  46  -1.656  -6.952  -4.902
  410    H    PHE  47           H        PHE  47  -5.153  -7.760  -2.746
  411    HA   PHE  47           HA       PHE  47  -5.343  -4.922  -3.493
  412    HB2  PHE  47           HB2      PHE  47  -7.018  -7.226  -4.422
  413    HB3  PHE  47           HB3      PHE  47  -7.719  -5.611  -4.329
  414    HD1  PHE  47           HD1      PHE  47  -4.777  -7.417  -5.734
  415    HD2  PHE  47           HD2      PHE  47  -7.498  -4.172  -6.116
  416    HE1  PHE  47           HE1      PHE  47  -3.784  -6.846  -7.907
  417    HE2  PHE  47           HE2      PHE  47  -6.505  -3.591  -8.288
  418    HZ   PHE  47           HZ       PHE  47  -4.647  -4.930  -9.187
  419    H    GLY  48           H        GLY  48  -6.244  -3.661  -2.060
  420    HA2  GLY  48           HA2      GLY  48  -8.046  -4.836  -0.050
  421    HA3  GLY  48           HA3      GLY  48  -6.624  -3.959   0.487
  422    H    LEU  49           H        LEU  49  -8.353  -2.769   1.627
  423    HA   LEU  49           HA       LEU  49  -9.830  -0.902  -0.088
  424    HB2  LEU  49           HB2      LEU  49 -10.256  -1.538   2.832
  425    HB3  LEU  49           HB3      LEU  49 -11.278  -0.526   1.831
  426    HG   LEU  49           HG       LEU  49 -10.897  -3.509   1.569
  427   HD11  LEU  49          HD11      LEU  49 -13.282  -1.843   2.353
  428   HD12  LEU  49          HD12      LEU  49 -13.268  -3.595   2.151
  429   HD13  LEU  49          HD13      LEU  49 -12.314  -2.848   3.432
  430   HD21  LEU  49          HD21      LEU  49 -11.134  -2.492  -0.629
  431   HD22  LEU  49          HD22      LEU  49 -12.586  -3.392  -0.192
  432   HD23  LEU  49          HD23      LEU  49 -12.574  -1.631  -0.087
  433    H    PHE  50           H        PHE  50  -8.719   0.858  -0.398
  434    HA   PHE  50           HA       PHE  50  -7.307   2.150   1.825
  435    HB2  PHE  50           HB2      PHE  50  -6.133   1.963  -0.349
  436    HB3  PHE  50           HB3      PHE  50  -7.405   2.916  -1.106
  437    HD1  PHE  50           HD1      PHE  50  -4.734   3.029   1.454
  438    HD2  PHE  50           HD2      PHE  50  -7.332   5.258  -1.077
  439    HE1  PHE  50           HE1      PHE  50  -3.510   5.086   2.014
  440    HE2  PHE  50           HE2      PHE  50  -6.111   7.318  -0.521
  441    HZ   PHE  50           HZ       PHE  50  -4.195   7.234   1.026
  442    H    LEU  51           H        LEU  51  -8.143   3.884   2.869
  443    HA   LEU  51           HA       LEU  51 -10.754   4.817   1.949
  444    HB2  LEU  51           HB2      LEU  51 -10.336   4.083   4.340
  445    HB3  LEU  51           HB3      LEU  51  -9.361   5.525   4.530
  446    HG   LEU  51           HG       LEU  51 -11.811   5.554   5.354
  447   HD11  LEU  51          HD11      LEU  51 -12.068   7.913   4.791
  448   HD12  LEU  51          HD12      LEU  51 -10.411   7.543   5.274
  449   HD13  LEU  51          HD13      LEU  51 -10.805   7.763   3.568
  450   HD21  LEU  51          HD21      LEU  51 -13.448   6.232   3.671
  451   HD22  LEU  51          HD22      LEU  51 -12.244   5.991   2.403
  452   HD23  LEU  51          HD23      LEU  51 -12.817   4.616   3.348
  453    H    SER  52           H        SER  52 -10.866   6.517   0.730
  454    HA   SER  52           HA       SER  52  -8.605   8.224   0.322
  455    HB2  SER  52           HB2      SER  52 -11.414   8.528  -0.758
  456    HB3  SER  52           HB3      SER  52  -9.939   9.238  -1.414
  457    HG   SER  52           HG       SER  52  -9.681   7.478  -2.507
  458    H    ASP  53           H        ASP  53  -8.333   9.156   2.367
  459    HA   ASP  53           HA       ASP  53 -10.276  10.647   3.753
  460    HB2  ASP  53           HB2      ASP  53  -8.079   9.826   4.678
  461    HB3  ASP  53           HB3      ASP  53  -7.282  11.096   3.759
  462    H    ASP  54           H        ASP  54  -7.622  11.695   1.668
  463    HA   ASP  54           HA       ASP  54  -9.040  13.684   0.284
  464    HB2  ASP  54           HB2      ASP  54  -9.031  14.927   2.389
  465    HB3  ASP  54           HB3      ASP  54  -7.294  14.685   2.555
  466    H    ASP  55           H        ASP  55  -5.906  13.017   1.740
  467    HA   ASP  55           HA       ASP  55  -4.666  13.150  -0.927
  468    HB2  ASP  55           HB2      ASP  55  -3.835  14.942   0.502
  469    HB3  ASP  55           HB3      ASP  55  -3.490  13.795   1.791
  470    HA   PRO  56           HA       PRO  56  -3.759   8.822  -0.652
  471    HB2  PRO  56           HB2      PRO  56  -1.108   8.973  -1.580
  472    HB3  PRO  56           HB3      PRO  56  -2.554   8.716  -2.558
  473    HG2  PRO  56           HG2      PRO  56  -1.041  11.227  -2.031
  474    HG3  PRO  56           HG3      PRO  56  -1.889  10.708  -3.500
  475    HD2  PRO  56           HD2      PRO  56  -2.938  12.561  -1.890
  476    HD3  PRO  56           HD3      PRO  56  -3.969  11.342  -2.670
  477    H    LYS  57           H        LYS  57  -1.413  11.120   0.728
  478    HA   LYS  57           HA       LYS  57  -0.179   8.989   2.280
  479    HB2  LYS  57           HB2      LYS  57   0.363  11.933   2.625
  480    HB3  LYS  57           HB3      LYS  57   1.417  10.581   3.005
  481    HG2  LYS  57           HG2      LYS  57   0.686  11.616   0.297
  482    HG3  LYS  57           HG3      LYS  57   2.254  11.697   1.071
  483    HD2  LYS  57           HD2      LYS  57   0.896   9.104   0.361
  484    HD3  LYS  57           HD3      LYS  57   1.987   9.948  -0.737
  485    HE2  LYS  57           HE2      LYS  57   3.723   9.836   1.102
  486    HE3  LYS  57           HE3      LYS  57   2.615   8.760   1.955
  487    HZ1  LYS  57           HZ1      LYS  57   3.760   8.264  -0.746
  488    HZ2  LYS  57           HZ2      LYS  57   2.696   7.232   0.079
  489    HZ3  LYS  57           HZ3      LYS  57   4.245   7.514   0.692
  490    H    LYS  58           H        LYS  58  -2.598  11.437   2.652
  491    HA   LYS  58           HA       LYS  58  -2.612  11.282   5.549
  492    HB2  LYS  58           HB2      LYS  58  -4.475  12.689   3.630
  493    HB3  LYS  58           HB3      LYS  58  -4.492  12.865   5.380
  494    HG2  LYS  58           HG2      LYS  58  -2.328  13.894   5.359
  495    HG3  LYS  58           HG3      LYS  58  -2.144  13.568   3.633
  496    HD2  LYS  58           HD2      LYS  58  -2.765  15.881   3.974
  497    HD3  LYS  58           HD3      LYS  58  -4.074  15.011   3.174
  498    HE2  LYS  58           HE2      LYS  58  -4.994  16.450   4.878
  499    HE3  LYS  58           HE3      LYS  58  -5.203  14.766   5.358
  500    HZ1  LYS  58           HZ1      LYS  58  -3.127  16.641   6.362
  501    HZ2  LYS  58           HZ2      LYS  58  -3.220  15.000   6.771
  502    HZ3  LYS  58           HZ3      LYS  58  -4.463  16.058   7.227
  503    H    GLY  59           H        GLY  59  -3.851   9.494   3.015
  504    HA2  GLY  59           HA2      GLY  59  -6.376   8.750   4.139
  505    HA3  GLY  59           HA3      GLY  59  -5.541   7.940   2.819
  506    H    ILE  60           H        ILE  60  -6.612   6.132   4.194
  507    HA   ILE  60           HA       ILE  60  -4.505   5.075   5.935
  508    HB   ILE  60           HB       ILE  60  -6.318   4.135   7.443
  509   HG12  ILE  60          HG12      ILE  60  -7.946   6.325   6.136
  510   HG13  ILE  60          HG13      ILE  60  -8.206   4.599   5.913
  511   HG21  ILE  60          HG21      ILE  60  -4.839   5.922   8.163
  512   HG22  ILE  60          HG22      ILE  60  -5.894   7.120   7.415
  513   HG23  ILE  60          HG23      ILE  60  -6.466   6.179   8.792
  514   HD11  ILE  60          HD11      ILE  60  -8.466   6.095   8.508
  515   HD12  ILE  60          HD12      ILE  60  -9.794   5.555   7.480
  516   HD13  ILE  60          HD13      ILE  60  -8.755   4.371   8.269
  517    H    TRP  61           H        TRP  61  -4.338   2.840   5.971
  518    HA   TRP  61           HA       TRP  61  -5.742   1.439   3.834
  519    HB2  TRP  61           HB2      TRP  61  -3.382   0.738   5.576
  520    HB3  TRP  61           HB3      TRP  61  -4.184  -0.472   4.582
  521    HD1  TRP  61           HD1      TRP  61  -1.577   2.188   4.422
  522    HE1  TRP  61           HE1      TRP  61  -0.712   2.438   2.000
  523    HE3  TRP  61           HE3      TRP  61  -5.136  -0.580   2.029
  524    HZ2  TRP  61           HZ2      TRP  61  -1.464   1.562  -0.573
  525    HZ3  TRP  61           HZ3      TRP  61  -4.993  -0.828  -0.414
  526    HH2  TRP  61           HH2      TRP  61  -3.195   0.222  -1.684
  527    H    LEU  62           H        LEU  62  -7.506   0.297   4.226
  528    HA   LEU  62           HA       LEU  62  -8.394  -0.079   6.946
  529    HB2  LEU  62           HB2      LEU  62  -9.685  -0.965   4.366
  530    HB3  LEU  62           HB3      LEU  62 -10.450  -0.899   5.941
  531    HG   LEU  62           HG       LEU  62  -9.467   1.497   4.386
  532   HD11  LEU  62          HD11      LEU  62 -11.834   2.011   4.109
  533   HD12  LEU  62          HD12      LEU  62 -11.422   0.466   3.365
  534   HD13  LEU  62          HD13      LEU  62 -12.260   0.502   4.916
  535   HD21  LEU  62          HD21      LEU  62 -10.631   2.794   6.087
  536   HD22  LEU  62          HD22      LEU  62 -11.020   1.308   6.958
  537   HD23  LEU  62          HD23      LEU  62  -9.340   1.822   6.796
  538    H    GLU  63           H        GLU  63  -7.470  -1.711   8.054
  539    HA   GLU  63           HA       GLU  63  -6.572  -4.104   6.782
  540    HB2  GLU  63           HB2      GLU  63  -6.061  -4.857   9.079
  541    HB3  GLU  63           HB3      GLU  63  -5.416  -3.257   8.748
  542    HG2  GLU  63           HG2      GLU  63  -7.271  -2.247   9.965
  543    HG3  GLU  63           HG3      GLU  63  -7.941  -3.847  10.281
  544    H    ALA  64           H        ALA  64  -7.335  -6.253   7.255
  545    HA   ALA  64           HA       ALA  64 -10.149  -6.495   7.003
  546    HB1  ALA  64           HB1      ALA  64  -8.107  -8.629   7.596
  547    HB2  ALA  64           HB2      ALA  64  -9.757  -8.895   7.032
  548    HB3  ALA  64           HB3      ALA  64  -8.590  -8.081   5.991
  549    H    GLY  65           H        GLY  65  -8.080  -6.279   9.695
  550    HA2  GLY  65           HA2      GLY  65  -9.736  -7.790  11.510
  551    HA3  GLY  65           HA3      GLY  65  -8.287  -6.890  11.918
  552    H    LYS  66           H        LYS  66 -10.708  -5.123  10.183
  553    HA   LYS  66           HA       LYS  66 -12.170  -4.407  12.564
  554    HB2  LYS  66           HB2      LYS  66 -11.466  -2.291  12.908
  555    HB3  LYS  66           HB3      LYS  66  -9.993  -2.858  12.138
  556    HG2  LYS  66           HG2      LYS  66 -12.223  -1.552  10.610
  557    HG3  LYS  66           HG3      LYS  66 -10.918  -0.639  11.364
  558    HD2  LYS  66           HD2      LYS  66  -9.309  -1.534   9.940
  559    HD3  LYS  66           HD3      LYS  66 -10.333  -2.900   9.490
  560    HE2  LYS  66           HE2      LYS  66 -10.854  -0.020   8.741
  561    HE3  LYS  66           HE3      LYS  66 -10.130  -1.228   7.683
  562    HZ1  LYS  66           HZ1      LYS  66 -12.183  -2.542   7.966
  563    HZ2  LYS  66           HZ2      LYS  66 -12.430  -1.060   7.187
  564    HZ3  LYS  66           HZ3      LYS  66 -12.868  -1.244   8.814
  565    H    ALA  67           H        ALA  67 -14.066  -3.118  12.102
  566    HA   ALA  67           HA       ALA  67 -15.160  -3.855   9.526
  567    HB1  ALA  67           HB1      ALA  67 -17.278  -3.122  10.433
  568    HB2  ALA  67           HB2      ALA  67 -16.445  -4.137  11.614
  569    HB3  ALA  67           HB3      ALA  67 -16.464  -2.384  11.815
  570    H    LEU  68           H        LEU  68 -16.700  -2.006   8.569
  571    HA   LEU  68           HA       LEU  68 -14.789  -0.050   7.671
  572    HB2  LEU  68           HB2      LEU  68 -17.697  -0.401   6.957
  573    HB3  LEU  68           HB3      LEU  68 -16.567   0.672   6.157
  574    HG   LEU  68           HG       LEU  68 -16.339  -2.336   6.230
  575   HD11  LEU  68          HD11      LEU  68 -16.923  -2.222   3.860
  576   HD12  LEU  68          HD12      LEU  68 -18.226  -1.606   4.878
  577   HD13  LEU  68          HD13      LEU  68 -17.180  -0.484   4.007
  578   HD21  LEU  68          HD21      LEU  68 -14.180  -1.227   6.101
  579   HD22  LEU  68          HD22      LEU  68 -14.579  -1.995   4.565
  580   HD23  LEU  68          HD23      LEU  68 -14.749  -0.249   4.750
  581    H    ASP  69           H        ASP  69 -18.004   0.128   9.139
  582    HA   ASP  69           HA       ASP  69 -18.041   2.928   9.472
  583    HB2  ASP  69           HB2      ASP  69 -20.107   1.703   9.358
  584    HB3  ASP  69           HB3      ASP  69 -19.649   0.688  10.717
  585    H    TYR  70           H        TYR  70 -16.468   0.478  11.140
  586    HA   TYR  70           HA       TYR  70 -16.182   1.346  13.722
  587    HB2  TYR  70           HB2      TYR  70 -15.194  -0.715  12.812
  588    HB3  TYR  70           HB3      TYR  70 -14.081   0.241  11.840
  589    HD1  TYR  70           HD1      TYR  70 -15.120  -0.059  15.395
  590    HD2  TYR  70           HD2      TYR  70 -11.955   0.436  12.616
  591    HE1  TYR  70           HE1      TYR  70 -13.508  -0.077  17.248
  592    HE2  TYR  70           HE2      TYR  70 -10.321   0.423  14.453
  593    HH   TYR  70           HH       TYR  70 -11.115  -0.577  17.603
  594    H    TYR  71           H        TYR  71 -14.568   2.488  10.791
  595    HA   TYR  71           HA       TYR  71 -13.147   4.580  12.179
  596    HB2  TYR  71           HB2      TYR  71 -13.377   3.747   9.307
  597    HB3  TYR  71           HB3      TYR  71 -12.666   5.301   9.733
  598    HD1  TYR  71           HD1      TYR  71 -12.286   1.664   9.962
  599    HD2  TYR  71           HD2      TYR  71 -10.524   5.435  10.813
  600    HE1  TYR  71           HE1      TYR  71 -10.155   0.559  10.430
  601    HE2  TYR  71           HE2      TYR  71  -8.378   4.334  11.283
  602    HH   TYR  71           HH       TYR  71  -7.746   1.110  10.447
  603    H    MET  72           H        MET  72 -13.443   6.573  10.157
  604    HA   MET  72           HA       MET  72 -15.882   7.800  11.171
  605    HB2  MET  72           HB2      MET  72 -13.664   9.047   9.563
  606    HB3  MET  72           HB3      MET  72 -14.903   9.885  10.488
  607    HG2  MET  72           HG2      MET  72 -13.076  10.048  11.866
  608    HG3  MET  72           HG3      MET  72 -13.893   8.629  12.508
  609    HE1  MET  72           HE1      MET  72 -10.209   8.371   9.733
  610    HE2  MET  72           HE2      MET  72 -11.822   8.804   9.168
  611    HE3  MET  72           HE3      MET  72 -10.937   9.896  10.233
  612    H    LEU  73           H        LEU  73 -15.750   5.794   8.832
  613    HA   LEU  73           HA       LEU  73 -16.600   7.605   6.687
  614    HB2  LEU  73           HB2      LEU  73 -16.291   5.575   5.205
  615    HB3  LEU  73           HB3      LEU  73 -14.847   6.318   5.858
  616    HG   LEU  73           HG       LEU  73 -15.011   4.479   7.686
  617   HD11  LEU  73          HD11      LEU  73 -16.004   2.409   6.932
  618   HD12  LEU  73          HD12      LEU  73 -17.227   3.674   7.074
  619   HD13  LEU  73          HD13      LEU  73 -16.620   3.209   5.483
  620   HD21  LEU  73          HD21      LEU  73 -13.230   4.611   6.076
  621   HD22  LEU  73          HD22      LEU  73 -13.757   2.937   6.247
  622   HD23  LEU  73          HD23      LEU  73 -14.255   3.881   4.841
  623    H    ARG  74           H        ARG  74 -18.505   7.516   5.769
  624    HA   ARG  74           HA       ARG  74 -20.428   5.436   6.428
  625    HB2  ARG  74           HB2      ARG  74 -21.215   8.305   6.927
  626    HB3  ARG  74           HB3      ARG  74 -22.053   6.841   7.419
  627    HG2  ARG  74           HG2      ARG  74 -21.131   7.075   9.414
  628    HG3  ARG  74           HG3      ARG  74 -19.549   6.786   8.679
  629    HD2  ARG  74           HD2      ARG  74 -20.938   9.426   9.059
  630    HD3  ARG  74           HD3      ARG  74 -19.465   8.874   9.841
  631    HE   ARG  74           HE       ARG  74 -18.528   8.855   7.471
  632   HH11  ARG  74          HH11      ARG  74 -20.937  11.124   8.614
  633   HH12  ARG  74          HH12      ARG  74 -20.549  12.332   7.424
  634   HH21  ARG  74          HH21      ARG  74 -18.028  10.405   5.892
  635   HH22  ARG  74          HH22      ARG  74 -18.888  11.922   5.870
  636    H    ASN  75           H        ASN  75 -22.583   7.333   5.569
  637    HA   ASN  75           HA       ASN  75 -22.490   6.851   2.782
  638    HB2  ASN  75           HB2      ASN  75 -24.247   8.620   4.479
  639    HB3  ASN  75           HB3      ASN  75 -24.415   8.553   2.730
  640   HD21  ASN  75          HD21      ASN  75 -23.577   5.862   4.809
  641   HD22  ASN  75          HD22      ASN  75 -25.022   4.949   4.525
  642    H    GLY  76           H        GLY  76 -20.923   7.758   1.567
  643    HA2  GLY  76           HA2      GLY  76 -20.853   9.865   0.206
  644    HA3  GLY  76           HA3      GLY  76 -20.697  10.702   1.740
  645    H    ASP  77           H        ASP  77 -18.892   8.288   2.569
  646    HA   ASP  77           HA       ASP  77 -16.480   9.676   1.870
  647    HB2  ASP  77           HB2      ASP  77 -17.028   7.200   3.497
  648    HB3  ASP  77           HB3      ASP  77 -15.391   7.746   3.148
  649    H    THR  78           H        THR  78 -14.897   9.088   0.498
  650    HA   THR  78           HA       THR  78 -15.588   7.087  -1.500
  651    HB   THR  78           HB       THR  78 -13.220   8.974  -1.395
  652    HG1  THR  78           HG1      THR  78 -15.506   9.833  -1.551
  653   HG21  THR  78          HG21      THR  78 -14.382   7.384  -3.688
  654   HG22  THR  78          HG22      THR  78 -12.858   7.047  -2.866
  655   HG23  THR  78          HG23      THR  78 -13.048   8.530  -3.801
  656    H    MET  79           H        MET  79 -14.591   5.135  -1.693
  657    HA   MET  79           HA       MET  79 -12.258   4.651   0.019
  658    HB2  MET  79           HB2      MET  79 -14.448   3.647   0.901
  659    HB3  MET  79           HB3      MET  79 -14.384   2.572  -0.488
  660    HG2  MET  79           HG2      MET  79 -12.214   1.736   0.259
  661    HG3  MET  79           HG3      MET  79 -12.284   2.809   1.655
  662    HE1  MET  79           HE1      MET  79 -14.898  -0.910   0.961
  663    HE2  MET  79           HE2      MET  79 -15.021   0.510  -0.081
  664    HE3  MET  79           HE3      MET  79 -13.520  -0.420  -0.033
  665    H    GLU  80           H        GLU  80 -10.654   4.313  -1.278
  666    HA   GLU  80           HA       GLU  80 -11.067   3.539  -4.028
  667    HB2  GLU  80           HB2      GLU  80  -9.317   5.209  -2.910
  668    HB3  GLU  80           HB3      GLU  80  -8.356   3.744  -2.791
  669    HG2  GLU  80           HG2      GLU  80  -8.635   3.418  -5.228
  670    HG3  GLU  80           HG3      GLU  80  -9.460   4.974  -5.299
  671    H    TYR  81           H        TYR  81 -11.001   1.427  -4.746
  672    HA   TYR  81           HA       TYR  81  -9.785  -0.546  -2.975
  673    HB2  TYR  81           HB2      TYR  81 -12.090  -0.936  -3.977
  674    HB3  TYR  81           HB3      TYR  81 -11.302  -1.047  -5.549
  675    HD1  TYR  81           HD1      TYR  81  -9.835  -2.932  -6.072
  676    HD2  TYR  81           HD2      TYR  81 -11.910  -2.743  -2.366
  677    HE1  TYR  81           HE1      TYR  81  -9.395  -5.322  -5.714
  678    HE2  TYR  81           HE2      TYR  81 -11.470  -5.137  -1.995
  679    HH   TYR  81           HH       TYR  81 -10.986  -7.157  -3.409
  680    H    ARG  82           H        ARG  82  -7.702  -0.750  -3.280
  681    HA   ARG  82           HA       ARG  82  -6.680  -0.697  -6.023
  682    HB2  ARG  82           HB2      ARG  82  -4.733   0.682  -5.281
  683    HB3  ARG  82           HB3      ARG  82  -6.265   1.541  -5.302
  684    HG2  ARG  82           HG2      ARG  82  -6.427   1.517  -2.952
  685    HG3  ARG  82           HG3      ARG  82  -5.141   0.318  -2.803
  686    HD2  ARG  82           HD2      ARG  82  -4.666   3.029  -4.007
  687    HD3  ARG  82           HD3      ARG  82  -4.551   2.745  -2.272
  688    HE   ARG  82           HE       ARG  82  -2.952   0.822  -3.354
  689   HH11  ARG  82          HH11      ARG  82  -3.119   4.300  -3.743
  690   HH12  ARG  82          HH12      ARG  82  -1.392   4.490  -3.895
  691   HH21  ARG  82          HH21      ARG  82  -0.671   1.072  -3.556
  692   HH22  ARG  82          HH22      ARG  82  -0.017   2.664  -3.794
  693    H    LYS  83           H        LYS  83  -4.390  -1.380  -6.122
  694    HA   LYS  83           HA       LYS  83  -3.911  -3.787  -4.740
  695    HB2  LYS  83           HB2      LYS  83  -2.982  -3.060  -6.996
  696    HB3  LYS  83           HB3      LYS  83  -1.863  -2.033  -6.115
  697    HG2  LYS  83           HG2      LYS  83  -0.826  -3.939  -5.097
  698    HG3  LYS  83           HG3      LYS  83  -2.035  -5.023  -5.794
  699    HD2  LYS  83           HD2      LYS  83  -1.264  -4.351  -8.050
  700    HD3  LYS  83           HD3      LYS  83  -0.010  -3.365  -7.299
  701    HE2  LYS  83           HE2      LYS  83   1.002  -5.416  -7.947
  702    HE3  LYS  83           HE3      LYS  83   0.837  -5.450  -6.194
  703    HZ1  LYS  83           HZ1      LYS  83  -1.088  -6.852  -6.413
  704    HZ2  LYS  83           HZ2      LYS  83   0.207  -7.556  -7.246
  705    HZ3  LYS  83           HZ3      LYS  83  -1.023  -6.761  -8.104
  706    H    LYS  84           H        LYS  84  -3.062  -4.110  -2.777
  707    HA   LYS  84           HA       LYS  84  -2.711  -2.105  -0.873
  708    HB2  LYS  84           HB2      LYS  84  -1.473  -4.860  -0.974
  709    HB3  LYS  84           HB3      LYS  84  -1.468  -3.822   0.439
  710    HG2  LYS  84           HG2      LYS  84  -4.017  -4.698  -0.857
  711    HG3  LYS  84           HG3      LYS  84  -3.164  -5.695   0.323
  712    HD2  LYS  84           HD2      LYS  84  -3.193  -3.458   1.717
  713    HD3  LYS  84           HD3      LYS  84  -4.596  -3.121   0.697
  714    HE2  LYS  84           HE2      LYS  84  -5.312  -4.209   2.739
  715    HE3  LYS  84           HE3      LYS  84  -5.571  -5.280   1.363
  716    HZ1  LYS  84           HZ1      LYS  84  -3.525  -5.462   3.479
  717    HZ2  LYS  84           HZ2      LYS  84  -3.287  -6.225   1.988
  718    HZ3  LYS  84           HZ3      LYS  84  -4.617  -6.648   2.950
  719    H    GLN  85           H        GLN  85  -0.496  -3.530  -3.159
  720    HA   GLN  85           HA       GLN  85   1.882  -2.690  -1.924
  721    HB2  GLN  85           HB2      GLN  85   1.670  -3.259  -4.819
  722    HB3  GLN  85           HB3      GLN  85   2.906  -3.742  -3.665
  723    HG2  GLN  85           HG2      GLN  85   0.143  -4.878  -3.935
  724    HG3  GLN  85           HG3      GLN  85   1.646  -5.620  -4.351
  725   HE21  GLN  85          HE21      GLN  85   3.085  -6.278  -2.640
  726   HE22  GLN  85          HE22      GLN  85   2.438  -6.615  -1.077
  727    H    ARG  86           H        ARG  86   3.214  -1.817  -4.241
  728    HA   ARG  86           HA       ARG  86   2.272   0.454  -5.445
  729    HB2  ARG  86           HB2      ARG  86   3.754   2.143  -4.128
  730    HB3  ARG  86           HB3      ARG  86   2.140   1.776  -3.555
  731    HG2  ARG  86           HG2      ARG  86   3.394   1.766  -1.625
  732    HG3  ARG  86           HG3      ARG  86   3.305   0.055  -2.036
  733    HD2  ARG  86           HD2      ARG  86   5.556   0.927  -1.299
  734    HD3  ARG  86           HD3      ARG  86   5.526   0.021  -2.811
  735    HE   ARG  86           HE       ARG  86   6.458   1.850  -3.749
  736   HH11  ARG  86          HH11      ARG  86   4.383   3.041  -1.158
  737   HH12  ARG  86          HH12      ARG  86   4.691   4.713  -1.540
  738   HH21  ARG  86          HH21      ARG  86   6.915   4.049  -4.160
  739   HH22  ARG  86          HH22      ARG  86   6.137   5.284  -3.210
  740    HA   PRO  87           HA       PRO  87   5.696  -0.708  -7.785
  741    HB2  PRO  87           HB2      PRO  87   6.156   1.571  -9.223
  742    HB3  PRO  87           HB3      PRO  87   4.824   0.456  -9.544
  743    HG2  PRO  87           HG2      PRO  87   4.815   3.039  -8.041
  744    HG3  PRO  87           HG3      PRO  87   3.622   2.406  -9.190
  745    HD2  PRO  87           HD2      PRO  87   3.241   2.306  -6.523
  746    HD3  PRO  87           HD3      PRO  87   2.638   1.041  -7.612
  747    H    LEU  88           H        LEU  88   7.478  -1.057  -6.611
  748    HA   LEU  88           HA       LEU  88   8.999   1.250  -5.637
  749    HB2  LEU  88           HB2      LEU  88   8.938  -1.642  -4.854
  750    HB3  LEU  88           HB3      LEU  88  10.322  -0.639  -4.455
  751    HG   LEU  88           HG       LEU  88   7.483  -0.054  -3.607
  752   HD11  LEU  88          HD11      LEU  88   8.336  -2.060  -2.522
  753   HD12  LEU  88          HD12      LEU  88   9.791  -1.189  -2.039
  754   HD13  LEU  88          HD13      LEU  88   8.223  -0.721  -1.380
  755   HD21  LEU  88          HD21      LEU  88   8.544   1.592  -2.138
  756   HD22  LEU  88          HD22      LEU  88  10.114   1.203  -2.843
  757   HD23  LEU  88          HD23      LEU  88   8.860   1.939  -3.839
  758    H    LYS  89           H        LYS  89  10.498   1.951  -6.951
  759    HA   LYS  89           HA       LYS  89  11.895   0.144  -8.753
  760    HB2  LYS  89           HB2      LYS  89  11.878   3.127  -8.354
  761    HB3  LYS  89           HB3      LYS  89  13.198   2.367  -9.230
  762    HG2  LYS  89           HG2      LYS  89  11.571   3.174 -10.791
  763    HG3  LYS  89           HG3      LYS  89  11.559   1.412 -10.807
  764    HD2  LYS  89           HD2      LYS  89   9.295   2.160 -10.864
  765    HD3  LYS  89           HD3      LYS  89   9.599   1.488  -9.263
  766    HE2  LYS  89           HE2      LYS  89   9.849   3.705  -8.334
  767    HE3  LYS  89           HE3      LYS  89   9.687   4.427  -9.936
  768    HZ1  LYS  89           HZ1      LYS  89   7.602   2.964  -8.413
  769    HZ2  LYS  89           HZ2      LYS  89   7.432   3.426 -10.033
  770    HZ3  LYS  89           HZ3      LYS  89   7.603   4.604  -8.829
  771    H    ILE  90           H        ILE  90  13.594  -0.949  -8.016
  772    HA   ILE  90           HA       ILE  90  14.999   0.132  -5.660
  773    HB   ILE  90           HB       ILE  90  14.278  -2.768  -6.143
  774   HG12  ILE  90          HG12      ILE  90  12.349  -1.403  -5.427
  775   HG13  ILE  90          HG13      ILE  90  12.824  -2.566  -4.195
  776   HG21  ILE  90          HG21      ILE  90  16.412  -2.614  -5.049
  777   HG22  ILE  90          HG22      ILE  90  15.770  -1.464  -3.874
  778   HG23  ILE  90          HG23      ILE  90  15.201  -3.132  -3.877
  779   HD11  ILE  90          HD11      ILE  90  13.958  -0.794  -2.960
  780   HD12  ILE  90          HD12      ILE  90  13.487   0.370  -4.199
  781   HD13  ILE  90          HD13      ILE  90  12.253  -0.420  -3.218
  782    H    ARG  91           H        ARG  91  17.204   0.165  -5.840
  783    HA   ARG  91           HA       ARG  91  18.349  -1.329  -8.103
  784    HB2  ARG  91           HB2      ARG  91  18.540   1.231  -8.021
  785    HB3  ARG  91           HB3      ARG  91  19.648   0.979  -6.681
  786    HG2  ARG  91           HG2      ARG  91  21.184  -0.203  -8.062
  787    HG3  ARG  91           HG3      ARG  91  20.039  -0.213  -9.407
  788    HD2  ARG  91           HD2      ARG  91  21.279   2.245  -8.171
  789    HD3  ARG  91           HD3      ARG  91  21.778   1.499  -9.691
  790    HE   ARG  91           HE       ARG  91  19.018   2.106  -9.761
  791   HH11  ARG  91          HH11      ARG  91  22.145   3.660  -9.866
  792   HH12  ARG  91          HH12      ARG  91  21.594   5.009 -10.818
  793   HH21  ARG  91          HH21      ARG  91  18.270   3.877 -11.015
  794   HH22  ARG  91          HH22      ARG  91  19.392   5.124 -11.480
  795    H    MET  92           H        MET  92  19.568  -2.997  -7.607
  796    HA   MET  92           HA       MET  92  20.117  -3.610  -4.847
  797    HB2  MET  92           HB2      MET  92  20.093  -5.044  -7.427
  798    HB3  MET  92           HB3      MET  92  21.252  -5.637  -6.247
  799    HG2  MET  92           HG2      MET  92  18.928  -6.687  -6.310
  800    HG3  MET  92           HG3      MET  92  19.601  -6.251  -4.742
  801    HE1  MET  92           HE1      MET  92  16.867  -5.594  -7.419
  802    HE2  MET  92           HE2      MET  92  16.237  -4.015  -6.949
  803    HE3  MET  92           HE3      MET  92  17.872  -4.157  -7.594
  804    H    LEU  93           H        LEU  93  22.338  -4.821  -4.540
  805    HA   LEU  93           HA       LEU  93  24.095  -2.703  -4.116
  806    HB2  LEU  93           HB2      LEU  93  24.741  -5.651  -4.086
  807    HB3  LEU  93           HB3      LEU  93  25.720  -4.388  -3.376
  808    HG   LEU  93           HG       LEU  93  24.656  -5.305  -1.544
  809   HD11  LEU  93          HD11      LEU  93  22.834  -3.066  -2.396
  810   HD12  LEU  93          HD12      LEU  93  23.003  -3.696  -0.757
  811   HD13  LEU  93          HD13      LEU  93  24.368  -2.897  -1.539
  812   HD21  LEU  93          HD21      LEU  93  22.024  -5.371  -3.002
  813   HD22  LEU  93          HD22      LEU  93  23.129  -6.741  -2.882
  814   HD23  LEU  93          HD23      LEU  93  22.398  -6.065  -1.427
  815    H    ASP  94           H        ASP  94  24.152  -5.247  -6.570
  816    HA   ASP  94           HA       ASP  94  26.694  -4.465  -7.634
  817    HB2  ASP  94           HB2      ASP  94  26.367  -6.134  -9.271
  818    HB3  ASP  94           HB3      ASP  94  25.557  -6.761  -7.839
  819    H    GLY  95           H        GLY  95  23.583  -3.199  -7.861
  820    HA2  GLY  95           HA2      GLY  95  23.284  -1.062  -8.919
  821    HA3  GLY  95           HA3      GLY  95  24.384  -1.583 -10.186
  822    H    THR  96           H        THR  96  22.148  -3.995  -9.237
  823    HA   THR  96           HA       THR  96  20.847  -3.783 -11.808
  824    HB   THR  96           HB       THR  96  20.497  -5.790  -9.566
  825    HG1  THR  96           HG1      THR  96  22.467  -6.095 -10.548
  826   HG21  THR  96          HG21      THR  96  19.373  -5.843 -12.370
  827   HG22  THR  96          HG22      THR  96  18.442  -5.615 -10.890
  828   HG23  THR  96          HG23      THR  96  19.262  -7.147 -11.189
  829    H    VAL  97           H        VAL  97  18.912  -2.886 -12.189
  830    HA   VAL  97           HA       VAL  97  17.362  -1.968  -9.869
  831    HB   VAL  97           HB       VAL  97  16.958  -1.218 -12.763
  832   HG11  VAL  97          HG11      VAL  97  14.994  -0.877 -11.356
  833   HG12  VAL  97          HG12      VAL  97  15.963   0.057 -10.215
  834   HG13  VAL  97          HG13      VAL  97  15.691   0.667 -11.848
  835   HG21  VAL  97          HG21      VAL  97  18.099   0.862 -12.224
  836   HG22  VAL  97          HG22      VAL  97  18.471   0.231 -10.621
  837   HG23  VAL  97          HG23      VAL  97  19.155  -0.538 -12.050
  838    H    LYS  98           H        LYS  98  15.418  -2.765  -9.415
  839    HA   LYS  98           HA       LYS  98  13.930  -3.882 -11.626
  840    HB2  LYS  98           HB2      LYS  98  13.174  -5.856 -10.507
  841    HB3  LYS  98           HB3      LYS  98  14.926  -5.838 -10.403
  842    HG2  LYS  98           HG2      LYS  98  14.897  -5.315  -8.123
  843    HG3  LYS  98           HG3      LYS  98  13.205  -4.817  -8.172
  844    HD2  LYS  98           HD2      LYS  98  14.062  -7.641  -8.763
  845    HD3  LYS  98           HD3      LYS  98  13.726  -7.098  -7.116
  846    HE2  LYS  98           HE2      LYS  98  11.725  -8.047  -7.828
  847    HE3  LYS  98           HE3      LYS  98  11.468  -6.316  -8.030
  848    HZ1  LYS  98           HZ1      LYS  98  12.072  -8.301 -10.160
  849    HZ2  LYS  98           HZ2      LYS  98  12.032  -6.627 -10.420
  850    HZ3  LYS  98           HZ3      LYS  98  10.628  -7.442  -9.936
  851    H    THR  99           H        THR  99  11.596  -3.910 -11.268
  852    HA   THR  99           HA       THR  99  10.766  -2.151  -9.060
  853    HB   THR  99           HB       THR  99   9.391  -2.596 -11.727
  854    HG1  THR  99           HG1      THR  99  11.203  -1.219 -11.917
  855   HG21  THR  99          HG21      THR  99   7.841  -0.846 -10.997
  856   HG22  THR  99          HG22      THR  99   8.658  -0.769  -9.436
  857   HG23  THR  99          HG23      THR  99   7.793  -2.233  -9.907
  858    H    ILE 100           H        ILE 100   9.693  -3.195  -7.487
  859    HA   ILE 100           HA       ILE 100   8.116  -5.559  -8.229
  860    HB   ILE 100           HB       ILE 100  10.304  -6.149  -7.121
  861   HG12  ILE 100          HG12      ILE 100   8.033  -7.456  -6.990
  862   HG13  ILE 100          HG13      ILE 100   9.407  -7.967  -6.025
  863   HG21  ILE 100          HG21      ILE 100  10.504  -5.824  -4.697
  864   HG22  ILE 100          HG22      ILE 100  10.507  -4.302  -5.589
  865   HG23  ILE 100          HG23      ILE 100   9.056  -4.818  -4.727
  866   HD11  ILE 100          HD11      ILE 100   8.450  -6.835  -4.081
  867   HD12  ILE 100          HD12      ILE 100   7.069  -6.341  -5.060
  868   HD13  ILE 100          HD13      ILE 100   7.360  -8.052  -4.744
  869    H    MET 101           H        MET 101   6.182  -5.800  -7.092
  870    HA   MET 101           HA       MET 101   5.239  -3.310  -5.911
  871    HB2  MET 101           HB2      MET 101   3.784  -5.858  -6.637
  872    HB3  MET 101           HB3      MET 101   3.012  -4.378  -6.085
  873    HG2  MET 101           HG2      MET 101   4.659  -4.619  -8.592
  874    HG3  MET 101           HG3      MET 101   2.899  -4.712  -8.529
  875    HE1  MET 101           HE1      MET 101   2.257  -2.576  -6.271
  876    HE2  MET 101           HE2      MET 101   1.975  -1.124  -7.236
  877    HE3  MET 101           HE3      MET 101   1.342  -2.680  -7.776
  878    H    VAL 102           H        VAL 102   5.589  -3.059  -3.844
  879    HA   VAL 102           HA       VAL 102   5.108  -5.346  -2.039
  880    HB   VAL 102           HB       VAL 102   6.814  -3.016  -1.234
  881   HG11  VAL 102          HG11      VAL 102   7.812  -4.684   0.253
  882   HG12  VAL 102          HG12      VAL 102   6.069  -4.558   0.490
  883   HG13  VAL 102          HG13      VAL 102   6.739  -5.915  -0.415
  884   HG21  VAL 102          HG21      VAL 102   8.800  -4.281  -1.951
  885   HG22  VAL 102          HG22      VAL 102   7.749  -5.451  -2.749
  886   HG23  VAL 102          HG23      VAL 102   7.793  -3.777  -3.309
  887    H    ASP 103           H        ASP 103   3.895  -5.069  -0.243
  888    HA   ASP 103           HA       ASP 103   1.703  -3.439  -0.313
  889    HB2  ASP 103           HB2      ASP 103   3.029  -4.521   2.177
  890    HB3  ASP 103           HB3      ASP 103   1.361  -3.988   2.056
  891    H    ASP 104           H        ASP 104   1.261  -1.376   0.171
  892    HA   ASP 104           HA       ASP 104   3.340   0.353   1.239
  893    HB2  ASP 104           HB2      ASP 104   1.830   1.049  -0.638
  894    HB3  ASP 104           HB3      ASP 104   0.478   1.011   0.484
  895    H    SER 105           H        SER 105   0.794  -1.538   2.395
  896    HA   SER 105           HA       SER 105  -0.187   0.113   4.487
  897    HB2  SER 105           HB2      SER 105  -0.365  -2.885   4.491
  898    HB3  SER 105           HB3      SER 105  -1.551  -1.706   5.043
  899    HG   SER 105           HG       SER 105  -1.503  -2.894   2.731
  900    H    LYS 106           H        LYS 106   2.675  -1.764   4.238
  901    HA   LYS 106           HA       LYS 106   2.787  -2.029   7.162
  902    HB2  LYS 106           HB2      LYS 106   4.266  -4.057   6.682
  903    HB3  LYS 106           HB3      LYS 106   2.538  -4.218   6.437
  904    HG2  LYS 106           HG2      LYS 106   3.430  -5.268   4.590
  905    HG3  LYS 106           HG3      LYS 106   3.062  -3.660   3.977
  906    HD2  LYS 106           HD2      LYS 106   5.361  -3.012   4.129
  907    HD3  LYS 106           HD3      LYS 106   5.772  -4.505   4.982
  908    HE2  LYS 106           HE2      LYS 106   4.807  -4.262   2.136
  909    HE3  LYS 106           HE3      LYS 106   6.438  -4.678   2.663
  910    HZ1  LYS 106           HZ1      LYS 106   5.537  -6.689   3.698
  911    HZ2  LYS 106           HZ2      LYS 106   5.215  -6.657   2.032
  912    HZ3  LYS 106           HZ3      LYS 106   3.986  -6.295   3.137
  913    H    THR 107           H        THR 107   5.245  -2.766   7.686
  914    HA   THR 107           HA       THR 107   6.625  -0.260   7.325
  915    HB   THR 107           HB       THR 107   8.265  -1.371   8.963
  916    HG1  THR 107           HG1      THR 107   7.737  -3.295   9.752
  917   HG21  THR 107          HG21      THR 107   5.388  -0.883   9.737
  918   HG22  THR 107          HG22      THR 107   6.679   0.320   9.664
  919   HG23  THR 107          HG23      THR 107   6.740  -0.969  10.867
  920    H    VAL 108           H        VAL 108   9.201  -0.660   7.460
  921    HA   VAL 108           HA       VAL 108   9.749  -1.311   4.728
  922    HB   VAL 108           HB       VAL 108  11.745  -0.434   6.789
  923   HG11  VAL 108          HG11      VAL 108  11.693  -0.177   3.789
  924   HG12  VAL 108          HG12      VAL 108  12.933   0.489   4.853
  925   HG13  VAL 108          HG13      VAL 108  12.722  -1.257   4.732
  926   HG21  VAL 108          HG21      VAL 108   9.977   1.285   5.051
  927   HG22  VAL 108          HG22      VAL 108   9.869   1.121   6.804
  928   HG23  VAL 108          HG23      VAL 108  11.291   1.866   6.074
  929    H    THR 109           H        THR 109  10.872  -2.601   7.860
  930    HA   THR 109           HA       THR 109  12.704  -4.456   6.922
  931    HB   THR 109           HB       THR 109  10.806  -4.854   9.243
  932    HG1  THR 109           HG1      THR 109  13.071  -4.060  10.179
  933   HG21  THR 109          HG21      THR 109  12.013  -6.894   8.623
  934   HG22  THR 109          HG22      THR 109  12.594  -6.256  10.162
  935   HG23  THR 109          HG23      THR 109  13.541  -6.015   8.694
  936    H    ASP 110           H        ASP 110   9.190  -4.753   7.162
  937    HA   ASP 110           HA       ASP 110   9.104  -7.489   6.347
  938    HB2  ASP 110           HB2      ASP 110   7.309  -6.293   7.653
  939    HB3  ASP 110           HB3      ASP 110   6.906  -5.413   6.183
  940    H    MET 111           H        MET 111   8.759  -4.373   4.783
  941    HA   MET 111           HA       MET 111   8.112  -5.179   2.185
  942    HB2  MET 111           HB2      MET 111   7.987  -2.869   2.913
  943    HB3  MET 111           HB3      MET 111   9.723  -2.828   3.181
  944    HG2  MET 111           HG2      MET 111   9.856  -3.400   0.650
  945    HG3  MET 111           HG3      MET 111   8.200  -2.792   0.620
  946    HE1  MET 111           HE1      MET 111   9.212   0.607   2.694
  947    HE2  MET 111           HE2      MET 111   7.779  -0.261   2.129
  948    HE3  MET 111           HE3      MET 111   8.863  -1.014   3.294
  949    H    LEU 112           H        LEU 112  11.265  -4.541   3.671
  950    HA   LEU 112           HA       LEU 112  12.809  -5.037   1.367
  951    HB2  LEU 112           HB2      LEU 112  13.334  -3.994   3.785
  952    HB3  LEU 112           HB3      LEU 112  13.975  -5.607   4.033
  953    HG   LEU 112           HG       LEU 112  15.379  -5.278   1.976
  954   HD11  LEU 112          HD11      LEU 112  15.724  -2.966   1.224
  955   HD12  LEU 112          HD12      LEU 112  14.076  -3.522   0.926
  956   HD13  LEU 112          HD13      LEU 112  14.410  -2.440   2.278
  957   HD21  LEU 112          HD21      LEU 112  16.341  -5.044   4.174
  958   HD22  LEU 112          HD22      LEU 112  16.999  -3.805   3.107
  959   HD23  LEU 112          HD23      LEU 112  15.759  -3.382   4.286
  960    H    MET 113           H        MET 113  11.621  -7.078   3.945
  961    HA   MET 113           HA       MET 113  12.970  -9.457   3.402
  962    HB2  MET 113           HB2      MET 113  11.407  -8.998   5.319
  963    HB3  MET 113           HB3      MET 113  10.067  -9.177   4.200
  964    HG2  MET 113           HG2      MET 113  10.774 -11.485   3.748
  965    HG3  MET 113           HG3      MET 113  12.069 -11.300   4.932
  966    HE1  MET 113           HE1      MET 113  11.597 -10.778   7.534
  967    HE2  MET 113           HE2      MET 113  10.521  -9.450   7.100
  968    HE3  MET 113           HE3      MET 113   9.977 -10.694   8.226
  969    H    THR 114           H        THR 114  10.084  -8.053   2.006
  970    HA   THR 114           HA       THR 114   9.519 -10.132   0.166
  971    HB   THR 114           HB       THR 114   8.753  -7.211   0.128
  972    HG1  THR 114           HG1      THR 114   6.688  -8.283   0.858
  973   HG21  THR 114          HG21      THR 114   8.498  -8.172  -2.097
  974   HG22  THR 114          HG22      THR 114   6.913  -7.917  -1.364
  975   HG23  THR 114          HG23      THR 114   7.606  -9.537  -1.425
  976    H    ILE 115           H        ILE 115  11.383  -7.093  -0.086
  977    HA   ILE 115           HA       ILE 115  11.607  -7.199  -2.926
  978    HB   ILE 115           HB       ILE 115  13.251  -5.628  -0.934
  979   HG12  ILE 115          HG12      ILE 115  10.842  -4.793  -2.567
  980   HG13  ILE 115          HG13      ILE 115  10.823  -5.142  -0.841
  981   HG21  ILE 115          HG21      ILE 115  13.793  -4.181  -2.844
  982   HG22  ILE 115          HG22      ILE 115  14.383  -5.826  -3.075
  983   HG23  ILE 115          HG23      ILE 115  12.929  -5.285  -3.914
  984   HD11  ILE 115          HD11      ILE 115  10.868  -2.754  -1.255
  985   HD12  ILE 115          HD12      ILE 115  12.347  -3.276  -0.451
  986   HD13  ILE 115          HD13      ILE 115  12.360  -2.927  -2.179
  987    H    CYS 116           H        CYS 116  13.868  -7.898  -0.263
  988    HA   CYS 116           HA       CYS 116  16.032  -8.560  -1.970
  989    HB2  CYS 116           HB2      CYS 116  15.572  -9.393   0.903
  990    HB3  CYS 116           HB3      CYS 116  17.106  -9.435   0.041
  991    HG   CYS 116           HG       CYS 116  16.949  -6.549  -0.381
  992    H    ALA 117           H        ALA 117  13.322 -10.354  -0.729
  993    HA   ALA 117           HA       ALA 117  14.334 -12.952  -1.293
  994    HB1  ALA 117           HB1      ALA 117  12.484 -12.598   0.265
  995    HB2  ALA 117           HB2      ALA 117  11.472 -12.032  -1.064
  996    HB3  ALA 117           HB3      ALA 117  12.031 -13.703  -1.032
  997    H    ARG 118           H        ARG 118  12.805 -10.459  -3.197
  998    HA   ARG 118           HA       ARG 118  12.071 -12.097  -5.403
  999    HB2  ARG 118           HB2      ARG 118  12.846  -9.170  -5.568
 1000    HB3  ARG 118           HB3      ARG 118  11.846 -10.081  -6.689
 1001    HG2  ARG 118           HG2      ARG 118  11.133  -9.285  -3.883
 1002    HG3  ARG 118           HG3      ARG 118  10.453  -8.652  -5.381
 1003    HD2  ARG 118           HD2      ARG 118  10.161 -11.437  -4.274
 1004    HD3  ARG 118           HD3      ARG 118   8.906 -10.208  -4.423
 1005    HE   ARG 118           HE       ARG 118   9.697 -10.536  -6.978
 1006   HH11  ARG 118          HH11      ARG 118   8.745 -12.795  -4.469
 1007   HH12  ARG 118          HH12      ARG 118   8.110 -13.967  -5.589
 1008   HH21  ARG 118          HH21      ARG 118   8.857 -12.075  -8.453
 1009   HH22  ARG 118          HH22      ARG 118   8.210 -13.576  -7.851
 1010    H    ILE 119           H        ILE 119  14.996 -10.379  -4.474
 1011    HA   ILE 119           HA       ILE 119  16.385 -10.914  -6.921
 1012    HB   ILE 119           HB       ILE 119  17.802 -10.341  -4.343
 1013   HG12  ILE 119          HG12      ILE 119  15.838  -8.848  -4.369
 1014   HG13  ILE 119          HG13      ILE 119  17.346  -7.959  -4.555
 1015   HG21  ILE 119          HG21      ILE 119  18.196  -9.411  -7.183
 1016   HG22  ILE 119          HG22      ILE 119  19.237  -9.007  -5.816
 1017   HG23  ILE 119          HG23      ILE 119  19.110 -10.678  -6.363
 1018   HD11  ILE 119          HD11      ILE 119  15.444  -8.685  -6.770
 1019   HD12  ILE 119          HD12      ILE 119  15.612  -7.098  -6.021
 1020   HD13  ILE 119          HD13      ILE 119  16.947  -7.780  -6.950
 1021    H    GLY 120           H        GLY 120  16.244 -12.299  -3.692
 1022    HA2  GLY 120           HA2      GLY 120  16.514 -14.731  -3.498
 1023    HA3  GLY 120           HA3      GLY 120  17.808 -14.594  -4.681
 1024    H    ILE 121           H        ILE 121  17.168 -12.527  -1.899
 1025    HA   ILE 121           HA       ILE 121  19.853 -13.194  -0.892
 1026    HB   ILE 121           HB       ILE 121  18.203 -10.748  -0.252
 1027   HG12  ILE 121          HG12      ILE 121  20.528 -10.979  -2.174
 1028   HG13  ILE 121          HG13      ILE 121  18.841 -10.848  -2.658
 1029   HG21  ILE 121          HG21      ILE 121  21.081 -11.448   0.276
 1030   HG22  ILE 121          HG22      ILE 121  20.372  -9.857   0.544
 1031   HG23  ILE 121          HG23      ILE 121  19.797 -11.242   1.469
 1032   HD11  ILE 121          HD11      ILE 121  18.716  -8.641  -1.611
 1033   HD12  ILE 121          HD12      ILE 121  20.409  -8.774  -1.136
 1034   HD13  ILE 121          HD13      ILE 121  19.974  -8.711  -2.844
 1035    H    THR 122           H        THR 122  20.101 -13.956   1.163
 1036    HA   THR 122           HA       THR 122  17.675 -14.662   2.621
 1037    HB   THR 122           HB       THR 122  20.530 -15.328   3.364
 1038    HG1  THR 122           HG1      THR 122  19.178 -16.151   1.218
 1039   HG21  THR 122          HG21      THR 122  19.490 -17.202   4.556
 1040   HG22  THR 122          HG22      THR 122  17.896 -16.639   4.052
 1041   HG23  THR 122          HG23      THR 122  18.876 -15.654   5.138
 1042    H    ASN 123           H        ASN 123  20.804 -13.085   3.315
 1043    HA   ASN 123           HA       ASN 123  19.784 -11.934   5.761
 1044    HB2  ASN 123           HB2      ASN 123  22.419 -11.654   4.309
 1045    HB3  ASN 123           HB3      ASN 123  22.036 -10.743   5.764
 1046   HD21  ASN 123          HD21      ASN 123  21.938 -11.795   7.730
 1047   HD22  ASN 123          HD22      ASN 123  22.538 -13.404   7.957
 1048    H    HIS 124           H        HIS 124  18.133 -10.578   5.227
 1049    HA   HIS 124           HA       HIS 124  18.671  -8.478   3.247
 1050    HB2  HIS 124           HB2      HIS 124  16.284  -8.133   3.112
 1051    HB3  HIS 124           HB3      HIS 124  16.619  -9.849   2.932
 1052    HD1  HIS 124           HD1      HIS 124  15.076  -7.372   5.295
 1053    HD2  HIS 124           HD2      HIS 124  15.567 -11.486   4.930
 1054    HE1  HIS 124           HE1      HIS 124  13.498  -8.391   6.962
 1055    HE2  HIS 124           HE2      HIS 124  14.008 -10.861   6.899
 1056    H    ASP 125           H        ASP 125  18.574  -8.996   6.579
 1057    HA   ASP 125           HA       ASP 125  17.563  -6.405   7.299
 1058    HB2  ASP 125           HB2      ASP 125  18.909  -8.559   8.939
 1059    HB3  ASP 125           HB3      ASP 125  18.283  -7.055   9.608
 1060    H    GLU 126           H        GLU 126  20.458  -7.581   6.116
 1061    HA   GLU 126           HA       GLU 126  22.255  -5.804   7.433
 1062    HB2  GLU 126           HB2      GLU 126  22.474  -7.229   4.783
 1063    HB3  GLU 126           HB3      GLU 126  23.766  -6.279   5.497
 1064    HG2  GLU 126           HG2      GLU 126  23.638  -7.819   7.481
 1065    HG3  GLU 126           HG3      GLU 126  22.581  -8.841   6.506
 1066    H    TYR 127           H        TYR 127  19.809  -5.372   5.190
 1067    HA   TYR 127           HA       TYR 127  21.144  -3.102   3.914
 1068    HB2  TYR 127           HB2      TYR 127  18.583  -4.471   3.095
 1069    HB3  TYR 127           HB3      TYR 127  19.501  -3.290   2.163
 1070    HD1  TYR 127           HD1      TYR 127  22.072  -4.006   1.869
 1071    HD2  TYR 127           HD2      TYR 127  18.819  -6.660   2.487
 1072    HE1  TYR 127           HE1      TYR 127  23.369  -5.813   0.856
 1073    HE2  TYR 127           HE2      TYR 127  20.105  -8.486   1.488
 1074    HH   TYR 127           HH       TYR 127  23.420  -8.323   0.946
 1075    H    SER 128           H        SER 128  20.361  -1.095   3.990
 1076    HA   SER 128           HA       SER 128  17.838  -0.668   5.446
 1077    HB2  SER 128           HB2      SER 128  20.191   1.238   5.265
 1078    HB3  SER 128           HB3      SER 128  18.710   1.478   6.195
 1079    HG   SER 128           HG       SER 128  20.051  -0.869   6.732
 1080    H    LEU 129           H        LEU 129  16.445   0.947   4.523
 1081    HA   LEU 129           HA       LEU 129  16.823   0.978   1.636
 1082    HB2  LEU 129           HB2      LEU 129  14.636   0.419   3.122
 1083    HB3  LEU 129           HB3      LEU 129  14.366   2.125   2.823
 1084    HG   LEU 129           HG       LEU 129  14.831   0.093   0.634
 1085   HD11  LEU 129          HD11      LEU 129  12.790  -0.443   1.841
 1086   HD12  LEU 129          HD12      LEU 129  12.237   1.222   1.668
 1087   HD13  LEU 129          HD13      LEU 129  12.424   0.204   0.241
 1088   HD21  LEU 129          HD21      LEU 129  13.882   1.838  -0.810
 1089   HD22  LEU 129          HD22      LEU 129  13.806   2.929   0.573
 1090   HD23  LEU 129          HD23      LEU 129  15.367   2.366  -0.022
 1091    H    VAL 130           H        VAL 130  17.043   2.810   0.438
 1092    HA   VAL 130           HA       VAL 130  16.818   5.378   1.821
 1093    HB   VAL 130           HB       VAL 130  19.132   5.252   1.862
 1094   HG11  VAL 130          HG11      VAL 130  20.508   4.349   0.035
 1095   HG12  VAL 130          HG12      VAL 130  19.403   3.162   0.731
 1096   HG13  VAL 130          HG13      VAL 130  19.030   3.911  -0.819
 1097   HG21  VAL 130          HG21      VAL 130  18.562   6.450  -0.846
 1098   HG22  VAL 130          HG22      VAL 130  18.488   7.295   0.702
 1099   HG23  VAL 130          HG23      VAL 130  20.032   6.691   0.096
 1100    H    ARG 131           H        ARG 131  15.360   6.524   0.823
 1101    HA   ARG 131           HA       ARG 131  14.697   5.864  -1.954
 1102    HB2  ARG 131           HB2      ARG 131  13.180   7.673  -0.075
 1103    HB3  ARG 131           HB3      ARG 131  12.594   6.925  -1.553
 1104    HG2  ARG 131           HG2      ARG 131  12.783   4.718  -0.468
 1105    HG3  ARG 131           HG3      ARG 131  13.268   5.527   1.023
 1106    HD2  ARG 131           HD2      ARG 131  10.913   5.032   1.126
 1107    HD3  ARG 131           HD3      ARG 131  11.137   6.779   0.990
 1108    HE   ARG 131           HE       ARG 131  10.651   6.442  -1.458
 1109   HH11  ARG 131          HH11      ARG 131   9.376   4.285   0.991
 1110   HH12  ARG 131          HH12      ARG 131   8.026   3.788   0.026
 1111   HH21  ARG 131          HH21      ARG 131   8.901   5.831  -2.716
 1112   HH22  ARG 131          HH22      ARG 131   7.747   4.679  -2.098
 1113    H    GLU 132           H        GLU 132  16.153   7.006  -3.175
 1114    HA   GLU 132           HA       GLU 132  16.458   9.830  -2.707
 1115    HB2  GLU 132           HB2      GLU 132  17.427   8.094  -4.996
 1116    HB3  GLU 132           HB3      GLU 132  17.788   9.806  -4.831
 1117    HG2  GLU 132           HG2      GLU 132  18.690   9.045  -2.476
 1118    HG3  GLU 132           HG3      GLU 132  18.819   7.485  -3.292
 1119    H    LEU 133           H        LEU 133  14.761  11.049  -3.086
 1120    HA   LEU 133           HA       LEU 133  12.880  10.279  -5.163
 1121    HB2  LEU 133           HB2      LEU 133  12.573  12.736  -3.475
 1122    HB3  LEU 133           HB3      LEU 133  11.335  11.746  -4.215
 1123    HG   LEU 133           HG       LEU 133  12.957  11.065  -1.766
 1124   HD11  LEU 133          HD11      LEU 133  10.024  11.598  -2.188
 1125   HD12  LEU 133          HD12      LEU 133  10.771  11.106  -0.668
 1126   HD13  LEU 133          HD13      LEU 133  11.176  12.664  -1.386
 1127   HD21  LEU 133          HD21      LEU 133  12.606   9.053  -3.094
 1128   HD22  LEU 133          HD22      LEU 133  11.613   9.028  -1.636
 1129   HD23  LEU 133          HD23      LEU 133  10.882   9.409  -3.195
 1130    H    MET 134           H        MET 134  11.846  12.402  -6.161
 1131    HA   MET 134           HA       MET 134  14.042  13.958  -7.356
 1132    HB2  MET 134           HB2      MET 134  12.026  14.434  -9.041
 1133    HB3  MET 134           HB3      MET 134  13.057  13.016  -9.199
 1134    HG2  MET 134           HG2      MET 134  11.392  11.609  -8.741
 1135    HG3  MET 134           HG3      MET 134  10.792  12.602  -7.417
 1136    HE1  MET 134           HE1      MET 134  10.207  15.376  -8.790
 1137    HE2  MET 134           HE2      MET 134   8.499  15.158  -9.170
 1138    HE3  MET 134           HE3      MET 134   9.150  14.548  -7.648
 1139    H    GLU 135           H        GLU 135  12.233  14.208  -4.863
 1140    HA   GLU 135           HA       GLU 135  10.527  16.416  -5.262
 1141    HB2  GLU 135           HB2      GLU 135  11.679  15.114  -2.819
 1142    HB3  GLU 135           HB3      GLU 135  10.584  16.487  -2.722
 1143    HG2  GLU 135           HG2      GLU 135   8.995  15.058  -4.125
 1144    HG3  GLU 135           HG3      GLU 135  10.059  13.714  -3.696
 1145    H    GLU 136           H        GLU 136  10.915  18.531  -5.201
 1146    HA   GLU 136           HA       GLU 136  13.503  19.531  -4.325
 1147    HB2  GLU 136           HB2      GLU 136  12.749  21.658  -5.156
 1148    HB3  GLU 136           HB3      GLU 136  12.293  20.429  -6.330
 1149    HG2  GLU 136           HG2      GLU 136  10.016  20.429  -5.458
 1150    HG3  GLU 136           HG3      GLU 136  10.467  21.667  -4.286
 1151    H    LYS 137           H        LYS 137  10.346  18.994  -3.162
 1152    HA   LYS 137           HA       LYS 137  10.153  20.985  -1.171
 1153    HB2  LYS 137           HB2      LYS 137   8.825  18.269  -1.272
 1154    HB3  LYS 137           HB3      LYS 137   8.314  19.636  -0.289
 1155    HG2  LYS 137           HG2      LYS 137   7.825  20.919  -2.298
 1156    HG3  LYS 137           HG3      LYS 137   8.374  19.574  -3.298
 1157    HD2  LYS 137           HD2      LYS 137   6.594  18.169  -2.382
 1158    HD3  LYS 137           HD3      LYS 137   6.044  19.518  -1.383
 1159    HE2  LYS 137           HE2      LYS 137   5.641  20.825  -3.441
 1160    HE3  LYS 137           HE3      LYS 137   6.107  19.422  -4.398
 1161    HZ1  LYS 137           HZ1      LYS 137   3.703  19.634  -4.179
 1162    HZ2  LYS 137           HZ2      LYS 137   3.832  19.507  -2.491
 1163    HZ3  LYS 137           HZ3      LYS 137   4.264  18.196  -3.477
 1164    H    LYS 138           H        LYS 138  10.422  17.481  -0.500
 1165    HA   LYS 138           HA       LYS 138  11.874  17.946   1.915
 1166    HB2  LYS 138           HB2      LYS 138  11.552  15.416   0.289
 1167    HB3  LYS 138           HB3      LYS 138  12.314  15.492   1.869
 1168    HG2  LYS 138           HG2      LYS 138  10.123  16.449   2.707
 1169    HG3  LYS 138           HG3      LYS 138   9.458  15.941   1.151
 1170    HD2  LYS 138           HD2      LYS 138  11.025  13.960   2.706
 1171    HD3  LYS 138           HD3      LYS 138   9.405  14.357   3.283
 1172    HE2  LYS 138           HE2      LYS 138  10.170  13.276   0.574
 1173    HE3  LYS 138           HE3      LYS 138   9.268  12.435   1.842
 1174    HZ1  LYS 138           HZ1      LYS 138   7.553  14.223   1.605
 1175    HZ2  LYS 138           HZ2      LYS 138   7.710  13.209   0.254
 1176    HZ3  LYS 138           HZ3      LYS 138   8.381  14.760   0.222
 1177    H    ASP 169           H        ASP 169  12.759  16.457  -1.155
 1178    HA   ASP 169           HA       ASP 169  14.708  15.979  -2.121
 1179    HB2  ASP 169           HB2      ASP 169  14.877  18.384  -2.454
 1180    HB3  ASP 169           HB3      ASP 169  15.549  18.590  -0.841
 1181    H    GLU 170           H        GLU 170  14.868  14.165  -0.850
 1182    HA   GLU 170           HA       GLU 170  16.901  14.280   1.238
 1183    HB2  GLU 170           HB2      GLU 170  14.126  14.080   1.724
 1184    HB3  GLU 170           HB3      GLU 170  14.798  12.479   1.998
 1185    HG2  GLU 170           HG2      GLU 170  15.966  14.939   3.248
 1186    HG3  GLU 170           HG3      GLU 170  14.657  14.022   3.993
 1187    H    LEU 171           H        LEU 171  17.767  12.256   1.790
 1188    HA   LEU 171           HA       LEU 171  17.932  10.377  -0.401
 1189    HB2  LEU 171           HB2      LEU 171  19.111  10.191   2.375
 1190    HB3  LEU 171           HB3      LEU 171  19.568   9.230   0.982
 1191    HG   LEU 171           HG       LEU 171  20.013  12.187   1.327
 1192   HD11  LEU 171          HD11      LEU 171  22.377  11.583   1.350
 1193   HD12  LEU 171          HD12      LEU 171  21.507  10.807   2.673
 1194   HD13  LEU 171          HD13      LEU 171  21.945   9.876   1.241
 1195   HD21  LEU 171          HD21      LEU 171  19.529  11.662  -0.987
 1196   HD22  LEU 171          HD22      LEU 171  21.246  12.019  -0.793
 1197   HD23  LEU 171          HD23      LEU 171  20.708  10.347  -0.955
 1198    H    ASN 172           H        ASN 172  16.224  10.864   2.479
 1199    HA   ASN 172           HA       ASN 172  14.715   9.673   3.678
 1200    HB2  ASN 172           HB2      ASN 172  14.154   8.684   0.881
 1201    HB3  ASN 172           HB3      ASN 172  13.127   8.312   2.250
 1202   HD21  ASN 172          HD21      ASN 172  13.902  10.537  -0.159
 1203   HD22  ASN 172          HD22      ASN 172  12.846  11.818   0.331
 1204    H    TRP 173           H        TRP 173  16.556   8.509   4.735
 1205    HA   TRP 173           HA       TRP 173  17.072   5.835   3.734
 1206    HB2  TRP 173           HB2      TRP 173  18.307   7.650   5.758
 1207    HB3  TRP 173           HB3      TRP 173  18.474   5.913   6.004
 1208    HD1  TRP 173           HD1      TRP 173  19.402   8.669   3.477
 1209    HE1  TRP 173           HE1      TRP 173  21.454   7.886   2.150
 1210    HE3  TRP 173           HE3      TRP 173  19.783   3.917   5.322
 1211    HZ2  TRP 173           HZ2      TRP 173  23.035   5.558   1.920
 1212    HZ3  TRP 173           HZ3      TRP 173  21.599   2.476   4.494
 1213    HH2  TRP 173           HH2      TRP 173  23.191   3.282   2.828
 1214    H    LEU 174           H        LEU 174  15.298   4.647   4.121
 1215    HA   LEU 174           HA       LEU 174  13.537   5.052   6.273
 1216    HB2  LEU 174           HB2      LEU 174  13.881   2.564   4.610
 1217    HB3  LEU 174           HB3      LEU 174  12.502   2.949   5.620
 1218    HG   LEU 174           HG       LEU 174  13.309   4.184   3.010
 1219   HD11  LEU 174          HD11      LEU 174  10.936   3.700   2.493
 1220   HD12  LEU 174          HD12      LEU 174  11.874   2.259   2.893
 1221   HD13  LEU 174          HD13      LEU 174  10.778   2.955   4.088
 1222   HD21  LEU 174          HD21      LEU 174  12.893   6.059   4.489
 1223   HD22  LEU 174          HD22      LEU 174  11.549   5.874   3.360
 1224   HD23  LEU 174          HD23      LEU 174  11.383   5.327   5.029
 1225    H    ASP 175           H        ASP 175  13.746   4.621   8.262
 1226    HA   ASP 175           HA       ASP 175  16.044   3.269   9.314
 1227    HB2  ASP 175           HB2      ASP 175  15.254   4.027  11.457
 1228    HB3  ASP 175           HB3      ASP 175  14.987   5.328  10.300
 1229    H    HIS 176           H        HIS 176  13.345   2.034   8.073
 1230    HA   HIS 176           HA       HIS 176  12.254   0.062   8.202
 1231    HB2  HIS 176           HB2      HIS 176  14.502  -0.592  10.093
 1232    HB3  HIS 176           HB3      HIS 176  13.220  -1.743   9.726
 1233    HD1  HIS 176           HD1      HIS 176  13.084  -2.583   7.243
 1234    HD2  HIS 176           HD2      HIS 176  16.458  -0.367   8.179
 1235    HE1  HIS 176           HE1      HIS 176  14.641  -2.902   5.306
 1236    HE2  HIS 176           HE2      HIS 176  16.814  -1.890   6.111
 1237    H    GLY 177           H        GLY 177  11.015   2.005   9.367
 1238    HA2  GLY 177           HA2      GLY 177   9.551   0.654  11.462
 1239    HA3  GLY 177           HA3      GLY 177  10.393   2.099  12.003
 1240    H    ARG 178           H        ARG 178  10.088   3.784   9.898
 1241    HA   ARG 178           HA       ARG 178   7.414   4.684  10.301
 1242    HB2  ARG 178           HB2      ARG 178   9.248   6.263  10.100
 1243    HB3  ARG 178           HB3      ARG 178   9.611   5.682   8.481
 1244    HG2  ARG 178           HG2      ARG 178   7.402   6.472   7.732
 1245    HG3  ARG 178           HG3      ARG 178   7.120   7.132   9.347
 1246    HD2  ARG 178           HD2      ARG 178   9.321   7.919   7.448
 1247    HD3  ARG 178           HD3      ARG 178   7.882   8.862   7.820
 1248    HE   ARG 178           HE       ARG 178   9.338   8.277  10.184
 1249   HH11  ARG 178          HH11      ARG 178   9.485  10.258   7.314
 1250   HH12  ARG 178          HH12      ARG 178  10.287  11.582   8.098
 1251   HH21  ARG 178          HH21      ARG 178  10.420   9.996  11.235
 1252   HH22  ARG 178          HH22      ARG 178  10.856  11.420  10.330
 1253    H    THR 179           H        THR 179   5.651   4.527   9.023
 1254    HA   THR 179           HA       THR 179   5.628   2.776   6.781
 1255    HB   THR 179           HB       THR 179   3.610   2.962   8.058
 1256    HG1  THR 179           HG1      THR 179   2.865   2.556   6.099
 1257   HG21  THR 179          HG21      THR 179   2.276   5.033   8.147
 1258   HG22  THR 179          HG22      THR 179   3.552   5.890   7.281
 1259   HG23  THR 179          HG23      THR 179   3.857   5.252   8.895
 1260    H    LEU 180           H        LEU 180   5.044   3.291   4.637
 1261    HA   LEU 180           HA       LEU 180   6.658   5.390   3.565
 1262    HB2  LEU 180           HB2      LEU 180   4.660   3.892   1.934
 1263    HB3  LEU 180           HB3      LEU 180   6.299   4.368   1.526
 1264    HG   LEU 180           HG       LEU 180   5.587   2.183   3.475
 1265   HD11  LEU 180          HD11      LEU 180   6.555   2.006   0.631
 1266   HD12  LEU 180          HD12      LEU 180   6.376   0.653   1.750
 1267   HD13  LEU 180          HD13      LEU 180   4.956   1.557   1.228
 1268   HD21  LEU 180          HD21      LEU 180   7.695   3.287   3.963
 1269   HD22  LEU 180          HD22      LEU 180   7.958   1.646   3.368
 1270   HD23  LEU 180          HD23      LEU 180   8.229   3.026   2.300
 1271    H    ARG 181           H        ARG 181   3.350   4.962   4.365
 1272    HA   ARG 181           HA       ARG 181   2.238   6.831   2.551
 1273    HB2  ARG 181           HB2      ARG 181   1.106   4.935   3.937
 1274    HB3  ARG 181           HB3      ARG 181   0.999   6.152   5.200
 1275    HG2  ARG 181           HG2      ARG 181  -0.132   7.614   3.421
 1276    HG3  ARG 181           HG3      ARG 181  -0.324   6.111   2.516
 1277    HD2  ARG 181           HD2      ARG 181  -1.454   6.844   5.199
 1278    HD3  ARG 181           HD3      ARG 181  -2.316   6.362   3.739
 1279    HE   ARG 181           HE       ARG 181  -1.231   4.115   4.111
 1280   HH11  ARG 181          HH11      ARG 181  -1.923   6.329   6.740
 1281   HH12  ARG 181          HH12      ARG 181  -2.045   5.068   7.932
 1282   HH21  ARG 181          HH21      ARG 181  -1.385   2.454   5.703
 1283   HH22  ARG 181          HH22      ARG 181  -1.745   2.881   7.350
 1284    H    GLU 182           H        GLU 182   3.586   7.102   5.796
 1285    HA   GLU 182           HA       GLU 182   2.590   9.838   5.963
 1286    HB2  GLU 182           HB2      GLU 182   3.031   9.757   8.239
 1287    HB3  GLU 182           HB3      GLU 182   2.720   8.065   7.909
 1288    HG2  GLU 182           HG2      GLU 182   5.016   7.524   7.976
 1289    HG3  GLU 182           HG3      GLU 182   5.488   9.221   7.916
 1290    H    GLN 183           H        GLN 183   5.334   8.206   4.879
 1291    HA   GLN 183           HA       GLN 183   7.374  10.046   5.494
 1292    HB2  GLN 183           HB2      GLN 183   7.059   8.094   3.224
 1293    HB3  GLN 183           HB3      GLN 183   8.503   9.079   3.444
 1294    HG2  GLN 183           HG2      GLN 183   8.995   8.019   5.513
 1295    HG3  GLN 183           HG3      GLN 183   7.436   7.196   5.530
 1296   HE21  GLN 183          HE21      GLN 183   8.437   5.182   5.706
 1297   HE22  GLN 183          HE22      GLN 183   9.260   4.450   4.373
 1298    H    GLY 184           H        GLY 184   4.723  10.229   3.409
 1299    HA2  GLY 184           HA2      GLY 184   4.062  11.786   1.866
 1300    HA3  GLY 184           HA3      GLY 184   5.365  12.809   2.457
 1301    H    VAL 185           H        VAL 185   6.312   9.682   1.442
 1302    HA   VAL 185           HA       VAL 185   7.851  10.815  -0.698
 1303    HB   VAL 185           HB       VAL 185   8.513   8.412  -1.133
 1304   HG11  VAL 185          HG11      VAL 185   9.892   9.912   0.190
 1305   HG12  VAL 185          HG12      VAL 185   8.955   9.526   1.635
 1306   HG13  VAL 185          HG13      VAL 185   9.933   8.280   0.858
 1307   HG21  VAL 185          HG21      VAL 185   6.903   7.980   1.375
 1308   HG22  VAL 185          HG22      VAL 185   6.561   7.316  -0.222
 1309   HG23  VAL 185          HG23      VAL 185   8.003   6.801   0.655
 1310    H    GLU 186           H        GLU 186   7.847   9.808  -2.864
 1311    HA   GLU 186           HA       GLU 186   5.122   9.804  -3.849
 1312    HB2  GLU 186           HB2      GLU 186   7.613   9.652  -5.540
 1313    HB3  GLU 186           HB3      GLU 186   6.042  10.305  -5.961
 1314    HG2  GLU 186           HG2      GLU 186   6.364  12.197  -4.572
 1315    HG3  GLU 186           HG3      GLU 186   7.838  11.525  -3.887
 1316    H    GLU 187           H        GLU 187   4.996   8.260  -5.927
 1317    HA   GLU 187           HA       GLU 187   5.970   5.616  -5.082
 1318    HB2  GLU 187           HB2      GLU 187   3.339   6.495  -6.206
 1319    HB3  GLU 187           HB3      GLU 187   3.907   4.864  -6.528
 1320    HG2  GLU 187           HG2      GLU 187   2.425   4.848  -4.633
 1321    HG3  GLU 187           HG3      GLU 187   4.058   4.459  -4.111
 1322    H    HIS 188           H        HIS 188   7.037   7.776  -6.912
 1323    HA   HIS 188           HA       HIS 188   7.399   6.103  -9.296
 1324    HB2  HIS 188           HB2      HIS 188   7.227   8.137 -10.733
 1325    HB3  HIS 188           HB3      HIS 188   5.714   7.705  -9.948
 1326    HD1  HIS 188           HD1      HIS 188   4.747   9.345  -8.235
 1327    HD2  HIS 188           HD2      HIS 188   8.402  10.545  -9.821
 1328    HE1  HIS 188           HE1      HIS 188   5.105  11.698  -7.432
 1329    HE2  HIS 188           HE2      HIS 188   7.384  12.333  -8.254
 1330    H    GLU 189           H        GLU 189   8.942   7.144  -6.805
 1331    HA   GLU 189           HA       GLU 189  11.250   8.318  -8.190
 1332    HB2  GLU 189           HB2      GLU 189  11.877   8.165  -5.498
 1333    HB3  GLU 189           HB3      GLU 189  11.274   9.582  -6.343
 1334    HG2  GLU 189           HG2      GLU 189   9.965   9.277  -4.380
 1335    HG3  GLU 189           HG3      GLU 189   8.965   8.875  -5.771
 1336    H    THR 190           H        THR 190  13.409   7.425  -7.808
 1337    HA   THR 190           HA       THR 190  13.363   4.547  -7.661
 1338    HB   THR 190           HB       THR 190  15.665   6.449  -8.139
 1339    HG1  THR 190           HG1      THR 190  14.333   6.454  -9.915
 1340   HG21  THR 190          HG21      THR 190  16.449   4.339  -7.156
 1341   HG22  THR 190          HG22      THR 190  16.926   4.473  -8.848
 1342   HG23  THR 190          HG23      THR 190  15.574   3.437  -8.394
 1343    H    LEU 191           H        LEU 191  13.951   3.316  -6.051
 1344    HA   LEU 191           HA       LEU 191  15.012   4.585  -3.609
 1345    HB2  LEU 191           HB2      LEU 191  13.514   1.965  -3.717
 1346    HB3  LEU 191           HB3      LEU 191  13.894   2.923  -2.303
 1347    HG   LEU 191           HG       LEU 191  11.637   3.299  -2.541
 1348   HD11  LEU 191          HD11      LEU 191  12.867   5.484  -4.198
 1349   HD12  LEU 191          HD12      LEU 191  11.301   5.551  -3.391
 1350   HD13  LEU 191          HD13      LEU 191  12.779   5.430  -2.438
 1351   HD21  LEU 191          HD21      LEU 191  11.998   3.449  -5.527
 1352   HD22  LEU 191          HD22      LEU 191  11.319   2.097  -4.621
 1353   HD23  LEU 191          HD23      LEU 191  10.474   3.644  -4.663
 1354    H    LEU 192           H        LEU 192  16.835   3.570  -2.633
 1355    HA   LEU 192           HA       LEU 192  18.084   1.598  -4.427
 1356    HB2  LEU 192           HB2      LEU 192  19.594   3.350  -2.530
 1357    HB3  LEU 192           HB3      LEU 192  20.159   2.567  -3.991
 1358    HG   LEU 192           HG       LEU 192  18.201   4.858  -3.985
 1359   HD11  LEU 192          HD11      LEU 192  20.073   6.264  -4.608
 1360   HD12  LEU 192          HD12      LEU 192  20.328   5.542  -3.019
 1361   HD13  LEU 192          HD13      LEU 192  21.174   4.896  -4.425
 1362   HD21  LEU 192          HD21      LEU 192  19.875   3.649  -6.184
 1363   HD22  LEU 192          HD22      LEU 192  18.136   3.438  -5.977
 1364   HD23  LEU 192          HD23      LEU 192  18.793   5.036  -6.336
 1365    H    LEU 193           H        LEU 193  18.675  -0.316  -3.594
 1366    HA   LEU 193           HA       LEU 193  18.391  -0.773  -0.756
 1367    HB2  LEU 193           HB2      LEU 193  17.626  -2.393  -2.514
 1368    HB3  LEU 193           HB3      LEU 193  19.305  -2.654  -2.938
 1369    HG   LEU 193           HG       LEU 193  18.449  -3.143  -0.116
 1370   HD11  LEU 193          HD11      LEU 193  18.053  -5.061  -2.407
 1371   HD12  LEU 193          HD12      LEU 193  17.846  -5.431  -0.695
 1372   HD13  LEU 193          HD13      LEU 193  16.768  -4.281  -1.486
 1373   HD21  LEU 193          HD21      LEU 193  20.443  -4.427  -1.977
 1374   HD22  LEU 193          HD22      LEU 193  20.806  -3.278  -0.688
 1375   HD23  LEU 193          HD23      LEU 193  20.175  -4.876  -0.292
 1376    H    ARG 194           H        ARG 194  20.003  -0.534   0.622
 1377    HA   ARG 194           HA       ARG 194  22.772  -0.576  -0.385
 1378    HB2  ARG 194           HB2      ARG 194  21.564   1.353   1.607
 1379    HB3  ARG 194           HB3      ARG 194  23.284   1.215   1.278
 1380    HG2  ARG 194           HG2      ARG 194  21.171   2.028  -0.702
 1381    HG3  ARG 194           HG3      ARG 194  22.297   3.109   0.120
 1382    HD2  ARG 194           HD2      ARG 194  22.984   0.917  -1.827
 1383    HD3  ARG 194           HD3      ARG 194  23.087   2.655  -2.108
 1384    HE   ARG 194           HE       ARG 194  24.678   2.077   0.115
 1385   HH11  ARG 194          HH11      ARG 194  24.573   1.249  -3.297
 1386   HH12  ARG 194          HH12      ARG 194  26.301   1.178  -3.463
 1387   HH21  ARG 194          HH21      ARG 194  26.951   1.956  -0.094
 1388   HH22  ARG 194          HH22      ARG 194  27.651   1.538  -1.634
 1389    H    ARG 195           H        ARG 195  24.216  -1.707   0.869
 1390    HA   ARG 195           HA       ARG 195  23.041  -3.097   3.130
 1391    HB2  ARG 195           HB2      ARG 195  24.853  -4.585   3.093
 1392    HB3  ARG 195           HB3      ARG 195  24.483  -4.270   1.410
 1393    HG2  ARG 195           HG2      ARG 195  26.383  -2.808   1.212
 1394    HG3  ARG 195           HG3      ARG 195  26.715  -2.957   2.941
 1395    HD2  ARG 195           HD2      ARG 195  26.866  -5.130   0.855
 1396    HD3  ARG 195           HD3      ARG 195  28.207  -4.414   1.749
 1397    HE   ARG 195           HE       ARG 195  26.526  -5.432   3.671
 1398   HH11  ARG 195          HH11      ARG 195  28.402  -6.695   0.995
 1399   HH12  ARG 195          HH12      ARG 195  28.475  -8.304   1.653
 1400   HH21  ARG 195          HH21      ARG 195  26.591  -7.555   4.520
 1401   HH22  ARG 195          HH22      ARG 195  27.420  -8.804   3.632
 1402    H    LYS 196           H        LYS 196  23.170  -2.432   5.078
 1403    HA   LYS 196           HA       LYS 196  24.900  -0.213   5.787
 1404    HB2  LYS 196           HB2      LYS 196  22.524  -0.250   6.484
 1405    HB3  LYS 196           HB3      LYS 196  22.815  -1.728   7.387
 1406    HG2  LYS 196           HG2      LYS 196  22.780   0.044   8.943
 1407    HG3  LYS 196           HG3      LYS 196  24.464  -0.450   8.768
 1408    HD2  LYS 196           HD2      LYS 196  24.853   1.414   7.237
 1409    HD3  LYS 196           HD3      LYS 196  23.165   1.905   7.403
 1410    HE2  LYS 196           HE2      LYS 196  23.549   2.167   9.848
 1411    HE3  LYS 196           HE3      LYS 196  25.261   1.842   9.565
 1412    HZ1  LYS 196           HZ1      LYS 196  24.868   4.209   9.659
 1413    HZ2  LYS 196           HZ2      LYS 196  23.714   4.111   8.424
 1414    HZ3  LYS 196           HZ3      LYS 196  25.341   3.774   8.090
 1415    H    PHE 197           H        PHE 197  24.360  -3.601   6.546
 1416    HA   PHE 197           HA       PHE 197  26.805  -3.652   8.177
 1417    HB2  PHE 197           HB2      PHE 197  24.787  -5.890   7.927
 1418    HB3  PHE 197           HB3      PHE 197  25.992  -5.648   9.191
 1419    HD1  PHE 197           HD1      PHE 197  25.607  -2.876   9.944
 1420    HD2  PHE 197           HD2      PHE 197  22.718  -5.831   8.956
 1421    HE1  PHE 197           HE1      PHE 197  23.974  -1.728  11.369
 1422    HE2  PHE 197           HE2      PHE 197  21.061  -4.690  10.368
 1423    HZ   PHE 197           HZ       PHE 197  21.622  -2.542  11.425
 1424    H    PHE 198           H        PHE 198  28.353  -5.375   7.763
 1425    HA   PHE 198           HA       PHE 198  28.323  -6.180   4.925
 1426    HB2  PHE 198           HB2      PHE 198  30.608  -5.018   6.530
 1427    HB3  PHE 198           HB3      PHE 198  30.806  -5.764   4.950
 1428    HD1  PHE 198           HD1      PHE 198  29.164  -2.956   6.726
 1429    HD2  PHE 198           HD2      PHE 198  30.432  -4.549   2.990
 1430    HE1  PHE 198           HE1      PHE 198  28.693  -0.795   5.649
 1431    HE2  PHE 198           HE2      PHE 198  29.963  -2.389   1.906
 1432    HZ   PHE 198           HZ       PHE 198  29.091  -0.509   3.235
 1433    H    TYR 199           H        TYR 199  27.552  -7.888   7.122
 1434    HA   TYR 199           HA       TYR 199  29.953  -9.496   7.549
 1435    HB2  TYR 199           HB2      TYR 199  28.712 -10.681   9.297
 1436    HB3  TYR 199           HB3      TYR 199  28.758  -8.950   9.579
 1437    HD1  TYR 199           HD1      TYR 199  26.706  -7.618   9.436
 1438    HD2  TYR 199           HD2      TYR 199  26.644 -11.828   8.847
 1439    HE1  TYR 199           HE1      TYR 199  24.267  -7.623   9.751
 1440    HE2  TYR 199           HE2      TYR 199  24.209 -11.847   9.164
 1441    HH   TYR 199           HH       TYR 199  22.475 -10.491  10.214
 1442    H    SER 200           H        SER 200  26.713  -9.771   6.168
 1443    HA   SER 200           HA       SER 200  25.704 -11.414   4.966
 1444    HB2  SER 200           HB2      SER 200  28.538 -11.699   3.967
 1445    HB3  SER 200           HB3      SER 200  27.150 -12.483   3.214
 1446    HG   SER 200           HG       SER 200  26.267 -10.451   2.806
 1447    H    ASP 201           H        ASP 201  25.691 -12.367   7.299
 1448    HA   ASP 201           HA       ASP 201  25.371 -14.261   8.482
 1449    HB2  ASP 201           HB2      ASP 201  24.587 -15.211   6.374
 1450    HB3  ASP 201           HB3      ASP 201  26.236 -15.632   5.935
 1451    H    GLN 202           H        GLN 202  28.285 -13.118   7.646
 1452    HA   GLN 202           HA       GLN 202  29.793 -15.222   9.026
 1453    HB2  GLN 202           HB2      GLN 202  30.504 -14.099   6.768
 1454    HB3  GLN 202           HB3      GLN 202  31.028 -12.775   7.793
 1455    HG2  GLN 202           HG2      GLN 202  31.988 -15.618   8.032
 1456    HG3  GLN 202           HG3      GLN 202  32.838 -14.334   7.179
 1457   HE21  GLN 202          HE21      GLN 202  32.022 -15.690  10.238
 1458   HE22  GLN 202          HE22      GLN 202  33.036 -14.667  11.204
  Start of MODEL   14
    1    H1   GLY  -5           H1       GLY  -5 -24.715  -8.927   7.361
    2    H2   GLY  -5           H2       GLY  -5 -23.881  -7.872   6.330
    3    H3   GLY  -5           H3       GLY  -5 -23.018  -8.872   7.393
    4    HA2  GLY  -5           HA2      GLY  -5 -22.919  -9.719   5.132
    5    HA3  GLY  -5           HA3      GLY  -5 -23.747 -10.834   6.214
    6    H    ILE  -4           H        ILE  -4 -25.736 -11.487   5.693
    7    HA   ILE  -4           HA       ILE  -4 -27.029 -10.247   3.380
    8    HB   ILE  -4           HB       ILE  -4 -27.990 -12.699   4.863
    9   HG12  ILE  -4          HG12      ILE  -4 -26.106 -12.618   2.493
   10   HG13  ILE  -4          HG13      ILE  -4 -25.625 -13.002   4.142
   11   HG21  ILE  -4          HG21      ILE  -4 -28.404 -11.716   2.038
   12   HG22  ILE  -4          HG22      ILE  -4 -29.043 -13.220   2.701
   13   HG23  ILE  -4          HG23      ILE  -4 -29.590 -11.672   3.342
   14   HD11  ILE  -4          HD11      ILE  -4 -25.878 -15.009   2.803
   15   HD12  ILE  -4          HD12      ILE  -4 -27.069 -14.966   4.104
   16   HD13  ILE  -4          HD13      ILE  -4 -27.552 -14.579   2.453
   17    H    ASP  -3           H        ASP  -3 -27.170  -8.414   5.053
   18    HA   ASP  -3           HA       ASP  -3 -29.263  -8.744   7.044
   19    HB2  ASP  -3           HB2      ASP  -3 -27.339  -6.496   6.425
   20    HB3  ASP  -3           HB3      ASP  -3 -28.608  -6.362   7.636
   21    HA   PRO  -2           HA       PRO  -2 -32.472  -6.652   4.738
   22    HB2  PRO  -2           HB2      PRO  -2 -33.091  -5.257   7.278
   23    HB3  PRO  -2           HB3      PRO  -2 -34.131  -6.272   6.274
   24    HG2  PRO  -2           HG2      PRO  -2 -33.190  -7.148   8.617
   25    HG3  PRO  -2           HG3      PRO  -2 -33.358  -8.235   7.226
   26    HD2  PRO  -2           HD2      PRO  -2 -30.900  -6.936   8.333
   27    HD3  PRO  -2           HD3      PRO  -2 -31.116  -8.577   7.687
   28    H    PHE  -1           H        PHE  -1 -32.002  -5.000   3.427
   29    HA   PHE  -1           HA       PHE  -1 -30.054  -3.052   4.271
   30    HB2  PHE  -1           HB2      PHE  -1 -31.357  -3.596   1.607
   31    HB3  PHE  -1           HB3      PHE  -1 -30.215  -2.283   1.870
   32    HD1  PHE  -1           HD1      PHE  -1 -27.893  -2.842   2.646
   33    HD2  PHE  -1           HD2      PHE  -1 -30.616  -5.778   1.218
   34    HE1  PHE  -1           HE1      PHE  -1 -26.014  -4.384   2.251
   35    HE2  PHE  -1           HE2      PHE  -1 -28.746  -7.329   0.819
   36    HZ   PHE  -1           HZ       PHE  -1 -26.441  -6.632   1.338
   37    H    THR   0           H        THR   0 -31.689  -2.280   5.858
   38    HA   THR   0           HA       THR   0 -33.447  -0.222   4.834
   39    HB   THR   0           HB       THR   0 -33.669   0.418   7.249
   40    HG1  THR   0           HG1      THR   0 -32.175  -0.282   8.556
   41   HG21  THR   0          HG21      THR   0 -34.127  -2.500   6.621
   42   HG22  THR   0          HG22      THR   0 -35.230  -1.171   6.264
   43   HG23  THR   0          HG23      THR   0 -34.885  -1.606   7.938
   44    H    MET   1           H        MET   1 -32.749   1.844   6.754
   45    HA   MET   1           HA       MET   1 -30.471   2.906   5.333
   46    HB2  MET   1           HB2      MET   1 -32.387   4.364   5.754
   47    HB3  MET   1           HB3      MET   1 -32.150   4.190   7.486
   48    HG2  MET   1           HG2      MET   1 -31.237   6.269   6.113
   49    HG3  MET   1           HG3      MET   1 -30.422   5.636   7.539
   50    HE1  MET   1           HE1      MET   1 -29.037   4.511   3.262
   51    HE2  MET   1           HE2      MET   1 -30.540   3.952   3.991
   52    HE3  MET   1           HE3      MET   1 -30.367   5.645   3.519
   53    H    VAL   2           H        VAL   2 -29.366   0.985   6.304
   54    HA   VAL   2           HA       VAL   2 -27.565   2.078   8.303
   55    HB   VAL   2           HB       VAL   2 -27.240  -0.207   9.268
   56   HG11  VAL   2          HG11      VAL   2 -30.027   0.909   9.529
   57   HG12  VAL   2          HG12      VAL   2 -29.267  -0.221  10.651
   58   HG13  VAL   2          HG13      VAL   2 -28.610   1.403  10.454
   59   HG21  VAL   2          HG21      VAL   2 -28.120  -1.517   7.408
   60   HG22  VAL   2          HG22      VAL   2 -28.946  -1.922   8.914
   61   HG23  VAL   2          HG23      VAL   2 -29.739  -0.891   7.721
   62    H    ALA   3           H        ALA   3 -27.120   2.457   5.794
   63    HA   ALA   3           HA       ALA   3 -25.084   0.498   5.069
   64    HB1  ALA   3           HB1      ALA   3 -26.974  -0.103   3.687
   65    HB2  ALA   3           HB2      ALA   3 -27.191   1.579   3.194
   66    HB3  ALA   3           HB3      ALA   3 -25.756   0.691   2.684
   67    H    LEU   4           H        LEU   4 -23.432   1.374   3.791
   68    HA   LEU   4           HA       LEU   4 -23.252   4.301   4.034
   69    HB2  LEU   4           HB2      LEU   4 -21.131   2.182   4.266
   70    HB3  LEU   4           HB3      LEU   4 -20.767   3.893   4.155
   71    HG   LEU   4           HG       LEU   4 -22.258   2.501   6.380
   72   HD11  LEU   4          HD11      LEU   4 -20.355   3.177   7.744
   73   HD12  LEU   4          HD12      LEU   4 -19.849   2.142   6.408
   74   HD13  LEU   4          HD13      LEU   4 -19.583   3.885   6.324
   75   HD21  LEU   4          HD21      LEU   4 -23.231   4.686   6.023
   76   HD22  LEU   4          HD22      LEU   4 -22.255   4.701   7.491
   77   HD23  LEU   4          HD23      LEU   4 -21.633   5.429   6.010
   78    H    SER   5           H        SER   5 -22.779   5.409   2.256
   79    HA   SER   5           HA       SER   5 -22.638   3.909  -0.251
   80    HB2  SER   5           HB2      SER   5 -23.090   6.869   0.224
   81    HB3  SER   5           HB3      SER   5 -23.146   6.061  -1.338
   82    HG   SER   5           HG       SER   5 -24.932   5.888   0.825
   83    H    LEU   6           H        LEU   6 -20.609   3.380  -0.802
   84    HA   LEU   6           HA       LEU   6 -18.503   5.334  -0.165
   85    HB2  LEU   6           HB2      LEU   6 -18.190   2.354  -0.533
   86    HB3  LEU   6           HB3      LEU   6 -16.957   3.486   0.005
   87    HG   LEU   6           HG       LEU   6 -19.436   2.669   1.524
   88   HD11  LEU   6          HD11      LEU   6 -16.513   2.213   2.091
   89   HD12  LEU   6          HD12      LEU   6 -17.863   1.727   3.120
   90   HD13  LEU   6          HD13      LEU   6 -17.661   0.999   1.525
   91   HD21  LEU   6          HD21      LEU   6 -17.291   4.651   2.270
   92   HD22  LEU   6          HD22      LEU   6 -18.982   5.015   1.919
   93   HD23  LEU   6          HD23      LEU   6 -18.562   4.062   3.343
   94    H    LYS   7           H        LYS   7 -17.513   6.260  -1.799
   95    HA   LYS   7           HA       LYS   7 -17.924   5.361  -4.504
   96    HB2  LYS   7           HB2      LYS   7 -16.485   7.657  -3.234
   97    HB3  LYS   7           HB3      LYS   7 -16.099   7.221  -4.892
   98    HG2  LYS   7           HG2      LYS   7 -18.482   7.485  -5.477
   99    HG3  LYS   7           HG3      LYS   7 -18.797   8.022  -3.825
  100    HD2  LYS   7           HD2      LYS   7 -17.480   9.962  -4.100
  101    HD3  LYS   7           HD3      LYS   7 -16.758   9.351  -5.591
  102    HE2  LYS   7           HE2      LYS   7 -18.911   9.518  -6.713
  103    HE3  LYS   7           HE3      LYS   7 -19.657  10.092  -5.221
  104    HZ1  LYS   7           HZ1      LYS   7 -18.386  12.075  -5.306
  105    HZ2  LYS   7           HZ2      LYS   7 -19.055  11.862  -6.853
  106    HZ3  LYS   7           HZ3      LYS   7 -17.422  11.495  -6.576
  107    H    ILE   8           H        ILE   8 -16.905   3.588  -5.137
  108    HA   ILE   8           HA       ILE   8 -14.341   2.877  -3.979
  109    HB   ILE   8           HB       ILE   8 -15.994   1.387  -6.028
  110   HG12  ILE   8          HG12      ILE   8 -17.242   1.624  -3.942
  111   HG13  ILE   8          HG13      ILE   8 -16.702  -0.038  -4.139
  112   HG21  ILE   8          HG21      ILE   8 -14.627  -0.537  -5.385
  113   HG22  ILE   8          HG22      ILE   8 -13.648   0.768  -6.052
  114   HG23  ILE   8          HG23      ILE   8 -13.684   0.496  -4.310
  115   HD11  ILE   8          HD11      ILE   8 -14.875   0.378  -2.570
  116   HD12  ILE   8          HD12      ILE   8 -15.439   2.037  -2.366
  117   HD13  ILE   8          HD13      ILE   8 -16.453   0.691  -1.847
  118    H    SER   9           H        SER   9 -12.787   4.159  -4.852
  119    HA   SER   9           HA       SER   9 -12.732   4.578  -7.726
  120    HB2  SER   9           HB2      SER   9 -10.685   5.965  -7.165
  121    HB3  SER   9           HB3      SER   9 -12.190   6.517  -6.430
  122    HG   SER   9           HG       SER   9 -10.334   4.823  -5.115
  123    H    ILE  10           H        ILE  10 -12.042   2.848  -8.838
  124    HA   ILE  10           HA       ILE  10  -9.809   1.287  -7.770
  125    HB   ILE  10           HB       ILE  10 -11.529   0.715 -10.193
  126   HG12  ILE  10          HG12      ILE  10 -11.602  -0.493  -7.416
  127   HG13  ILE  10          HG13      ILE  10 -12.794   0.623  -8.071
  128   HG21  ILE  10          HG21      ILE  10 -10.535  -1.524 -10.094
  129   HG22  ILE  10          HG22      ILE  10  -9.308  -0.282 -10.346
  130   HG23  ILE  10          HG23      ILE  10  -9.515  -1.008  -8.751
  131   HD11  ILE  10          HD11      ILE  10 -13.406  -1.026  -9.761
  132   HD12  ILE  10          HD12      ILE  10 -12.206  -2.141  -9.108
  133   HD13  ILE  10          HD13      ILE  10 -13.594  -1.667  -8.129
  134    H    GLY  11           H        GLY  11  -8.045   2.537  -8.139
  135    HA2  GLY  11           HA2      GLY  11  -6.294   3.411  -9.351
  136    HA3  GLY  11           HA3      GLY  11  -7.032   2.739 -10.800
  137    H    ASN  12           H        ASN  12  -8.436   3.983 -12.021
  138    HA   ASN  12           HA       ASN  12  -8.485   6.841 -11.307
  139    HB2  ASN  12           HB2      ASN  12  -8.405   7.369 -13.683
  140    HB3  ASN  12           HB3      ASN  12  -7.034   6.355 -13.247
  141   HD21  ASN  12          HD21      ASN  12  -8.360   6.824 -15.826
  142   HD22  ASN  12          HD22      ASN  12  -8.821   5.257 -16.413
  143    H    VAL  13           H        VAL  13 -10.362   4.094 -11.989
  144    HA   VAL  13           HA       VAL  13 -12.665   5.628 -12.921
  145    HB   VAL  13           HB       VAL  13 -12.088   3.443 -13.986
  146   HG11  VAL  13          HG11      VAL  13 -12.951   2.274 -11.348
  147   HG12  VAL  13          HG12      VAL  13 -12.633   1.363 -12.824
  148   HG13  VAL  13          HG13      VAL  13 -11.324   2.236 -12.029
  149   HG21  VAL  13          HG21      VAL  13 -14.376   2.558 -14.045
  150   HG22  VAL  13          HG22      VAL  13 -14.790   3.558 -12.651
  151   HG23  VAL  13          HG23      VAL  13 -14.342   4.316 -14.180
  152    H    VAL  14           H        VAL  14 -14.798   5.242 -11.844
  153    HA   VAL  14           HA       VAL  14 -14.475   4.827  -8.959
  154    HB   VAL  14           HB       VAL  14 -14.576   7.257  -9.375
  155   HG11  VAL  14          HG11      VAL  14 -15.917   7.252 -11.411
  156   HG12  VAL  14          HG12      VAL  14 -17.324   6.713 -10.491
  157   HG13  VAL  14          HG13      VAL  14 -16.622   8.302 -10.183
  158   HG21  VAL  14          HG21      VAL  14 -15.417   6.399  -7.277
  159   HG22  VAL  14          HG22      VAL  14 -16.405   7.761  -7.803
  160   HG23  VAL  14          HG23      VAL  14 -17.002   6.112  -7.995
  161    H    LYS  15           H        LYS  15 -15.744   3.320  -8.239
  162    HA   LYS  15           HA       LYS  15 -18.260   2.738  -9.661
  163    HB2  LYS  15           HB2      LYS  15 -16.600   0.918  -7.900
  164    HB3  LYS  15           HB3      LYS  15 -18.075   0.468  -8.746
  165    HG2  LYS  15           HG2      LYS  15 -15.546   1.370 -10.106
  166    HG3  LYS  15           HG3      LYS  15 -15.992  -0.315  -9.842
  167    HD2  LYS  15           HD2      LYS  15 -17.996  -0.016 -11.189
  168    HD3  LYS  15           HD3      LYS  15 -17.614   1.694 -11.405
  169    HE2  LYS  15           HE2      LYS  15 -15.603   1.134 -12.616
  170    HE3  LYS  15           HE3      LYS  15 -15.855  -0.582 -12.305
  171    HZ1  LYS  15           HZ1      LYS  15 -16.532   0.062 -14.541
  172    HZ2  LYS  15           HZ2      LYS  15 -17.662   1.151 -13.907
  173    HZ3  LYS  15           HZ3      LYS  15 -17.846  -0.518 -13.645
  174    H    THR  16           H        THR  16 -20.142   2.681  -8.460
  175    HA   THR  16           HA       THR  16 -19.842   3.775  -5.747
  176    HB   THR  16           HB       THR  16 -22.243   3.896  -7.581
  177    HG1  THR  16           HG1      THR  16 -20.515   5.213  -8.304
  178   HG21  THR  16          HG21      THR  16 -22.888   3.951  -5.221
  179   HG22  THR  16          HG22      THR  16 -23.110   5.538  -5.958
  180   HG23  THR  16          HG23      THR  16 -21.717   5.235  -4.919
  181    H    MET  17           H        MET  17 -20.099   2.360  -4.146
  182    HA   MET  17           HA       MET  17 -22.135   0.286  -4.420
  183    HB2  MET  17           HB2      MET  17 -19.226  -0.156  -3.922
  184    HB3  MET  17           HB3      MET  17 -20.371  -1.142  -3.024
  185    HG2  MET  17           HG2      MET  17 -21.403  -1.726  -5.261
  186    HG3  MET  17           HG3      MET  17 -19.976  -0.991  -5.993
  187    HE1  MET  17           HE1      MET  17 -19.713  -4.562  -3.073
  188    HE2  MET  17           HE2      MET  17 -20.235  -2.931  -2.640
  189    HE3  MET  17           HE3      MET  17 -21.267  -3.951  -3.648
  190    H    GLN  18           H        GLN  18 -23.053  -0.360  -2.489
  191    HA   GLN  18           HA       GLN  18 -22.305   1.277  -0.168
  192    HB2  GLN  18           HB2      GLN  18 -24.943   0.134  -1.046
  193    HB3  GLN  18           HB3      GLN  18 -24.670   0.656   0.614
  194    HG2  GLN  18           HG2      GLN  18 -24.563   2.851   0.066
  195    HG3  GLN  18           HG3      GLN  18 -23.950   2.533  -1.558
  196   HE21  GLN  18          HE21      GLN  18 -25.393   3.830  -2.569
  197   HE22  GLN  18          HE22      GLN  18 -27.067   3.449  -2.709
  198    H    PHE  19           H        PHE  19 -21.989   0.332   1.795
  199    HA   PHE  19           HA       PHE  19 -22.060  -2.594   1.935
  200    HB2  PHE  19           HB2      PHE  19 -19.812  -0.830   2.961
  201    HB3  PHE  19           HB3      PHE  19 -19.932  -2.570   3.171
  202    HD1  PHE  19           HD1      PHE  19 -19.572  -4.074   1.266
  203    HD2  PHE  19           HD2      PHE  19 -19.030   0.131   0.934
  204    HE1  PHE  19           HE1      PHE  19 -18.279  -4.406  -0.803
  205    HE2  PHE  19           HE2      PHE  19 -17.737  -0.190  -1.130
  206    HZ   PHE  19           HZ       PHE  19 -17.359  -2.461  -2.003
  207    H    GLU  20           H        GLU  20 -22.190  -3.296   4.209
  208    HA   GLU  20           HA       GLU  20 -23.847  -1.516   5.753
  209    HB2  GLU  20           HB2      GLU  20 -22.612  -4.075   6.731
  210    HB3  GLU  20           HB3      GLU  20 -24.090  -3.303   7.280
  211    HG2  GLU  20           HG2      GLU  20 -25.311  -4.060   5.482
  212    HG3  GLU  20           HG3      GLU  20 -23.873  -4.298   4.481
  213    HA   PRO  21           HA       PRO  21 -20.927   0.506   8.497
  214    HB2  PRO  21           HB2      PRO  21 -22.329  -0.504  10.799
  215    HB3  PRO  21           HB3      PRO  21 -22.409   1.118  10.110
  216    HG2  PRO  21           HG2      PRO  21 -24.234  -1.183   9.730
  217    HG3  PRO  21           HG3      PRO  21 -24.583   0.554   9.600
  218    HD2  PRO  21           HD2      PRO  21 -24.439  -0.988   7.436
  219    HD3  PRO  21           HD3      PRO  21 -23.803   0.671   7.424
  220    H    SER  22           H        SER  22 -22.124  -2.674   9.633
  221    HA   SER  22           HA       SER  22 -19.379  -3.319  10.428
  222    HB2  SER  22           HB2      SER  22 -20.550  -5.177  11.752
  223    HB3  SER  22           HB3      SER  22 -20.776  -3.520  12.308
  224    HG   SER  22           HG       SER  22 -22.632  -4.538  10.471
  225    H    THR  23           H        THR  23 -20.219  -3.538   7.643
  226    HA   THR  23           HA       THR  23 -20.486  -6.250   6.917
  227    HB   THR  23           HB       THR  23 -19.259  -3.886   5.507
  228    HG1  THR  23           HG1      THR  23 -21.575  -5.492   5.104
  229   HG21  THR  23          HG21      THR  23 -19.038  -5.260   3.490
  230   HG22  THR  23          HG22      THR  23 -19.469  -6.695   4.424
  231   HG23  THR  23          HG23      THR  23 -17.977  -5.826   4.781
  232    H    MET  24           H        MET  24 -17.685  -4.233   7.553
  233    HA   MET  24           HA       MET  24 -15.583  -4.692   8.261
  234    HB2  MET  24           HB2      MET  24 -16.900  -6.805   9.280
  235    HB3  MET  24           HB3      MET  24 -15.843  -7.642   8.152
  236    HG2  MET  24           HG2      MET  24 -13.919  -6.937   9.248
  237    HG3  MET  24           HG3      MET  24 -14.768  -5.638  10.093
  238    HE1  MET  24           HE1      MET  24 -14.222  -6.035  12.541
  239    HE2  MET  24           HE2      MET  24 -13.948  -7.640  13.224
  240    HE3  MET  24           HE3      MET  24 -12.950  -7.069  11.885
  241    H    VAL  25           H        VAL  25 -13.761  -4.776   7.184
  242    HA   VAL  25           HA       VAL  25 -13.649  -4.536   4.517
  243    HB   VAL  25           HB       VAL  25 -11.476  -5.490   6.352
  244   HG11  VAL  25          HG11      VAL  25 -10.921  -6.264   4.094
  245   HG12  VAL  25          HG12      VAL  25 -11.190  -4.637   3.469
  246   HG13  VAL  25          HG13      VAL  25  -9.866  -4.942   4.593
  247   HG21  VAL  25          HG21      VAL  25 -12.335  -3.269   6.752
  248   HG22  VAL  25          HG22      VAL  25 -10.710  -3.172   6.073
  249   HG23  VAL  25          HG23      VAL  25 -12.114  -2.852   5.053
  250    H    TYR  26           H        TYR  26 -12.882  -7.637   6.131
  251    HA   TYR  26           HA       TYR  26 -12.179  -8.977   3.794
  252    HB2  TYR  26           HB2      TYR  26 -12.479 -11.080   4.996
  253    HB3  TYR  26           HB3      TYR  26 -11.625  -9.898   5.974
  254    HD1  TYR  26           HD1      TYR  26 -14.820 -11.683   5.529
  255    HD2  TYR  26           HD2      TYR  26 -12.532  -9.137   8.051
  256    HE1  TYR  26           HE1      TYR  26 -16.401 -12.094   7.362
  257    HE2  TYR  26           HE2      TYR  26 -14.111  -9.538   9.891
  258    HH   TYR  26           HH       TYR  26 -16.404 -12.010   9.842
  259    H    ASP  27           H        ASP  27 -15.348  -8.454   5.180
  260    HA   ASP  27           HA       ASP  27 -16.623 -10.256   3.316
  261    HB2  ASP  27           HB2      ASP  27 -17.507  -9.763   5.637
  262    HB3  ASP  27           HB3      ASP  27 -17.989  -8.186   5.024
  263    H    ALA  28           H        ALA  28 -15.958  -6.812   3.555
  264    HA   ALA  28           HA       ALA  28 -17.630  -5.987   1.450
  265    HB1  ALA  28           HB1      ALA  28 -16.664  -4.430   3.074
  266    HB2  ALA  28           HB2      ALA  28 -15.057  -4.742   2.419
  267    HB3  ALA  28           HB3      ALA  28 -16.278  -3.955   1.420
  268    H    CYS  29           H        CYS  29 -14.185  -6.778   1.537
  269    HA   CYS  29           HA       CYS  29 -13.638  -6.317  -1.145
  270    HB2  CYS  29           HB2      CYS  29 -11.626  -7.661  -0.789
  271    HB3  CYS  29           HB3      CYS  29 -11.893  -6.527   0.518
  272    HG   CYS  29           HG       CYS  29 -13.332  -9.156   1.583
  273    H    ARG  30           H        ARG  30 -15.200  -9.053   0.311
  274    HA   ARG  30           HA       ARG  30 -14.732 -10.789  -1.940
  275    HB2  ARG  30           HB2      ARG  30 -16.173 -12.389  -0.874
  276    HB3  ARG  30           HB3      ARG  30 -15.095 -11.700   0.322
  277    HG2  ARG  30           HG2      ARG  30 -16.975 -10.179   1.021
  278    HG3  ARG  30           HG3      ARG  30 -18.012 -11.094  -0.075
  279    HD2  ARG  30           HD2      ARG  30 -18.169 -11.832   2.288
  280    HD3  ARG  30           HD3      ARG  30 -17.689 -13.110   1.174
  281    HE   ARG  30           HE       ARG  30 -15.314 -12.204   2.062
  282   HH11  ARG  30          HH11      ARG  30 -18.203 -12.975   3.872
  283   HH12  ARG  30          HH12      ARG  30 -17.328 -13.697   5.189
  284   HH21  ARG  30          HH21      ARG  30 -14.172 -13.148   3.741
  285   HH22  ARG  30          HH22      ARG  30 -15.019 -13.805   5.112
  286    H    MET  31           H        MET  31 -17.396  -8.750  -0.830
  287    HA   MET  31           HA       MET  31 -19.212  -9.576  -2.850
  288    HB2  MET  31           HB2      MET  31 -19.177  -7.057  -1.187
  289    HB3  MET  31           HB3      MET  31 -20.532  -7.631  -2.145
  290    HG2  MET  31           HG2      MET  31 -20.689  -9.622  -0.771
  291    HG3  MET  31           HG3      MET  31 -19.307  -9.091   0.176
  292    HE1  MET  31           HE1      MET  31 -19.231  -7.078   1.682
  293    HE2  MET  31           HE2      MET  31 -19.792  -5.969   0.424
  294    HE3  MET  31           HE3      MET  31 -20.574  -5.967   2.012
  295    H    ILE  32           H        ILE  32 -16.954  -6.866  -2.563
  296    HA   ILE  32           HA       ILE  32 -17.817  -5.577  -4.934
  297    HB   ILE  32           HB       ILE  32 -16.578  -4.362  -3.231
  298   HG12  ILE  32          HG12      ILE  32 -15.116  -4.514  -5.876
  299   HG13  ILE  32          HG13      ILE  32 -16.542  -3.538  -5.536
  300   HG21  ILE  32          HG21      ILE  32 -15.070  -6.116  -2.491
  301   HG22  ILE  32          HG22      ILE  32 -14.211  -6.049  -4.030
  302   HG23  ILE  32          HG23      ILE  32 -14.172  -4.665  -2.936
  303   HD11  ILE  32          HD11      ILE  32 -13.840  -3.223  -4.266
  304   HD12  ILE  32          HD12      ILE  32 -14.536  -2.194  -5.517
  305   HD13  ILE  32          HD13      ILE  32 -15.267  -2.248  -3.914
  306    H    ARG  33           H        ARG  33 -15.187  -7.868  -4.284
  307    HA   ARG  33           HA       ARG  33 -14.235  -8.091  -6.920
  308    HB2  ARG  33           HB2      ARG  33 -12.809  -9.031  -5.367
  309    HB3  ARG  33           HB3      ARG  33 -14.112  -9.777  -4.461
  310    HG2  ARG  33           HG2      ARG  33 -14.318 -11.534  -6.058
  311    HG3  ARG  33           HG3      ARG  33 -13.206 -10.725  -7.164
  312    HD2  ARG  33           HD2      ARG  33 -12.274 -12.652  -5.778
  313    HD3  ARG  33           HD3      ARG  33 -11.353 -11.149  -5.794
  314    HE   ARG  33           HE       ARG  33 -11.956 -10.764  -3.568
  315   HH11  ARG  33          HH11      ARG  33 -13.435 -13.707  -4.779
  316   HH12  ARG  33          HH12      ARG  33 -13.776 -14.324  -3.188
  317   HH21  ARG  33          HH21      ARG  33 -12.371 -11.585  -1.504
  318   HH22  ARG  33          HH22      ARG  33 -13.151 -13.134  -1.321
  319    H    GLU  34           H        GLU  34 -16.987  -9.357  -5.330
  320    HA   GLU  34           HA       GLU  34 -17.636 -11.460  -7.154
  321    HB2  GLU  34           HB2      GLU  34 -18.503 -11.334  -4.827
  322    HB3  GLU  34           HB3      GLU  34 -19.437  -9.907  -5.271
  323    HG2  GLU  34           HG2      GLU  34 -20.873 -11.820  -5.235
  324    HG3  GLU  34           HG3      GLU  34 -20.680 -11.273  -6.900
  325    H    ARG  35           H        ARG  35 -18.888  -8.203  -6.645
  326    HA   ARG  35           HA       ARG  35 -20.658  -8.372  -8.907
  327    HB2  ARG  35           HB2      ARG  35 -20.016  -6.047  -7.093
  328    HB3  ARG  35           HB3      ARG  35 -21.380  -6.151  -8.203
  329    HG2  ARG  35           HG2      ARG  35 -22.525  -7.613  -6.880
  330    HG3  ARG  35           HG3      ARG  35 -21.057  -8.293  -6.177
  331    HD2  ARG  35           HD2      ARG  35 -22.237  -7.018  -4.503
  332    HD3  ARG  35           HD3      ARG  35 -20.725  -6.224  -4.918
  333    HE   ARG  35           HE       ARG  35 -22.246  -4.814  -6.450
  334   HH11  ARG  35          HH11      ARG  35 -23.181  -6.120  -3.326
  335   HH12  ARG  35          HH12      ARG  35 -24.302  -4.831  -2.988
  336   HH21  ARG  35          HH21      ARG  35 -23.758  -3.153  -6.018
  337   HH22  ARG  35          HH22      ARG  35 -24.673  -3.183  -4.539
  338    H    ILE  36           H        ILE  36 -17.735  -6.522  -8.108
  339    HA   ILE  36           HA       ILE  36 -17.836  -5.248 -10.748
  340    HB   ILE  36           HB       ILE  36 -16.112  -4.579  -8.357
  341   HG12  ILE  36          HG12      ILE  36 -18.615  -3.228  -9.388
  342   HG13  ILE  36          HG13      ILE  36 -18.509  -4.207  -7.929
  343   HG21  ILE  36          HG21      ILE  36 -16.597  -3.076 -10.930
  344   HG22  ILE  36          HG22      ILE  36 -15.691  -2.462  -9.547
  345   HG23  ILE  36          HG23      ILE  36 -15.092  -3.860 -10.443
  346   HD11  ILE  36          HD11      ILE  36 -18.501  -1.841  -7.400
  347   HD12  ILE  36          HD12      ILE  36 -16.964  -2.584  -6.957
  348   HD13  ILE  36          HD13      ILE  36 -17.081  -1.603  -8.418
  349    HA   PRO  37           HA       PRO  37 -14.809  -8.377 -11.837
  350    HB2  PRO  37           HB2      PRO  37 -14.935  -7.180 -14.507
  351    HB3  PRO  37           HB3      PRO  37 -15.390  -8.803 -13.982
  352    HG2  PRO  37           HG2      PRO  37 -17.217  -6.964 -14.717
  353    HG3  PRO  37           HG3      PRO  37 -17.544  -8.178 -13.468
  354    HD2  PRO  37           HD2      PRO  37 -16.809  -5.289 -13.159
  355    HD3  PRO  37           HD3      PRO  37 -18.007  -6.248 -12.264
  356    H    GLU  38           H        GLU  38 -14.453  -4.923 -12.626
  357    HA   GLU  38           HA       GLU  38 -11.667  -5.289 -13.297
  358    HB2  GLU  38           HB2      GLU  38 -11.588  -2.775 -13.350
  359    HB3  GLU  38           HB3      GLU  38 -12.713  -3.520 -14.474
  360    HG2  GLU  38           HG2      GLU  38 -13.820  -2.736 -11.859
  361    HG3  GLU  38           HG3      GLU  38 -13.317  -1.424 -12.923
  362    H    ALA  39           H        ALA  39 -13.148  -5.521 -10.458
  363    HA   ALA  39           HA       ALA  39 -11.488  -3.947  -8.766
  364    HB1  ALA  39           HB1      ALA  39 -12.361  -5.312  -6.947
  365    HB2  ALA  39           HB2      ALA  39 -13.663  -4.811  -8.027
  366    HB3  ALA  39           HB3      ALA  39 -13.032  -6.457  -8.109
  367    H    LEU  40           H        LEU  40 -11.378  -7.317  -9.872
  368    HA   LEU  40           HA       LEU  40  -8.834  -7.626  -8.502
  369    HB2  LEU  40           HB2      LEU  40  -9.099 -10.081  -9.320
  370    HB3  LEU  40           HB3      LEU  40  -9.975  -9.506  -7.930
  371    HG   LEU  40           HG       LEU  40 -11.278 -11.009  -9.408
  372   HD11  LEU  40          HD11      LEU  40 -12.488  -9.551  -7.969
  373   HD12  LEU  40          HD12      LEU  40 -12.309  -8.209  -9.099
  374   HD13  LEU  40          HD13      LEU  40 -13.305  -9.597  -9.534
  375   HD21  LEU  40          HD21      LEU  40 -10.965  -8.768 -11.375
  376   HD22  LEU  40          HD22      LEU  40 -10.472 -10.450 -11.563
  377   HD23  LEU  40          HD23      LEU  40 -12.187 -10.036 -11.516
  378    H    ALA  41           H        ALA  41  -7.922  -6.088 -10.039
  379    HA   ALA  41           HA       ALA  41  -7.471  -6.909 -12.739
  380    HB1  ALA  41           HB1      ALA  41  -5.966  -4.983 -12.858
  381    HB2  ALA  41           HB2      ALA  41  -7.509  -4.548 -12.122
  382    HB3  ALA  41           HB3      ALA  41  -6.083  -4.784 -11.111
  383    H    GLY  42           H        GLY  42  -6.381  -8.197 -10.005
  384    HA2  GLY  42           HA2      GLY  42  -4.214  -9.568 -11.289
  385    HA3  GLY  42           HA3      GLY  42  -3.682  -8.496  -9.996
  386    HA   PRO  43           HA       PRO  43  -4.659 -12.472  -7.874
  387    HB2  PRO  43           HB2      PRO  43  -2.628 -11.444  -6.004
  388    HB3  PRO  43           HB3      PRO  43  -2.708 -13.005  -6.824
  389    HG2  PRO  43           HG2      PRO  43  -0.902 -11.143  -7.512
  390    HG3  PRO  43           HG3      PRO  43  -1.642 -12.216  -8.715
  391    HD2  PRO  43           HD2      PRO  43  -2.285  -9.361  -8.070
  392    HD3  PRO  43           HD3      PRO  43  -2.170 -10.159  -9.653
  393    HA   PRO  44           HA       PRO  44  -7.541  -9.987  -5.502
  394    HB2  PRO  44           HB2      PRO  44  -8.837 -12.124  -4.351
  395    HB3  PRO  44           HB3      PRO  44  -9.179 -11.500  -5.968
  396    HG2  PRO  44           HG2      PRO  44  -7.468 -13.818  -5.154
  397    HG3  PRO  44           HG3      PRO  44  -8.630 -13.698  -6.491
  398    HD2  PRO  44           HD2      PRO  44  -6.001 -13.488  -6.927
  399    HD3  PRO  44           HD3      PRO  44  -7.162 -12.481  -7.820
  400    H    ASN  45           H        ASN  45  -5.244 -12.213  -4.203
  401    HA   ASN  45           HA       ASN  45  -5.900 -11.762  -1.439
  402    HB2  ASN  45           HB2      ASN  45  -3.223 -12.739  -2.421
  403    HB3  ASN  45           HB3      ASN  45  -4.030 -13.100  -0.898
  404   HD21  ASN  45          HD21      ASN  45  -3.568 -13.987  -4.148
  405   HD22  ASN  45          HD22      ASN  45  -4.619 -15.369  -4.170
  406    H    ASP  46           H        ASP  46  -4.232 -10.083  -3.853
  407    HA   ASP  46           HA       ASP  46  -2.575  -8.605  -1.938
  408    HB2  ASP  46           HB2      ASP  46  -2.452  -8.827  -4.951
  409    HB3  ASP  46           HB3      ASP  46  -1.415  -7.765  -4.000
  410    H    PHE  47           H        PHE  47  -5.559  -8.276  -2.654
  411    HA   PHE  47           HA       PHE  47  -5.393  -5.403  -3.285
  412    HB2  PHE  47           HB2      PHE  47  -7.511  -7.433  -3.946
  413    HB3  PHE  47           HB3      PHE  47  -7.881  -5.713  -3.903
  414    HD1  PHE  47           HD1      PHE  47  -6.856  -4.185  -5.504
  415    HD2  PHE  47           HD2      PHE  47  -6.211  -8.381  -5.724
  416    HE1  PHE  47           HE1      PHE  47  -6.029  -3.931  -7.803
  417    HE2  PHE  47           HE2      PHE  47  -5.382  -8.134  -8.023
  418    HZ   PHE  47           HZ       PHE  47  -5.290  -5.908  -9.067
  419    H    GLY  48           H        GLY  48  -6.030  -4.010  -1.782
  420    HA2  GLY  48           HA2      GLY  48  -7.724  -5.014   0.413
  421    HA3  GLY  48           HA3      GLY  48  -6.281  -4.066   0.739
  422    H    LEU  49           H        LEU  49  -8.288  -2.964   1.864
  423    HA   LEU  49           HA       LEU  49  -9.629  -1.158  -0.013
  424    HB2  LEU  49           HB2      LEU  49 -10.239  -1.679   2.897
  425    HB3  LEU  49           HB3      LEU  49 -11.199  -0.711   1.795
  426    HG   LEU  49           HG       LEU  49 -10.810  -3.701   1.722
  427   HD11  LEU  49          HD11      LEU  49 -12.408  -2.920   3.376
  428   HD12  LEU  49          HD12      LEU  49 -13.244  -1.976   2.143
  429   HD13  LEU  49          HD13      LEU  49 -13.234  -3.736   2.050
  430   HD21  LEU  49          HD21      LEU  49 -12.299  -3.701  -0.216
  431   HD22  LEU  49          HD22      LEU  49 -12.282  -1.937  -0.229
  432   HD23  LEU  49          HD23      LEU  49 -10.799  -2.835  -0.554
  433    H    PHE  50           H        PHE  50  -8.562   0.644  -0.322
  434    HA   PHE  50           HA       PHE  50  -7.200   1.951   1.928
  435    HB2  PHE  50           HB2      PHE  50  -5.925   1.697  -0.172
  436    HB3  PHE  50           HB3      PHE  50  -7.139   2.647  -1.019
  437    HD1  PHE  50           HD1      PHE  50  -4.647   2.807   1.727
  438    HD2  PHE  50           HD2      PHE  50  -6.979   4.976  -1.100
  439    HE1  PHE  50           HE1      PHE  50  -3.421   4.863   2.297
  440    HE2  PHE  50           HE2      PHE  50  -5.757   7.034  -0.534
  441    HZ   PHE  50           HZ       PHE  50  -3.977   6.981   1.168
  442    H    LEU  51           H        LEU  51  -7.958   3.771   2.855
  443    HA   LEU  51           HA       LEU  51 -10.530   4.751   1.885
  444    HB2  LEU  51           HB2      LEU  51 -10.117   4.145   4.311
  445    HB3  LEU  51           HB3      LEU  51  -9.077   5.552   4.406
  446    HG   LEU  51           HG       LEU  51 -11.483   5.764   5.270
  447   HD11  LEU  51          HD11      LEU  51 -10.450   7.756   3.255
  448   HD12  LEU  51          HD12      LEU  51 -11.684   8.074   4.476
  449   HD13  LEU  51          HD13      LEU  51 -10.035   7.692   4.969
  450   HD21  LEU  51          HD21      LEU  51 -12.571   4.680   3.363
  451   HD22  LEU  51          HD22      LEU  51 -13.171   6.319   3.613
  452   HD23  LEU  51          HD23      LEU  51 -12.028   5.990   2.313
  453    H    SER  52           H        SER  52 -10.693   6.532   0.726
  454    HA   SER  52           HA       SER  52  -8.247   8.089   0.317
  455    HB2  SER  52           HB2      SER  52  -9.328   6.995  -1.655
  456    HB3  SER  52           HB3      SER  52 -10.741   8.010  -1.376
  457    HG   SER  52           HG       SER  52  -8.814   8.643  -2.893
  458    H    ASP  53           H        ASP  53  -8.204   9.720   1.694
  459    HA   ASP  53           HA       ASP  53 -10.545  11.336   2.243
  460    HB2  ASP  53           HB2      ASP  53  -8.899  10.972   4.035
  461    HB3  ASP  53           HB3      ASP  53  -7.643  11.708   3.046
  462    H    ASP  54           H        ASP  54  -7.289  12.035   1.045
  463    HA   ASP  54           HA       ASP  54  -7.997  13.218  -1.381
  464    HB2  ASP  54           HB2      ASP  54  -9.017  15.012  -0.050
  465    HB3  ASP  54           HB3      ASP  54  -7.518  15.216   0.853
  466    H    ASP  55           H        ASP  55  -5.871  13.605   1.391
  467    HA   ASP  55           HA       ASP  55  -3.515  13.440  -0.332
  468    HB2  ASP  55           HB2      ASP  55  -3.445  15.198   1.328
  469    HB3  ASP  55           HB3      ASP  55  -3.853  14.067   2.610
  470    HA   PRO  56           HA       PRO  56  -3.028   9.092   0.297
  471    HB2  PRO  56           HB2      PRO  56  -0.241   9.073   0.388
  472    HB3  PRO  56           HB3      PRO  56  -1.228   8.970  -1.072
  473    HG2  PRO  56           HG2      PRO  56   0.119  11.337   0.143
  474    HG3  PRO  56           HG3      PRO  56  -0.075  10.907  -1.566
  475    HD2  PRO  56           HD2      PRO  56  -1.585  12.800  -0.446
  476    HD3  PRO  56           HD3      PRO  56  -2.268  11.672  -1.638
  477    H    LYS  57           H        LYS  57  -1.135  11.305   2.370
  478    HA   LYS  57           HA       LYS  57  -0.469   9.251   4.256
  479    HB2  LYS  57           HB2      LYS  57  -0.413  12.248   4.619
  480    HB3  LYS  57           HB3      LYS  57   0.353  11.069   5.666
  481    HG2  LYS  57           HG2      LYS  57   1.740  10.381   3.695
  482    HG3  LYS  57           HG3      LYS  57   1.096  11.804   2.861
  483    HD2  LYS  57           HD2      LYS  57   1.907  13.225   4.678
  484    HD3  LYS  57           HD3      LYS  57   2.556  11.803   5.495
  485    HE2  LYS  57           HE2      LYS  57   4.358  12.841   4.384
  486    HE3  LYS  57           HE3      LYS  57   3.948  11.395   3.466
  487    HZ1  LYS  57           HZ1      LYS  57   2.857  12.706   1.828
  488    HZ2  LYS  57           HZ2      LYS  57   4.376  13.410   2.098
  489    HZ3  LYS  57           HZ3      LYS  57   2.988  14.114   2.767
  490    H    LYS  58           H        LYS  58  -2.944  11.721   3.987
  491    HA   LYS  58           HA       LYS  58  -4.038  11.384   6.583
  492    HB2  LYS  58           HB2      LYS  58  -5.372  12.394   4.067
  493    HB3  LYS  58           HB3      LYS  58  -5.966  12.611   5.707
  494    HG2  LYS  58           HG2      LYS  58  -4.080  14.004   6.256
  495    HG3  LYS  58           HG3      LYS  58  -3.356  13.699   4.675
  496    HD2  LYS  58           HD2      LYS  58  -4.399  15.834   4.564
  497    HD3  LYS  58           HD3      LYS  58  -5.405  14.712   3.648
  498    HE2  LYS  58           HE2      LYS  58  -6.730  14.449   5.842
  499    HE3  LYS  58           HE3      LYS  58  -5.905  15.921   6.348
  500    HZ1  LYS  58           HZ1      LYS  58  -7.924  16.603   5.402
  501    HZ2  LYS  58           HZ2      LYS  58  -7.771  15.552   4.082
  502    HZ3  LYS  58           HZ3      LYS  58  -6.765  16.912   4.202
  503    H    GLY  59           H        GLY  59  -4.359   9.693   3.590
  504    HA2  GLY  59           HA2      GLY  59  -6.766   8.288   4.224
  505    HA3  GLY  59           HA3      GLY  59  -5.617   7.873   2.960
  506    H    ILE  60           H        ILE  60  -6.762   5.858   4.336
  507    HA   ILE  60           HA       ILE  60  -4.552   4.815   5.950
  508    HB   ILE  60           HB       ILE  60  -6.234   3.809   7.537
  509   HG12  ILE  60          HG12      ILE  60  -8.051   5.907   6.331
  510   HG13  ILE  60          HG13      ILE  60  -8.217   4.170   6.108
  511   HG21  ILE  60          HG21      ILE  60  -4.828   5.664   8.207
  512   HG22  ILE  60          HG22      ILE  60  -5.980   6.812   7.523
  513   HG23  ILE  60          HG23      ILE  60  -6.435   5.827   8.914
  514   HD11  ILE  60          HD11      ILE  60  -8.619   3.907   8.499
  515   HD12  ILE  60          HD12      ILE  60  -8.461   5.650   8.712
  516   HD13  ILE  60          HD13      ILE  60  -9.787   4.997   7.750
  517    H    TRP  61           H        TRP  61  -4.518   2.509   6.090
  518    HA   TRP  61           HA       TRP  61  -5.945   1.171   3.933
  519    HB2  TRP  61           HB2      TRP  61  -3.691   0.328   5.749
  520    HB3  TRP  61           HB3      TRP  61  -4.535  -0.822   4.719
  521    HD1  TRP  61           HD1      TRP  61  -1.815   1.746   4.660
  522    HE1  TRP  61           HE1      TRP  61  -0.836   1.945   2.280
  523    HE3  TRP  61           HE3      TRP  61  -5.328  -0.976   2.149
  524    HZ2  TRP  61           HZ2      TRP  61  -1.491   1.034  -0.316
  525    HZ3  TRP  61           HZ3      TRP  61  -5.078  -1.274  -0.279
  526    HH2  TRP  61           HH2      TRP  61  -3.198  -0.289  -1.484
  527    H    LEU  62           H        LEU  62  -7.661  -0.059   4.239
  528    HA   LEU  62           HA       LEU  62  -8.659  -0.408   6.957
  529    HB2  LEU  62           HB2      LEU  62 -10.003  -1.109   4.345
  530    HB3  LEU  62           HB3      LEU  62 -10.763  -0.971   5.918
  531    HG   LEU  62           HG       LEU  62  -9.552   1.336   4.386
  532   HD11  LEU  62          HD11      LEU  62 -11.513   0.453   3.250
  533   HD12  LEU  62          HD12      LEU  62 -12.433   0.531   4.754
  534   HD13  LEU  62          HD13      LEU  62 -11.867   2.015   3.989
  535   HD21  LEU  62          HD21      LEU  62 -11.251   1.269   6.873
  536   HD22  LEU  62          HD22      LEU  62  -9.531   1.661   6.802
  537   HD23  LEU  62          HD23      LEU  62 -10.709   2.722   6.025
  538    H    GLU  63           H        GLU  63  -7.846  -2.193   7.944
  539    HA   GLU  63           HA       GLU  63  -7.255  -4.571   6.394
  540    HB2  GLU  63           HB2      GLU  63  -6.288  -5.459   8.413
  541    HB3  GLU  63           HB3      GLU  63  -5.733  -3.807   8.196
  542    HG2  GLU  63           HG2      GLU  63  -7.285  -3.026   9.872
  543    HG3  GLU  63           HG3      GLU  63  -7.960  -4.647  10.035
  544    H    ALA  64           H        ALA  64  -8.029  -6.701   7.084
  545    HA   ALA  64           HA       ALA  64 -10.852  -6.784   7.175
  546    HB1  ALA  64           HB1      ALA  64  -9.509  -8.521   6.112
  547    HB2  ALA  64           HB2      ALA  64  -8.873  -8.996   7.687
  548    HB3  ALA  64           HB3      ALA  64 -10.588  -9.201   7.331
  549    H    GLY  65           H        GLY  65  -8.510  -6.570   9.660
  550    HA2  GLY  65           HA2      GLY  65 -10.011  -7.976  11.668
  551    HA3  GLY  65           HA3      GLY  65  -8.531  -7.071  11.913
  552    H    LYS  66           H        LYS  66 -11.124  -5.362  10.373
  553    HA   LYS  66           HA       LYS  66 -12.398  -4.561  12.810
  554    HB2  LYS  66           HB2      LYS  66 -11.557  -2.479  13.172
  555    HB3  LYS  66           HB3      LYS  66 -10.134  -3.169  12.408
  556    HG2  LYS  66           HG2      LYS  66 -12.238  -1.648  10.894
  557    HG3  LYS  66           HG3      LYS  66 -10.823  -0.887  11.619
  558    HD2  LYS  66           HD2      LYS  66  -9.350  -2.001  10.176
  559    HD3  LYS  66           HD3      LYS  66 -10.571  -3.190   9.711
  560    HE2  LYS  66           HE2      LYS  66 -10.689  -0.246   9.051
  561    HE3  LYS  66           HE3      LYS  66 -10.141  -1.506   7.946
  562    HZ1  LYS  66           HZ1      LYS  66 -12.340  -2.543   8.188
  563    HZ2  LYS  66           HZ2      LYS  66 -12.409  -0.999   7.499
  564    HZ3  LYS  66           HZ3      LYS  66 -12.845  -1.220   9.121
  565    H    ALA  67           H        ALA  67 -14.150  -2.965  12.417
  566    HA   ALA  67           HA       ALA  67 -15.457  -3.655   9.923
  567    HB1  ALA  67           HB1      ALA  67 -16.439  -1.953  12.215
  568    HB2  ALA  67           HB2      ALA  67 -17.415  -2.590  10.891
  569    HB3  ALA  67           HB3      ALA  67 -16.682  -3.695  12.057
  570    H    LEU  68           H        LEU  68 -16.743  -1.749   8.861
  571    HA   LEU  68           HA       LEU  68 -14.665  -0.017   7.877
  572    HB2  LEU  68           HB2      LEU  68 -17.586  -0.184   7.160
  573    HB3  LEU  68           HB3      LEU  68 -16.394   0.796   6.339
  574    HG   LEU  68           HG       LEU  68 -16.330  -2.218   6.490
  575   HD11  LEU  68          HD11      LEU  68 -17.112  -0.397   4.215
  576   HD12  LEU  68          HD12      LEU  68 -16.966  -2.154   4.135
  577   HD13  LEU  68          HD13      LEU  68 -18.207  -1.419   5.149
  578   HD21  LEU  68          HD21      LEU  68 -14.120  -1.176   6.282
  579   HD22  LEU  68          HD22      LEU  68 -14.576  -2.037   4.812
  580   HD23  LEU  68          HD23      LEU  68 -14.681  -0.278   4.871
  581    H    ASP  69           H        ASP  69 -17.798   0.452   9.437
  582    HA   ASP  69           HA       ASP  69 -17.584   3.282   9.617
  583    HB2  ASP  69           HB2      ASP  69 -19.673   3.200  10.669
  584    HB3  ASP  69           HB3      ASP  69 -19.707   1.802   9.609
  585    H    TYR  70           H        TYR  70 -16.339   0.693  11.402
  586    HA   TYR  70           HA       TYR  70 -15.985   1.660  13.945
  587    HB2  TYR  70           HB2      TYR  70 -15.257  -0.567  13.282
  588    HB3  TYR  70           HB3      TYR  70 -14.083   0.119  12.166
  589    HD1  TYR  70           HD1      TYR  70 -14.958   0.267  15.785
  590    HD2  TYR  70           HD2      TYR  70 -11.912   0.213  12.831
  591    HE1  TYR  70           HE1      TYR  70 -13.257   0.251  17.554
  592    HE2  TYR  70           HE2      TYR  70 -10.196   0.201  14.586
  593    HH   TYR  70           HH       TYR  70 -10.935  -0.374  17.882
  594    H    TYR  71           H        TYR  71 -14.139   2.341  11.012
  595    HA   TYR  71           HA       TYR  71 -12.581   4.395  12.295
  596    HB2  TYR  71           HB2      TYR  71 -12.747   3.310   9.513
  597    HB3  TYR  71           HB3      TYR  71 -11.953   4.856   9.804
  598    HD1  TYR  71           HD1      TYR  71  -9.948   4.958  11.261
  599    HD2  TYR  71           HD2      TYR  71 -11.723   1.257  10.144
  600    HE1  TYR  71           HE1      TYR  71  -7.890   3.769  11.910
  601    HE2  TYR  71           HE2      TYR  71  -9.673   0.064  10.792
  602    HH   TYR  71           HH       TYR  71  -7.202   1.498  12.608
  603    H    MET  72           H        MET  72 -12.878   5.994   9.687
  604    HA   MET  72           HA       MET  72 -15.015   7.670  10.801
  605    HB2  MET  72           HB2      MET  72 -12.613   8.351   9.101
  606    HB3  MET  72           HB3      MET  72 -13.842   9.512   9.584
  607    HG2  MET  72           HG2      MET  72 -13.255   9.301  11.877
  608    HG3  MET  72           HG3      MET  72 -12.207   7.923  11.542
  609    HE1  MET  72           HE1      MET  72 -12.462  11.101   9.273
  610    HE2  MET  72           HE2      MET  72 -12.729  11.788  10.875
  611    HE3  MET  72           HE3      MET  72 -11.252  12.166   9.988
  612    H    LEU  73           H        LEU  73 -15.370   5.432   8.766
  613    HA   LEU  73           HA       LEU  73 -15.929   6.909   6.321
  614    HB2  LEU  73           HB2      LEU  73 -16.898   4.138   6.509
  615    HB3  LEU  73           HB3      LEU  73 -16.075   4.954   5.207
  616    HG   LEU  73           HG       LEU  73 -14.791   3.730   7.643
  617   HD11  LEU  73          HD11      LEU  73 -13.733   2.269   5.980
  618   HD12  LEU  73          HD12      LEU  73 -15.490   2.122   5.969
  619   HD13  LEU  73          HD13      LEU  73 -14.677   3.049   4.710
  620   HD21  LEU  73          HD21      LEU  73 -13.559   5.280   5.372
  621   HD22  LEU  73          HD22      LEU  73 -13.616   5.760   7.069
  622   HD23  LEU  73          HD23      LEU  73 -12.662   4.357   6.583
  623    H    ARG  74           H        ARG  74 -17.844   7.137   5.375
  624    HA   ARG  74           HA       ARG  74 -20.274   6.357   6.652
  625    HB2  ARG  74           HB2      ARG  74 -20.967   8.912   6.663
  626    HB3  ARG  74           HB3      ARG  74 -20.205   8.157   8.054
  627    HG2  ARG  74           HG2      ARG  74 -19.152  10.258   7.732
  628    HG3  ARG  74           HG3      ARG  74 -18.010   9.031   7.203
  629    HD2  ARG  74           HD2      ARG  74 -19.304   9.559   4.884
  630    HD3  ARG  74           HD3      ARG  74 -19.367  11.127   5.682
  631    HE   ARG  74           HE       ARG  74 -16.808   9.692   5.394
  632   HH11  ARG  74          HH11      ARG  74 -18.779  12.555   4.817
  633   HH12  ARG  74          HH12      ARG  74 -17.456  13.468   4.148
  634   HH21  ARG  74          HH21      ARG  74 -15.103  10.900   4.520
  635   HH22  ARG  74          HH22      ARG  74 -15.383  12.524   3.969
  636    H    ASN  75           H        ASN  75 -21.938   8.211   5.446
  637    HA   ASN  75           HA       ASN  75 -21.982   7.104   2.812
  638    HB2  ASN  75           HB2      ASN  75 -23.786   8.779   4.452
  639    HB3  ASN  75           HB3      ASN  75 -23.919   8.989   2.708
  640   HD21  ASN  75          HD21      ASN  75 -24.171   6.695   5.342
  641   HD22  ASN  75          HD22      ASN  75 -25.099   5.517   4.464
  642    H    GLY  76           H        GLY  76 -20.717   7.776   1.265
  643    HA2  GLY  76           HA2      GLY  76 -20.330   9.510  -0.377
  644    HA3  GLY  76           HA3      GLY  76 -20.346  10.681   0.934
  645    H    ASP  77           H        ASP  77 -18.708   8.057   2.114
  646    HA   ASP  77           HA       ASP  77 -16.193   9.405   1.858
  647    HB2  ASP  77           HB2      ASP  77 -17.270   7.536   3.619
  648    HB3  ASP  77           HB3      ASP  77 -16.014   6.645   2.764
  649    H    THR  78           H        THR  78 -14.745   9.176   0.290
  650    HA   THR  78           HA       THR  78 -15.108   7.216  -1.781
  651    HB   THR  78           HB       THR  78 -12.763   9.078  -1.341
  652    HG1  THR  78           HG1      THR  78 -15.351   9.523  -2.227
  653   HG21  THR  78          HG21      THR  78 -13.787   7.702  -3.832
  654   HG22  THR  78          HG22      THR  78 -12.324   7.274  -2.942
  655   HG23  THR  78          HG23      THR  78 -12.434   8.832  -3.762
  656    H    MET  79           H        MET  79 -14.239   5.228  -1.823
  657    HA   MET  79           HA       MET  79 -11.986   4.687  -0.031
  658    HB2  MET  79           HB2      MET  79 -14.258   3.886   0.861
  659    HB3  MET  79           HB3      MET  79 -14.234   2.719  -0.455
  660    HG2  MET  79           HG2      MET  79 -11.863   2.872   1.317
  661    HG3  MET  79           HG3      MET  79 -13.333   2.140   1.954
  662    HE1  MET  79           HE1      MET  79 -14.708   0.538  -0.153
  663    HE2  MET  79           HE2      MET  79 -13.846  -1.001  -0.142
  664    HE3  MET  79           HE3      MET  79 -14.192  -0.173   1.379
  665    H    GLU  80           H        GLU  80 -10.374   4.155  -1.233
  666    HA   GLU  80           HA       GLU  80 -10.707   3.430  -4.001
  667    HB2  GLU  80           HB2      GLU  80  -8.902   4.958  -2.986
  668    HB3  GLU  80           HB3      GLU  80  -8.134   3.485  -2.414
  669    HG2  GLU  80           HG2      GLU  80  -7.880   2.702  -4.694
  670    HG3  GLU  80           HG3      GLU  80  -8.714   4.137  -5.291
  671    H    TYR  81           H        TYR  81 -10.931   1.313  -4.694
  672    HA   TYR  81           HA       TYR  81  -9.914  -0.784  -2.956
  673    HB2  TYR  81           HB2      TYR  81 -12.202  -1.007  -3.970
  674    HB3  TYR  81           HB3      TYR  81 -11.448  -1.031  -5.559
  675    HD1  TYR  81           HD1      TYR  81 -11.956  -2.919  -2.445
  676    HD2  TYR  81           HD2      TYR  81 -10.257  -2.980  -6.341
  677    HE1  TYR  81           HE1      TYR  81 -11.660  -5.355  -2.274
  678    HE2  TYR  81           HE2      TYR  81  -9.959  -5.413  -6.183
  679    HH   TYR  81           HH       TYR  81  -9.735  -7.129  -4.430
  680    H    ARG  82           H        ARG  82  -7.836  -1.072  -3.207
  681    HA   ARG  82           HA       ARG  82  -6.730  -0.985  -5.918
  682    HB2  ARG  82           HB2      ARG  82  -4.786   0.298  -5.082
  683    HB3  ARG  82           HB3      ARG  82  -6.288   1.207  -4.992
  684    HG2  ARG  82           HG2      ARG  82  -6.435   0.893  -2.642
  685    HG3  ARG  82           HG3      ARG  82  -5.112  -0.276  -2.658
  686    HD2  ARG  82           HD2      ARG  82  -4.845   2.621  -3.442
  687    HD3  ARG  82           HD3      ARG  82  -4.456   1.979  -1.847
  688    HE   ARG  82           HE       ARG  82  -2.805   0.523  -3.093
  689   HH11  ARG  82          HH11      ARG  82  -3.858   3.604  -4.363
  690   HH12  ARG  82          HH12      ARG  82  -2.334   3.958  -5.128
  691   HH21  ARG  82          HH21      ARG  82  -0.786   0.976  -4.085
  692   HH22  ARG  82          HH22      ARG  82  -0.570   2.478  -4.946
  693    H    LYS  83           H        LYS  83  -4.506  -1.831  -5.973
  694    HA   LYS  83           HA       LYS  83  -4.262  -4.277  -4.586
  695    HB2  LYS  83           HB2      LYS  83  -3.239  -3.655  -6.832
  696    HB3  LYS  83           HB3      LYS  83  -2.050  -2.719  -5.940
  697    HG2  LYS  83           HG2      LYS  83  -1.057  -4.620  -5.031
  698    HG3  LYS  83           HG3      LYS  83  -2.467  -5.632  -5.382
  699    HD2  LYS  83           HD2      LYS  83  -2.009  -5.415  -7.776
  700    HD3  LYS  83           HD3      LYS  83  -0.605  -4.410  -7.417
  701    HE2  LYS  83           HE2      LYS  83   0.443  -6.260  -6.240
  702    HE3  LYS  83           HE3      LYS  83  -0.975  -7.267  -6.527
  703    HZ1  LYS  83           HZ1      LYS  83  -0.562  -7.235  -8.859
  704    HZ2  LYS  83           HZ2      LYS  83   0.893  -7.664  -8.095
  705    HZ3  LYS  83           HZ3      LYS  83   0.676  -6.090  -8.696
  706    H    LYS  84           H        LYS  84  -3.297  -4.723  -2.690
  707    HA   LYS  84           HA       LYS  84  -2.872  -2.818  -0.711
  708    HB2  LYS  84           HB2      LYS  84  -1.967  -5.649  -1.096
  709    HB3  LYS  84           HB3      LYS  84  -1.363  -4.726   0.269
  710    HG2  LYS  84           HG2      LYS  84  -4.284  -5.144  -0.298
  711    HG3  LYS  84           HG3      LYS  84  -3.319  -6.183   0.755
  712    HD2  LYS  84           HD2      LYS  84  -2.683  -3.968   1.938
  713    HD3  LYS  84           HD3      LYS  84  -4.113  -3.323   1.131
  714    HE2  LYS  84           HE2      LYS  84  -4.644  -4.102   3.380
  715    HE3  LYS  84           HE3      LYS  84  -5.484  -5.058   2.159
  716    HZ1  LYS  84           HZ1      LYS  84  -2.904  -5.930   3.312
  717    HZ2  LYS  84           HZ2      LYS  84  -4.062  -6.865   2.493
  718    HZ3  LYS  84           HZ3      LYS  84  -4.380  -6.293   4.062
  719    H    GLN  85           H        GLN  85  -0.867  -3.887  -3.259
  720    HA   GLN  85           HA       GLN  85   1.580  -2.926  -2.065
  721    HB2  GLN  85           HB2      GLN  85   1.443  -4.026  -4.823
  722    HB3  GLN  85           HB3      GLN  85   2.674  -4.249  -3.585
  723    HG2  GLN  85           HG2      GLN  85   0.724  -5.538  -2.367
  724    HG3  GLN  85           HG3      GLN  85   0.126  -5.712  -4.017
  725   HE21  GLN  85          HE21      GLN  85   2.454  -6.673  -1.706
  726   HE22  GLN  85          HE22      GLN  85   3.259  -7.852  -2.678
  727    H    ARG  86           H        ARG  86   2.783  -2.361  -4.619
  728    HA   ARG  86           HA       ARG  86   1.806  -0.156  -5.894
  729    HB2  ARG  86           HB2      ARG  86   3.153   1.634  -4.536
  730    HB3  ARG  86           HB3      ARG  86   1.525   1.202  -4.043
  731    HG2  ARG  86           HG2      ARG  86   2.638   1.217  -2.040
  732    HG3  ARG  86           HG3      ARG  86   2.726  -0.488  -2.477
  733    HD2  ARG  86           HD2      ARG  86   4.859   0.385  -1.621
  734    HD3  ARG  86           HD3      ARG  86   4.989  -0.198  -3.280
  735    HE   ARG  86           HE       ARG  86   5.691   1.879  -3.834
  736   HH11  ARG  86          HH11      ARG  86   3.621   2.185  -1.019
  737   HH12  ARG  86          HH12      ARG  86   3.776   3.904  -0.926
  738   HH21  ARG  86          HH21      ARG  86   5.899   4.165  -3.712
  739   HH22  ARG  86          HH22      ARG  86   5.064   5.031  -2.463
  740    HA   PRO  87           HA       PRO  87   5.509  -1.164  -7.953
  741    HB2  PRO  87           HB2      PRO  87   5.461   1.476  -9.241
  742    HB3  PRO  87           HB3      PRO  87   5.293  -0.127  -9.959
  743    HG2  PRO  87           HG2      PRO  87   3.211   1.570  -9.747
  744    HG3  PRO  87           HG3      PRO  87   3.018  -0.188  -9.626
  745    HD2  PRO  87           HD2      PRO  87   3.078   1.868  -7.454
  746    HD3  PRO  87           HD3      PRO  87   2.061   0.420  -7.609
  747    H    LEU  88           H        LEU  88   7.255  -1.207  -6.709
  748    HA   LEU  88           HA       LEU  88   8.433   1.322  -5.793
  749    HB2  LEU  88           HB2      LEU  88   8.651  -1.505  -4.830
  750    HB3  LEU  88           HB3      LEU  88   9.927  -0.357  -4.468
  751    HG   LEU  88           HG       LEU  88   7.031   0.070  -3.729
  752   HD11  LEU  88          HD11      LEU  88   9.320  -0.935  -2.045
  753   HD12  LEU  88          HD12      LEU  88   7.721  -0.490  -1.447
  754   HD13  LEU  88          HD13      LEU  88   7.903  -1.860  -2.541
  755   HD21  LEU  88          HD21      LEU  88   9.581   1.471  -2.936
  756   HD22  LEU  88          HD22      LEU  88   8.282   2.128  -3.933
  757   HD23  LEU  88          HD23      LEU  88   7.994   1.779  -2.227
  758    H    LYS  89           H        LYS  89  10.050   2.116  -6.952
  759    HA   LYS  89           HA       LYS  89  11.546   0.378  -8.739
  760    HB2  LYS  89           HB2      LYS  89  11.159   3.302  -8.485
  761    HB3  LYS  89           HB3      LYS  89  12.758   2.793  -9.007
  762    HG2  LYS  89           HG2      LYS  89  11.522   3.172 -10.967
  763    HG3  LYS  89           HG3      LYS  89  11.617   1.423 -10.785
  764    HD2  LYS  89           HD2      LYS  89   9.397   1.763 -11.359
  765    HD3  LYS  89           HD3      LYS  89   9.330   1.659  -9.599
  766    HE2  LYS  89           HE2      LYS  89   9.225   4.054  -9.411
  767    HE3  LYS  89           HE3      LYS  89   9.485   4.243 -11.145
  768    HZ1  LYS  89           HZ1      LYS  89   7.074   3.342  -9.719
  769    HZ2  LYS  89           HZ2      LYS  89   7.346   2.809 -11.303
  770    HZ3  LYS  89           HZ3      LYS  89   7.221   4.469 -10.978
  771    H    ILE  90           H        ILE  90  13.254  -0.659  -7.989
  772    HA   ILE  90           HA       ILE  90  14.644   0.452  -5.637
  773    HB   ILE  90           HB       ILE  90  14.044  -2.470  -6.146
  774   HG12  ILE  90          HG12      ILE  90  12.035  -1.219  -5.469
  775   HG13  ILE  90          HG13      ILE  90  12.553  -2.337  -4.211
  776   HG21  ILE  90          HG21      ILE  90  16.152  -2.201  -5.012
  777   HG22  ILE  90          HG22      ILE  90  15.418  -1.108  -3.836
  778   HG23  ILE  90          HG23      ILE  90  14.947  -2.807  -3.874
  779   HD11  ILE  90          HD11      ILE  90  13.572  -0.482  -2.991
  780   HD12  ILE  90          HD12      ILE  90  13.039   0.632  -4.250
  781   HD13  ILE  90          HD13      ILE  90  11.850  -0.221  -3.267
  782    H    ARG  91           H        ARG  91  16.817   0.634  -5.889
  783    HA   ARG  91           HA       ARG  91  18.048  -0.778  -8.154
  784    HB2  ARG  91           HB2      ARG  91  18.090   1.758  -8.128
  785    HB3  ARG  91           HB3      ARG  91  19.101   1.644  -6.696
  786    HG2  ARG  91           HG2      ARG  91  20.850   0.585  -7.916
  787    HG3  ARG  91           HG3      ARG  91  19.828   0.443  -9.348
  788    HD2  ARG  91           HD2      ARG  91  20.680   3.049  -8.083
  789    HD3  ARG  91           HD3      ARG  91  21.449   2.314  -9.490
  790    HE   ARG  91           HE       ARG  91  19.034   2.479 -10.436
  791   HH11  ARG  91          HH11      ARG  91  20.630   4.867  -8.404
  792   HH12  ARG  91          HH12      ARG  91  19.715   6.189  -9.059
  793   HH21  ARG  91          HH21      ARG  91  17.851   4.229 -11.281
  794   HH22  ARG  91          HH22      ARG  91  18.151   5.839 -10.677
  795    H    MET  92           H        MET  92  19.369  -2.378  -7.658
  796    HA   MET  92           HA       MET  92  19.895  -2.998  -4.900
  797    HB2  MET  92           HB2      MET  92  19.907  -4.372  -7.481
  798    HB3  MET  92           HB3      MET  92  21.188  -4.896  -6.400
  799    HG2  MET  92           HG2      MET  92  18.999  -6.150  -6.357
  800    HG3  MET  92           HG3      MET  92  19.692  -5.683  -4.811
  801    HE1  MET  92           HE1      MET  92  16.039  -3.728  -6.815
  802    HE2  MET  92           HE2      MET  92  17.654  -3.698  -7.524
  803    HE3  MET  92           HE3      MET  92  16.791  -5.228  -7.360
  804    H    LEU  93           H        LEU  93  22.186  -4.260  -4.766
  805    HA   LEU  93           HA       LEU  93  23.904  -2.223  -4.034
  806    HB2  LEU  93           HB2      LEU  93  24.636  -5.097  -4.598
  807    HB3  LEU  93           HB3      LEU  93  25.604  -3.964  -3.684
  808    HG   LEU  93           HG       LEU  93  24.635  -5.216  -2.016
  809   HD11  LEU  93          HD11      LEU  93  24.212  -2.889  -1.553
  810   HD12  LEU  93          HD12      LEU  93  22.687  -2.964  -2.438
  811   HD13  LEU  93          HD13      LEU  93  22.884  -3.881  -0.946
  812   HD21  LEU  93          HD21      LEU  93  21.968  -5.190  -3.410
  813   HD22  LEU  93          HD22      LEU  93  23.153  -6.490  -3.555
  814   HD23  LEU  93          HD23      LEU  93  22.432  -6.121  -1.989
  815    H    ASP  94           H        ASP  94  24.110  -4.332  -6.890
  816    HA   ASP  94           HA       ASP  94  26.558  -3.148  -7.802
  817    HB2  ASP  94           HB2      ASP  94  25.894  -5.498  -8.298
  818    HB3  ASP  94           HB3      ASP  94  24.595  -4.887  -9.314
  819    H    GLY  95           H        GLY  95  23.410  -2.104  -7.774
  820    HA2  GLY  95           HA2      GLY  95  22.802   0.031  -8.666
  821    HA3  GLY  95           HA3      GLY  95  23.917  -0.243 -10.001
  822    H    THR  96           H        THR  96  22.184  -3.007  -9.236
  823    HA   THR  96           HA       THR  96  20.831  -2.937 -11.761
  824    HB   THR  96           HB       THR  96  20.549  -5.001  -9.571
  825    HG1  THR  96           HG1      THR  96  22.494  -4.907 -11.666
  826   HG21  THR  96          HG21      THR  96  18.955  -5.194 -11.418
  827   HG22  THR  96          HG22      THR  96  20.110  -6.527 -11.435
  828   HG23  THR  96          HG23      THR  96  20.287  -5.192 -12.575
  829    H    VAL  97           H        VAL  97  18.786  -2.205 -12.082
  830    HA   VAL  97           HA       VAL  97  17.247  -1.671  -9.637
  831    HB   VAL  97           HB       VAL  97  17.842   0.356 -10.866
  832   HG11  VAL  97          HG11      VAL  97  16.877   0.836 -13.055
  833   HG12  VAL  97          HG12      VAL  97  17.985  -0.535 -13.110
  834   HG13  VAL  97          HG13      VAL  97  16.243  -0.808 -13.132
  835   HG21  VAL  97          HG21      VAL  97  15.608   1.342 -11.034
  836   HG22  VAL  97          HG22      VAL  97  14.897  -0.272 -10.999
  837   HG23  VAL  97          HG23      VAL  97  15.772   0.337  -9.594
  838    H    LYS  98           H        LYS  98  15.266  -2.380  -9.394
  839    HA   LYS  98           HA       LYS  98  13.855  -3.600 -11.646
  840    HB2  LYS  98           HB2      LYS  98  13.322  -5.632 -10.560
  841    HB3  LYS  98           HB3      LYS  98  15.053  -5.431 -10.350
  842    HG2  LYS  98           HG2      LYS  98  14.832  -4.910  -8.078
  843    HG3  LYS  98           HG3      LYS  98  13.105  -4.581  -8.234
  844    HD2  LYS  98           HD2      LYS  98  14.278  -7.305  -8.733
  845    HD3  LYS  98           HD3      LYS  98  13.757  -6.791  -7.125
  846    HE2  LYS  98           HE2      LYS  98  11.923  -7.942  -8.006
  847    HE3  LYS  98           HE3      LYS  98  11.517  -6.236  -8.211
  848    HZ1  LYS  98           HZ1      LYS  98  11.028  -7.694 -10.160
  849    HZ2  LYS  98           HZ2      LYS  98  12.700  -7.897 -10.372
  850    HZ3  LYS  98           HZ3      LYS  98  12.008  -6.357 -10.512
  851    H    THR  99           H        THR  99  11.545  -3.773 -11.282
  852    HA   THR  99           HA       THR  99  10.616  -2.038  -9.096
  853    HB   THR  99           HB       THR  99   9.183  -2.581 -11.702
  854    HG1  THR  99           HG1      THR  99  11.134  -1.371 -12.032
  855   HG21  THR  99          HG21      THR  99   8.735  -0.521  -9.543
  856   HG22  THR  99          HG22      THR  99   7.753  -1.960  -9.817
  857   HG23  THR  99          HG23      THR  99   7.801  -0.679 -11.032
  858    H    ILE 100           H        ILE 100   9.576  -3.128  -7.545
  859    HA   ILE 100           HA       ILE 100   8.201  -5.611  -8.296
  860    HB   ILE 100           HB       ILE 100  10.405  -6.013  -7.167
  861   HG12  ILE 100          HG12      ILE 100   8.210  -7.466  -6.964
  862   HG13  ILE 100          HG13      ILE 100   9.656  -7.874  -6.052
  863   HG21  ILE 100          HG21      ILE 100  10.589  -5.604  -4.754
  864   HG22  ILE 100          HG22      ILE 100  10.476  -4.113  -5.691
  865   HG23  ILE 100          HG23      ILE 100   9.071  -4.710  -4.805
  866   HD11  ILE 100          HD11      ILE 100   7.253  -6.395  -5.008
  867   HD12  ILE 100          HD12      ILE 100   7.678  -8.075  -4.681
  868   HD13  ILE 100          HD13      ILE 100   8.707  -6.773  -4.084
  869    H    MET 101           H        MET 101   6.281  -6.033  -7.176
  870    HA   MET 101           HA       MET 101   5.069  -3.644  -6.048
  871    HB2  MET 101           HB2      MET 101   3.894  -6.370  -6.640
  872    HB3  MET 101           HB3      MET 101   2.978  -4.950  -6.158
  873    HG2  MET 101           HG2      MET 101   4.623  -5.143  -8.666
  874    HG3  MET 101           HG3      MET 101   2.888  -5.438  -8.580
  875    HE1  MET 101           HE1      MET 101   1.570  -1.914  -7.444
  876    HE2  MET 101           HE2      MET 101   1.121  -3.574  -7.837
  877    HE3  MET 101           HE3      MET 101   2.066  -3.235  -6.386
  878    H    VAL 102           H        VAL 102   5.376  -3.275  -4.007
  879    HA   VAL 102           HA       VAL 102   5.141  -5.505  -2.083
  880    HB   VAL 102           HB       VAL 102   6.528  -2.919  -1.439
  881   HG11  VAL 102          HG11      VAL 102   7.683  -4.301   0.214
  882   HG12  VAL 102          HG12      VAL 102   5.932  -4.375   0.413
  883   HG13  VAL 102          HG13      VAL 102   6.791  -5.716  -0.346
  884   HG21  VAL 102          HG21      VAL 102   7.782  -5.337  -2.731
  885   HG22  VAL 102          HG22      VAL 102   7.657  -3.712  -3.410
  886   HG23  VAL 102          HG23      VAL 102   8.676  -4.003  -1.999
  887    H    ASP 103           H        ASP 103   3.720  -5.309  -0.437
  888    HA   ASP 103           HA       ASP 103   1.537  -3.619  -0.551
  889    HB2  ASP 103           HB2      ASP 103   2.715  -5.024   1.846
  890    HB3  ASP 103           HB3      ASP 103   1.132  -4.265   1.816
  891    H    ASP 104           H        ASP 104   1.072  -1.614   0.164
  892    HA   ASP 104           HA       ASP 104   3.189   0.004   1.308
  893    HB2  ASP 104           HB2      ASP 104   1.696   0.980  -0.381
  894    HB3  ASP 104           HB3      ASP 104   0.305   0.671   0.651
  895    H    SER 105           H        SER 105   0.615  -1.924   2.364
  896    HA   SER 105           HA       SER 105   0.013  -0.520   4.806
  897    HB2  SER 105           HB2      SER 105  -0.695  -3.387   4.313
  898    HB3  SER 105           HB3      SER 105  -1.643  -2.126   5.097
  899    HG   SER 105           HG       SER 105  -1.548  -1.147   2.842
  900    H    LYS 106           H        LYS 106   2.746  -0.945   4.773
  901    HA   LYS 106           HA       LYS 106   3.141  -2.677   7.067
  902    HB2  LYS 106           HB2      LYS 106   4.918  -4.000   6.008
  903    HB3  LYS 106           HB3      LYS 106   3.381  -4.246   5.187
  904    HG2  LYS 106           HG2      LYS 106   4.023  -2.873   3.374
  905    HG3  LYS 106           HG3      LYS 106   5.440  -2.279   4.235
  906    HD2  LYS 106           HD2      LYS 106   6.343  -3.812   2.769
  907    HD3  LYS 106           HD3      LYS 106   6.174  -4.759   4.248
  908    HE2  LYS 106           HE2      LYS 106   4.111  -4.746   2.056
  909    HE3  LYS 106           HE3      LYS 106   5.452  -5.884   2.100
  910    HZ1  LYS 106           HZ1      LYS 106   4.632  -6.611   4.305
  911    HZ2  LYS 106           HZ2      LYS 106   3.554  -6.919   3.036
  912    HZ3  LYS 106           HZ3      LYS 106   3.261  -5.626   4.090
  913    H    THR 107           H        THR 107   5.672  -2.699   7.507
  914    HA   THR 107           HA       THR 107   6.642   0.043   7.246
  915    HB   THR 107           HB       THR 107   8.433  -0.696   8.812
  916    HG1  THR 107           HG1      THR 107   8.191  -2.775   9.780
  917   HG21  THR 107          HG21      THR 107   6.990  -0.930  10.786
  918   HG22  THR 107          HG22      THR 107   5.614  -1.269   9.736
  919   HG23  THR 107          HG23      THR 107   6.390   0.314   9.690
  920    H    VAL 108           H        VAL 108   9.314  -0.208   7.208
  921    HA   VAL 108           HA       VAL 108   9.804  -0.932   4.470
  922    HB   VAL 108           HB       VAL 108  11.955  -0.227   6.432
  923   HG11  VAL 108          HG11      VAL 108  12.644  -0.900   4.210
  924   HG12  VAL 108          HG12      VAL 108  11.598   0.327   3.497
  925   HG13  VAL 108          HG13      VAL 108  12.984   0.810   4.475
  926   HG21  VAL 108          HG21      VAL 108  10.173   1.385   6.810
  927   HG22  VAL 108          HG22      VAL 108  11.533   2.148   5.987
  928   HG23  VAL 108          HG23      VAL 108  10.086   1.712   5.079
  929    H    THR 109           H        THR 109  10.745  -2.147   7.629
  930    HA   THR 109           HA       THR 109  12.531  -4.127   7.021
  931    HB   THR 109           HB       THR 109  10.322  -4.576   9.010
  932    HG1  THR 109           HG1      THR 109  10.983  -2.893  10.120
  933   HG21  THR 109          HG21      THR 109  13.286  -5.166   9.051
  934   HG22  THR 109          HG22      THR 109  12.003  -6.344   8.766
  935   HG23  THR 109          HG23      THR 109  12.141  -5.552  10.335
  936    H    ASP 110           H        ASP 110   8.978  -4.482   7.122
  937    HA   ASP 110           HA       ASP 110   8.959  -7.181   6.262
  938    HB2  ASP 110           HB2      ASP 110   7.098  -5.947   7.463
  939    HB3  ASP 110           HB3      ASP 110   6.736  -5.158   5.933
  940    H    MET 111           H        MET 111   8.753  -4.087   4.619
  941    HA   MET 111           HA       MET 111   8.176  -4.919   2.022
  942    HB2  MET 111           HB2      MET 111   8.183  -2.571   2.583
  943    HB3  MET 111           HB3      MET 111   9.890  -2.631   3.002
  944    HG2  MET 111           HG2      MET 111   9.990  -3.497   0.452
  945    HG3  MET 111           HG3      MET 111   8.588  -2.432   0.374
  946    HE1  MET 111           HE1      MET 111   8.673   0.138   1.138
  947    HE2  MET 111           HE2      MET 111   9.402  -0.336   2.674
  948    HE3  MET 111           HE3      MET 111  10.145   0.934   1.701
  949    H    LEU 112           H        LEU 112  11.317  -4.487   3.610
  950    HA   LEU 112           HA       LEU 112  12.866  -5.118   1.343
  951    HB2  LEU 112           HB2      LEU 112  13.405  -4.087   3.785
  952    HB3  LEU 112           HB3      LEU 112  14.020  -5.718   3.989
  953    HG   LEU 112           HG       LEU 112  15.416  -5.398   1.954
  954   HD11  LEU 112          HD11      LEU 112  14.441  -2.556   2.175
  955   HD12  LEU 112          HD12      LEU 112  15.733  -3.120   1.113
  956   HD13  LEU 112          HD13      LEU 112  14.079  -3.686   0.868
  957   HD21  LEU 112          HD21      LEU 112  17.028  -3.859   3.013
  958   HD22  LEU 112          HD22      LEU 112  15.799  -3.431   4.200
  959   HD23  LEU 112          HD23      LEU 112  16.410  -5.083   4.123
  960    H    MET 113           H        MET 113  11.513  -7.071   3.921
  961    HA   MET 113           HA       MET 113  12.762  -9.515   3.437
  962    HB2  MET 113           HB2      MET 113  11.193  -9.124   5.300
  963    HB3  MET 113           HB3      MET 113   9.863  -9.012   4.156
  964    HG2  MET 113           HG2      MET 113  10.376 -11.356   3.455
  965    HG3  MET 113           HG3      MET 113  11.523 -11.438   4.790
  966    HE1  MET 113           HE1      MET 113   9.176 -11.045   7.901
  967    HE2  MET 113           HE2      MET 113  10.831 -11.312   7.347
  968    HE3  MET 113           HE3      MET 113  10.041  -9.763   7.052
  969    H    THR 114           H        THR 114  10.096  -7.934   1.854
  970    HA   THR 114           HA       THR 114   9.492 -10.076   0.063
  971    HB   THR 114           HB       THR 114   8.680  -7.170   0.099
  972    HG1  THR 114           HG1      THR 114   7.851  -8.434   1.816
  973   HG21  THR 114          HG21      THR 114   7.626  -9.417  -1.628
  974   HG22  THR 114          HG22      THR 114   8.528  -8.008  -2.189
  975   HG23  THR 114          HG23      THR 114   6.917  -7.805  -1.501
  976    H    ILE 115           H        ILE 115  11.487  -7.133  -0.113
  977    HA   ILE 115           HA       ILE 115  11.758  -7.262  -2.965
  978    HB   ILE 115           HB       ILE 115  13.301  -5.634  -0.942
  979   HG12  ILE 115          HG12      ILE 115  10.992  -4.906  -2.760
  980   HG13  ILE 115          HG13      ILE 115  10.902  -5.106  -1.013
  981   HG21  ILE 115          HG21      ILE 115  14.581  -5.927  -2.994
  982   HG22  ILE 115          HG22      ILE 115  13.197  -5.398  -3.950
  983   HG23  ILE 115          HG23      ILE 115  13.998  -4.269  -2.858
  984   HD11  ILE 115          HD11      ILE 115  12.486  -3.010  -2.480
  985   HD12  ILE 115          HD12      ILE 115  10.966  -2.765  -1.619
  986   HD13  ILE 115          HD13      ILE 115  12.422  -3.212  -0.729
  987    H    CYS 116           H        CYS 116  13.937  -7.964  -0.221
  988    HA   CYS 116           HA       CYS 116  16.168  -8.607  -1.822
  989    HB2  CYS 116           HB2      CYS 116  15.528  -9.610   0.963
  990    HB3  CYS 116           HB3      CYS 116  17.111  -9.620   0.192
  991    HG   CYS 116           HG       CYS 116  16.868  -6.667  -0.073
  992    H    ALA 117           H        ALA 117  13.387 -10.442  -0.826
  993    HA   ALA 117           HA       ALA 117  14.380 -13.022  -1.457
  994    HB1  ALA 117           HB1      ALA 117  12.055 -13.734  -1.369
  995    HB2  ALA 117           HB2      ALA 117  12.434 -12.673  -0.013
  996    HB3  ALA 117           HB3      ALA 117  11.524 -12.051  -1.391
  997    H    ARG 118           H        ARG 118  13.126 -10.411  -3.381
  998    HA   ARG 118           HA       ARG 118  12.367 -11.981  -5.641
  999    HB2  ARG 118           HB2      ARG 118  13.165  -9.053  -5.650
 1000    HB3  ARG 118           HB3      ARG 118  12.214  -9.905  -6.860
 1001    HG2  ARG 118           HG2      ARG 118  11.380  -9.344  -4.027
 1002    HG3  ARG 118           HG3      ARG 118  10.787  -8.539  -5.479
 1003    HD2  ARG 118           HD2      ARG 118  10.439 -11.451  -4.777
 1004    HD3  ARG 118           HD3      ARG 118   9.196 -10.202  -4.711
 1005    HE   ARG 118           HE       ARG 118  10.492 -11.062  -7.227
 1006   HH11  ARG 118          HH11      ARG 118   7.664 -10.139  -5.388
 1007   HH12  ARG 118          HH12      ARG 118   6.577 -10.276  -6.733
 1008   HH21  ARG 118          HH21      ARG 118   9.078 -11.263  -8.996
 1009   HH22  ARG 118          HH22      ARG 118   7.383 -10.920  -8.796
 1010    H    ILE 119           H        ILE 119  15.321 -10.339  -4.639
 1011    HA   ILE 119           HA       ILE 119  16.685 -10.856  -7.110
 1012    HB   ILE 119           HB       ILE 119  18.182 -10.307  -4.585
 1013   HG12  ILE 119          HG12      ILE 119  16.181  -8.853  -4.454
 1014   HG13  ILE 119          HG13      ILE 119  17.666  -7.932  -4.664
 1015   HG21  ILE 119          HG21      ILE 119  19.376 -10.544  -6.687
 1016   HG22  ILE 119          HG22      ILE 119  18.391  -9.268  -7.406
 1017   HG23  ILE 119          HG23      ILE 119  19.503  -8.890  -6.089
 1018   HD11  ILE 119          HD11      ILE 119  17.155  -7.662  -7.037
 1019   HD12  ILE 119          HD12      ILE 119  15.664  -8.578  -6.815
 1020   HD13  ILE 119          HD13      ILE 119  15.870  -7.022  -6.012
 1021    H    GLY 120           H        GLY 120  16.325 -12.392  -4.008
 1022    HA2  GLY 120           HA2      GLY 120  16.607 -14.812  -3.918
 1023    HA3  GLY 120           HA3      GLY 120  17.999 -14.614  -4.974
 1024    H    ILE 121           H        ILE 121  17.326 -12.494  -2.279
 1025    HA   ILE 121           HA       ILE 121  19.826 -13.360  -1.035
 1026    HB   ILE 121           HB       ILE 121  18.099 -11.021  -0.216
 1027   HG12  ILE 121          HG12      ILE 121  20.482 -10.966  -2.083
 1028   HG13  ILE 121          HG13      ILE 121  18.810 -10.876  -2.623
 1029   HG21  ILE 121          HG21      ILE 121  20.198 -10.193   0.765
 1030   HG22  ILE 121          HG22      ILE 121  19.719 -11.749   1.444
 1031   HG23  ILE 121          HG23      ILE 121  21.008 -11.670   0.244
 1032   HD11  ILE 121          HD11      ILE 121  19.837  -8.678  -2.559
 1033   HD12  ILE 121          HD12      ILE 121  18.526  -8.790  -1.385
 1034   HD13  ILE 121          HD13      ILE 121  20.203  -8.883  -0.846
 1035    H    THR 122           H        THR 122  19.875 -14.454   0.849
 1036    HA   THR 122           HA       THR 122  17.517 -15.771   1.704
 1037    HB   THR 122           HB       THR 122  20.169 -15.654   3.149
 1038    HG1  THR 122           HG1      THR 122  20.942 -16.902   1.614
 1039   HG21  THR 122          HG21      THR 122  18.336 -16.643   4.443
 1040   HG22  THR 122          HG22      THR 122  19.522 -17.863   3.980
 1041   HG23  THR 122          HG23      THR 122  17.991 -17.748   3.113
 1042    H    ASN 123           H        ASN 123  19.584 -13.370   3.336
 1043    HA   ASN 123           HA       ASN 123  17.360 -12.861   5.189
 1044    HB2  ASN 123           HB2      ASN 123  19.165 -11.951   6.731
 1045    HB3  ASN 123           HB3      ASN 123  19.150 -13.691   6.491
 1046   HD21  ASN 123          HD21      ASN 123  21.309 -12.144   7.453
 1047   HD22  ASN 123          HD22      ASN 123  22.610 -12.301   6.328
 1048    H    HIS 124           H        HIS 124  17.215 -10.535   5.973
 1049    HA   HIS 124           HA       HIS 124  17.658  -8.857   3.592
 1050    HB2  HIS 124           HB2      HIS 124  15.341  -8.091   3.654
 1051    HB3  HIS 124           HB3      HIS 124  15.430  -9.832   3.420
 1052    HD1  HIS 124           HD1      HIS 124  14.109  -7.237   5.710
 1053    HD2  HIS 124           HD2      HIS 124  14.607 -11.365   5.691
 1054    HE1  HIS 124           HE1      HIS 124  12.580  -8.111   7.500
 1055    HE2  HIS 124           HE2      HIS 124  13.089 -10.577   7.633
 1056    H    ASP 125           H        ASP 125  17.663  -8.987   7.020
 1057    HA   ASP 125           HA       ASP 125  17.025  -6.199   7.400
 1058    HB2  ASP 125           HB2      ASP 125  18.115  -8.262   9.333
 1059    HB3  ASP 125           HB3      ASP 125  17.575  -6.644   9.771
 1060    H    GLU 126           H        GLU 126  19.521  -7.754   6.141
 1061    HA   GLU 126           HA       GLU 126  21.749  -6.516   7.441
 1062    HB2  GLU 126           HB2      GLU 126  21.868  -7.706   4.697
 1063    HB3  GLU 126           HB3      GLU 126  23.090  -7.713   5.961
 1064    HG2  GLU 126           HG2      GLU 126  20.598  -9.376   5.796
 1065    HG3  GLU 126           HG3      GLU 126  22.271  -9.918   5.747
 1066    H    TYR 127           H        TYR 127  19.402  -5.424   5.421
 1067    HA   TYR 127           HA       TYR 127  21.161  -3.464   4.110
 1068    HB2  TYR 127           HB2      TYR 127  18.560  -4.596   3.071
 1069    HB3  TYR 127           HB3      TYR 127  19.592  -3.438   2.241
 1070    HD1  TYR 127           HD1      TYR 127  21.979  -4.204   1.675
 1071    HD2  TYR 127           HD2      TYR 127  18.843  -6.856   2.752
 1072    HE1  TYR 127           HE1      TYR 127  23.205  -6.058   0.633
 1073    HE2  TYR 127           HE2      TYR 127  20.043  -8.716   1.724
 1074    HH   TYR 127           HH       TYR 127  23.314  -8.470   0.704
 1075    H    SER 128           H        SER 128  20.500  -1.346   4.057
 1076    HA   SER 128           HA       SER 128  18.028  -0.708   5.517
 1077    HB2  SER 128           HB2      SER 128  20.447   1.049   5.025
 1078    HB3  SER 128           HB3      SER 128  19.039   1.453   6.010
 1079    HG   SER 128           HG       SER 128  19.920  -0.845   6.924
 1080    H    LEU 129           H        LEU 129  16.880   1.262   4.633
 1081    HA   LEU 129           HA       LEU 129  16.983   1.076   1.701
 1082    HB2  LEU 129           HB2      LEU 129  14.877   0.562   3.284
 1083    HB3  LEU 129           HB3      LEU 129  14.651   2.286   3.093
 1084    HG   LEU 129           HG       LEU 129  13.314   0.905   1.516
 1085   HD11  LEU 129          HD11      LEU 129  15.352   2.636   0.137
 1086   HD12  LEU 129          HD12      LEU 129  13.747   2.215  -0.455
 1087   HD13  LEU 129          HD13      LEU 129  13.918   3.230   0.977
 1088   HD21  LEU 129          HD21      LEU 129  14.926  -0.895   1.171
 1089   HD22  LEU 129          HD22      LEU 129  14.415  -0.183  -0.359
 1090   HD23  LEU 129          HD23      LEU 129  15.993   0.221   0.317
 1091    H    VAL 130           H        VAL 130  17.055   2.957   0.470
 1092    HA   VAL 130           HA       VAL 130  17.005   5.512   1.880
 1093    HB   VAL 130           HB       VAL 130  19.336   5.153   1.877
 1094   HG11  VAL 130          HG11      VAL 130  19.424   3.236   0.444
 1095   HG12  VAL 130          HG12      VAL 130  19.066   4.237  -0.963
 1096   HG13  VAL 130          HG13      VAL 130  20.590   4.442  -0.102
 1097   HG21  VAL 130          HG21      VAL 130  20.260   6.767   0.289
 1098   HG22  VAL 130          HG22      VAL 130  18.741   6.751  -0.608
 1099   HG23  VAL 130          HG23      VAL 130  18.783   7.369   1.044
 1100    H    ARG 131           H        ARG 131  15.597   6.753   0.893
 1101    HA   ARG 131           HA       ARG 131  14.809   6.108  -1.857
 1102    HB2  ARG 131           HB2      ARG 131  13.523   7.973   0.143
 1103    HB3  ARG 131           HB3      ARG 131  12.852   7.490  -1.405
 1104    HG2  ARG 131           HG2      ARG 131  12.478   5.281  -0.652
 1105    HG3  ARG 131           HG3      ARG 131  13.433   5.551   0.811
 1106    HD2  ARG 131           HD2      ARG 131  10.942   5.630   1.133
 1107    HD3  ARG 131           HD3      ARG 131  11.826   7.051   1.691
 1108    HE   ARG 131           HE       ARG 131  10.611   7.117  -0.975
 1109   HH11  ARG 131          HH11      ARG 131  10.673   8.170   2.348
 1110   HH12  ARG 131          HH12      ARG 131   9.604   9.508   2.101
 1111   HH21  ARG 131          HH21      ARG 131   9.174   8.872  -1.353
 1112   HH22  ARG 131          HH22      ARG 131   8.723   9.890  -0.017
 1113    H    GLU 132           H        GLU 132  16.262   7.132  -3.161
 1114    HA   GLU 132           HA       GLU 132  16.837   9.920  -2.766
 1115    HB2  GLU 132           HB2      GLU 132  17.399   8.102  -5.121
 1116    HB3  GLU 132           HB3      GLU 132  17.909   9.778  -5.035
 1117    HG2  GLU 132           HG2      GLU 132  19.174   9.167  -2.949
 1118    HG3  GLU 132           HG3      GLU 132  18.825   7.481  -3.336
 1119    H    LEU 133           H        LEU 133  15.401  11.433  -3.165
 1120    HA   LEU 133           HA       LEU 133  13.254  10.772  -5.044
 1121    HB2  LEU 133           HB2      LEU 133  13.247  12.913  -2.936
 1122    HB3  LEU 133           HB3      LEU 133  11.879  12.341  -3.870
 1123    HG   LEU 133           HG       LEU 133  13.343  10.929  -1.661
 1124   HD11  LEU 133          HD11      LEU 133  11.060  10.787  -0.735
 1125   HD12  LEU 133          HD12      LEU 133  11.590  12.452  -0.993
 1126   HD13  LEU 133          HD13      LEU 133  10.468  11.700  -2.128
 1127   HD21  LEU 133          HD21      LEU 133  13.020   9.309  -3.456
 1128   HD22  LEU 133          HD22      LEU 133  11.941   8.972  -2.101
 1129   HD23  LEU 133          HD23      LEU 133  11.315   9.747  -3.558
 1130    H    MET 134           H        MET 134  12.123  13.062  -5.498
 1131    HA   MET 134           HA       MET 134  14.031  14.757  -6.971
 1132    HB2  MET 134           HB2      MET 134  11.971  14.894  -8.603
 1133    HB3  MET 134           HB3      MET 134  13.045  13.501  -8.691
 1134    HG2  MET 134           HG2      MET 134  10.752  12.756  -8.763
 1135    HG3  MET 134           HG3      MET 134  11.493  12.237  -7.259
 1136    HE1  MET 134           HE1      MET 134   8.171  12.770  -5.571
 1137    HE2  MET 134           HE2      MET 134   8.679  11.783  -6.940
 1138    HE3  MET 134           HE3      MET 134   9.723  11.932  -5.526
 1139    H    GLU 135           H        GLU 135  12.776  14.944  -4.358
 1140    HA   GLU 135           HA       GLU 135  10.235  16.179  -4.491
 1141    HB2  GLU 135           HB2      GLU 135  12.139  15.351  -2.387
 1142    HB3  GLU 135           HB3      GLU 135  10.920  16.538  -1.949
 1143    HG2  GLU 135           HG2      GLU 135  10.179  13.986  -3.314
 1144    HG3  GLU 135           HG3      GLU 135  10.415  14.069  -1.569
 1145    H    GLU 136           H        GLU 136   9.691  18.205  -4.642
 1146    HA   GLU 136           HA       GLU 136  11.498  20.394  -4.258
 1147    HB2  GLU 136           HB2      GLU 136   9.473  21.765  -4.591
 1148    HB3  GLU 136           HB3      GLU 136   9.631  20.525  -5.831
 1149    HG2  GLU 136           HG2      GLU 136   7.997  19.139  -4.700
 1150    HG3  GLU 136           HG3      GLU 136   7.862  20.331  -3.409
 1151    H    LYS 137           H        LYS 137   9.362  18.509  -2.334
 1152    HA   LYS 137           HA       LYS 137   9.240  20.496  -0.198
 1153    HB2  LYS 137           HB2      LYS 137   7.896  17.793  -0.283
 1154    HB3  LYS 137           HB3      LYS 137   7.495  19.159   0.750
 1155    HG2  LYS 137           HG2      LYS 137   6.766  20.425  -1.215
 1156    HG3  LYS 137           HG3      LYS 137   7.155  19.042  -2.238
 1157    HD2  LYS 137           HD2      LYS 137   5.518  17.691  -0.977
 1158    HD3  LYS 137           HD3      LYS 137   5.090  19.127  -0.043
 1159    HE2  LYS 137           HE2      LYS 137   4.775  18.743  -3.017
 1160    HE3  LYS 137           HE3      LYS 137   3.484  18.794  -1.820
 1161    HZ1  LYS 137           HZ1      LYS 137   3.524  20.905  -2.785
 1162    HZ2  LYS 137           HZ2      LYS 137   5.212  21.014  -2.742
 1163    HZ3  LYS 137           HZ3      LYS 137   4.321  21.114  -1.302
 1164    H    LYS 138           H        LYS 138   9.480  16.975  -0.145
 1165    HA   LYS 138           HA       LYS 138  10.817  16.755   2.280
 1166    HB2  LYS 138           HB2      LYS 138   9.564  15.020   0.864
 1167    HB3  LYS 138           HB3      LYS 138  11.070  14.814  -0.007
 1168    HG2  LYS 138           HG2      LYS 138  12.166  14.009   1.946
 1169    HG3  LYS 138           HG3      LYS 138  10.771  14.415   2.952
 1170    HD2  LYS 138           HD2      LYS 138  10.788  12.395   0.708
 1171    HD3  LYS 138           HD3      LYS 138  10.858  12.013   2.428
 1172    HE2  LYS 138           HE2      LYS 138   8.619  11.769   2.109
 1173    HE3  LYS 138           HE3      LYS 138   8.664  13.496   2.462
 1174    HZ1  LYS 138           HZ1      LYS 138   7.274  12.984   0.534
 1175    HZ2  LYS 138           HZ2      LYS 138   8.609  12.330  -0.274
 1176    HZ3  LYS 138           HZ3      LYS 138   8.576  13.980   0.103
 1177    H    ASP 169           H        ASP 169  12.238  15.987  -0.864
 1178    HA   ASP 169           HA       ASP 169  14.345  15.942  -1.663
 1179    HB2  ASP 169           HB2      ASP 169  13.857  18.391  -1.718
 1180    HB3  ASP 169           HB3      ASP 169  14.681  18.544  -0.167
 1181    H    GLU 170           H        GLU 170  14.719  14.118  -0.324
 1182    HA   GLU 170           HA       GLU 170  17.108  14.542   1.266
 1183    HB2  GLU 170           HB2      GLU 170  14.652  14.181   2.518
 1184    HB3  GLU 170           HB3      GLU 170  15.354  12.569   2.505
 1185    HG2  GLU 170           HG2      GLU 170  16.757  15.005   3.558
 1186    HG3  GLU 170           HG3      GLU 170  15.826  13.889   4.553
 1187    H    LEU 171           H        LEU 171  18.203  12.494   1.718
 1188    HA   LEU 171           HA       LEU 171  18.126  10.619  -0.450
 1189    HB2  LEU 171           HB2      LEU 171  19.496  10.355   2.231
 1190    HB3  LEU 171           HB3      LEU 171  19.844   9.428   0.783
 1191    HG   LEU 171           HG       LEU 171  20.354  12.357   1.216
 1192   HD11  LEU 171          HD11      LEU 171  22.219  10.029   0.788
 1193   HD12  LEU 171          HD12      LEU 171  22.698  11.720   0.945
 1194   HD13  LEU 171          HD13      LEU 171  21.956  10.882   2.309
 1195   HD21  LEU 171          HD21      LEU 171  19.618  11.994  -1.057
 1196   HD22  LEU 171          HD22      LEU 171  21.357  12.298  -1.035
 1197   HD23  LEU 171          HD23      LEU 171  20.753  10.651  -1.234
 1198    H    ASN 172           H        ASN 172  16.634  11.032   2.569
 1199    HA   ASN 172           HA       ASN 172  15.151   9.825   3.785
 1200    HB2  ASN 172           HB2      ASN 172  14.555   9.033   0.958
 1201    HB3  ASN 172           HB3      ASN 172  13.651   8.319   2.275
 1202   HD21  ASN 172          HD21      ASN 172  14.079  11.016   0.271
 1203   HD22  ASN 172          HD22      ASN 172  12.876  12.029   0.978
 1204    H    TRP 173           H        TRP 173  17.008   8.667   4.804
 1205    HA   TRP 173           HA       TRP 173  17.519   5.998   3.792
 1206    HB2  TRP 173           HB2      TRP 173  18.730   7.781   5.866
 1207    HB3  TRP 173           HB3      TRP 173  18.926   6.038   6.041
 1208    HD1  TRP 173           HD1      TRP 173  19.949   8.972   3.798
 1209    HE1  TRP 173           HE1      TRP 173  21.973   8.255   2.394
 1210    HE3  TRP 173           HE3      TRP 173  20.081   4.019   5.047
 1211    HZ2  TRP 173           HZ2      TRP 173  23.439   5.895   1.876
 1212    HZ3  TRP 173           HZ3      TRP 173  21.827   2.601   4.053
 1213    HH2  TRP 173           HH2      TRP 173  23.470   3.521   2.500
 1214    H    LEU 174           H        LEU 174  15.870   4.681   4.219
 1215    HA   LEU 174           HA       LEU 174  13.983   5.224   6.258
 1216    HB2  LEU 174           HB2      LEU 174  14.343   2.765   4.566
 1217    HB3  LEU 174           HB3      LEU 174  12.984   3.056   5.632
 1218    HG   LEU 174           HG       LEU 174  13.661   4.407   3.052
 1219   HD11  LEU 174          HD11      LEU 174  11.228   3.926   2.692
 1220   HD12  LEU 174          HD12      LEU 174  12.246   2.498   2.891
 1221   HD13  LEU 174          HD13      LEU 174  11.245   3.054   4.233
 1222   HD21  LEU 174          HD21      LEU 174  13.301   6.232   4.603
 1223   HD22  LEU 174          HD22      LEU 174  11.897   6.063   3.546
 1224   HD23  LEU 174          HD23      LEU 174  11.832   5.463   5.204
 1225    H    ASP 175           H        ASP 175  14.023   4.826   8.225
 1226    HA   ASP 175           HA       ASP 175  16.027   3.386   9.598
 1227    HB2  ASP 175           HB2      ASP 175  15.005   5.267  10.655
 1228    HB3  ASP 175           HB3      ASP 175  13.396   4.597  10.427
 1229    H    HIS 176           H        HIS 176  13.229   2.389   8.047
 1230    HA   HIS 176           HA       HIS 176  12.099   0.423   7.897
 1231    HB2  HIS 176           HB2      HIS 176  14.256  -0.570   9.766
 1232    HB3  HIS 176           HB3      HIS 176  12.950  -1.594   9.186
 1233    HD1  HIS 176           HD1      HIS 176  13.132  -2.508   6.841
 1234    HD2  HIS 176           HD2      HIS 176  16.179   0.142   7.798
 1235    HE1  HIS 176           HE1      HIS 176  14.786  -2.689   4.970
 1236    HE2  HIS 176           HE2      HIS 176  16.761  -1.353   5.768
 1237    H    GLY 177           H        GLY 177  11.929   2.516  10.124
 1238    HA2  GLY 177           HA2      GLY 177  10.713   0.934  12.261
 1239    HA3  GLY 177           HA3      GLY 177  11.168   2.627  12.360
 1240    H    ARG 178           H        ARG 178   9.892   3.716  10.200
 1241    HA   ARG 178           HA       ARG 178   7.123   3.431  11.132
 1242    HB2  ARG 178           HB2      ARG 178   6.706   5.640  10.408
 1243    HB3  ARG 178           HB3      ARG 178   8.274   5.681  11.196
 1244    HG2  ARG 178           HG2      ARG 178   9.323   5.551   8.931
 1245    HG3  ARG 178           HG3      ARG 178   7.707   5.741   8.242
 1246    HD2  ARG 178           HD2      ARG 178   8.786   7.901   8.342
 1247    HD3  ARG 178           HD3      ARG 178   7.466   7.856   9.508
 1248    HE   ARG 178           HE       ARG 178   9.349   7.230  11.139
 1249   HH11  ARG 178          HH11      ARG 178   9.652   9.508   8.482
 1250   HH12  ARG 178          HH12      ARG 178  10.963  10.379   9.223
 1251   HH21  ARG 178          HH21      ARG 178  11.049   8.375  12.106
 1252   HH22  ARG 178          HH22      ARG 178  11.753   9.746  11.290
 1253    H    THR 179           H        THR 179   5.392   3.766   9.508
 1254    HA   THR 179           HA       THR 179   5.717   1.872   7.402
 1255    HB   THR 179           HB       THR 179   3.588   2.039   8.550
 1256    HG1  THR 179           HG1      THR 179   3.297   1.312   6.492
 1257   HG21  THR 179          HG21      THR 179   3.335   4.792   7.352
 1258   HG22  THR 179          HG22      THR 179   3.644   4.445   9.051
 1259   HG23  THR 179          HG23      THR 179   2.116   3.959   8.313
 1260    H    LEU 180           H        LEU 180   4.653   2.575   5.199
 1261    HA   LEU 180           HA       LEU 180   6.688   4.309   4.099
 1262    HB2  LEU 180           HB2      LEU 180   4.536   2.833   2.605
 1263    HB3  LEU 180           HB3      LEU 180   6.114   3.334   2.021
 1264    HG   LEU 180           HG       LEU 180   5.605   1.196   4.086
 1265   HD11  LEU 180          HD11      LEU 180   6.508   0.994   1.221
 1266   HD12  LEU 180          HD12      LEU 180   6.423  -0.340   2.372
 1267   HD13  LEU 180          HD13      LEU 180   4.948   0.484   1.869
 1268   HD21  LEU 180          HD21      LEU 180   7.684   2.406   4.493
 1269   HD22  LEU 180          HD22      LEU 180   7.997   0.759   3.933
 1270   HD23  LEU 180          HD23      LEU 180   8.181   2.121   2.825
 1271    H    ARG 181           H        ARG 181   3.186   4.143   4.261
 1272    HA   ARG 181           HA       ARG 181   2.545   6.375   2.700
 1273    HB2  ARG 181           HB2      ARG 181   1.053   4.533   3.722
 1274    HB3  ARG 181           HB3      ARG 181   1.022   5.547   5.155
 1275    HG2  ARG 181           HG2      ARG 181   0.204   7.402   3.590
 1276    HG3  ARG 181           HG3      ARG 181  -0.114   6.097   2.442
 1277    HD2  ARG 181           HD2      ARG 181  -1.403   6.694   5.055
 1278    HD3  ARG 181           HD3      ARG 181  -2.132   6.192   3.526
 1279    HE   ARG 181           HE       ARG 181  -0.946   3.963   4.078
 1280   HH11  ARG 181          HH11      ARG 181  -2.539   6.110   6.328
 1281   HH12  ARG 181          HH12      ARG 181  -2.727   4.897   7.560
 1282   HH21  ARG 181          HH21      ARG 181  -1.207   2.351   5.692
 1283   HH22  ARG 181          HH22      ARG 181  -2.004   2.750   7.186
 1284    H    GLU 182           H        GLU 182   3.642   6.050   5.969
 1285    HA   GLU 182           HA       GLU 182   2.925   8.599   6.969
 1286    HB2  GLU 182           HB2      GLU 182   3.585   6.559   8.312
 1287    HB3  GLU 182           HB3      GLU 182   5.247   6.865   7.831
 1288    HG2  GLU 182           HG2      GLU 182   4.945   7.740  10.009
 1289    HG3  GLU 182           HG3      GLU 182   5.069   9.103   8.897
 1290    H    GLN 183           H        GLN 183   5.793   7.278   5.449
 1291    HA   GLN 183           HA       GLN 183   7.490   9.505   5.666
 1292    HB2  GLN 183           HB2      GLN 183   7.398   7.422   3.490
 1293    HB3  GLN 183           HB3      GLN 183   8.767   8.445   3.893
 1294    HG2  GLN 183           HG2      GLN 183   9.130   7.322   5.929
 1295    HG3  GLN 183           HG3      GLN 183   7.570   6.499   5.832
 1296   HE21  GLN 183          HE21      GLN 183   8.457   4.461   5.934
 1297   HE22  GLN 183          HE22      GLN 183   9.345   3.781   4.611
 1298    H    GLY 184           H        GLY 184   5.129   8.500   3.282
 1299    HA2  GLY 184           HA2      GLY 184   4.068   9.914   1.711
 1300    HA3  GLY 184           HA3      GLY 184   5.371  11.081   1.924
 1301    H    VAL 185           H        VAL 185   5.718   7.622   1.405
 1302    HA   VAL 185           HA       VAL 185   7.466   7.967  -0.809
 1303    HB   VAL 185           HB       VAL 185   7.350   5.530  -1.075
 1304   HG11  VAL 185          HG11      VAL 185   8.167   4.875   1.144
 1305   HG12  VAL 185          HG12      VAL 185   8.861   6.405   0.604
 1306   HG13  VAL 185          HG13      VAL 185   7.566   6.397   1.802
 1307   HG21  VAL 185          HG21      VAL 185   4.960   5.257  -0.595
 1308   HG22  VAL 185          HG22      VAL 185   5.965   4.159   0.351
 1309   HG23  VAL 185          HG23      VAL 185   5.276   5.596   1.108
 1310    H    GLU 186           H        GLU 186   7.058   8.001  -2.935
 1311    HA   GLU 186           HA       GLU 186   4.253   7.753  -3.764
 1312    HB2  GLU 186           HB2      GLU 186   6.562   9.167  -5.121
 1313    HB3  GLU 186           HB3      GLU 186   4.932   9.051  -5.759
 1314    HG2  GLU 186           HG2      GLU 186   5.639  10.362  -3.149
 1315    HG3  GLU 186           HG3      GLU 186   5.443  11.214  -4.682
 1316    H    GLU 187           H        GLU 187   3.894   6.786  -5.879
 1317    HA   GLU 187           HA       GLU 187   5.367   4.308  -6.062
 1318    HB2  GLU 187           HB2      GLU 187   2.968   5.415  -7.503
 1319    HB3  GLU 187           HB3      GLU 187   3.643   3.828  -7.847
 1320    HG2  GLU 187           HG2      GLU 187   3.170   3.094  -5.600
 1321    HG3  GLU 187           HG3      GLU 187   2.631   4.709  -5.152
 1322    H    HIS 188           H        HIS 188   6.499   7.021  -6.954
 1323    HA   HIS 188           HA       HIS 188   7.406   6.130  -9.595
 1324    HB2  HIS 188           HB2      HIS 188   7.130   8.400 -10.513
 1325    HB3  HIS 188           HB3      HIS 188   5.594   7.689 -10.037
 1326    HD1  HIS 188           HD1      HIS 188   4.177   8.998  -8.443
 1327    HD2  HIS 188           HD2      HIS 188   8.083  10.432  -8.637
 1328    HE1  HIS 188           HE1      HIS 188   4.185  11.149  -7.143
 1329    HE2  HIS 188           HE2      HIS 188   6.457  12.147  -7.562
 1330    H    GLU 189           H        GLU 189   8.500   6.624  -6.698
 1331    HA   GLU 189           HA       GLU 189  10.713   8.418  -7.437
 1332    HB2  GLU 189           HB2      GLU 189  10.212   7.319  -4.684
 1333    HB3  GLU 189           HB3      GLU 189  11.102   8.760  -5.150
 1334    HG2  GLU 189           HG2      GLU 189   9.081   9.907  -5.713
 1335    HG3  GLU 189           HG3      GLU 189   8.130   8.447  -5.436
 1336    H    THR 190           H        THR 190  12.866   7.685  -7.404
 1337    HA   THR 190           HA       THR 190  13.204   4.832  -7.465
 1338    HB   THR 190           HB       THR 190  15.303   6.996  -7.690
 1339    HG1  THR 190           HG1      THR 190  13.373   6.789  -9.271
 1340   HG21  THR 190          HG21      THR 190  16.592   5.267  -8.871
 1341   HG22  THR 190          HG22      THR 190  15.315   4.096  -8.540
 1342   HG23  THR 190          HG23      THR 190  16.241   4.790  -7.210
 1343    H    LEU 191           H        LEU 191  13.773   3.562  -5.862
 1344    HA   LEU 191           HA       LEU 191  14.939   4.777  -3.434
 1345    HB2  LEU 191           HB2      LEU 191  13.444   2.159  -3.458
 1346    HB3  LEU 191           HB3      LEU 191  13.859   3.150  -2.079
 1347    HG   LEU 191           HG       LEU 191  11.590   3.467  -2.224
 1348   HD11  LEU 191          HD11      LEU 191  12.649   5.645  -2.219
 1349   HD12  LEU 191          HD12      LEU 191  12.648   5.663  -3.983
 1350   HD13  LEU 191          HD13      LEU 191  11.122   5.683  -3.101
 1351   HD21  LEU 191          HD21      LEU 191  11.811   3.539  -5.223
 1352   HD22  LEU 191          HD22      LEU 191  11.214   2.199  -4.244
 1353   HD23  LEU 191          HD23      LEU 191  10.320   3.718  -4.298
 1354    H    LEU 192           H        LEU 192  16.752   3.664  -2.502
 1355    HA   LEU 192           HA       LEU 192  17.874   1.615  -4.303
 1356    HB2  LEU 192           HB2      LEU 192  19.568   3.224  -2.447
 1357    HB3  LEU 192           HB3      LEU 192  20.002   2.453  -3.954
 1358    HG   LEU 192           HG       LEU 192  18.250   4.898  -3.798
 1359   HD11  LEU 192          HD11      LEU 192  20.224   6.175  -4.403
 1360   HD12  LEU 192          HD12      LEU 192  20.453   5.368  -2.853
 1361   HD13  LEU 192          HD13      LEU 192  21.214   4.718  -4.305
 1362   HD21  LEU 192          HD21      LEU 192  18.020   3.581  -5.842
 1363   HD22  LEU 192          HD22      LEU 192  18.825   5.117  -6.163
 1364   HD23  LEU 192          HD23      LEU 192  19.766   3.628  -6.078
 1365    H    LEU 193           H        LEU 193  18.502  -0.288  -3.439
 1366    HA   LEU 193           HA       LEU 193  18.183  -0.717  -0.590
 1367    HB2  LEU 193           HB2      LEU 193  17.372  -2.366  -2.243
 1368    HB3  LEU 193           HB3      LEU 193  19.006  -2.584  -2.827
 1369    HG   LEU 193           HG       LEU 193  18.451  -3.152   0.053
 1370   HD11  LEU 193          HD11      LEU 193  17.800  -5.019  -2.223
 1371   HD12  LEU 193          HD12      LEU 193  17.784  -5.428  -0.508
 1372   HD13  LEU 193          HD13      LEU 193  16.625  -4.261  -1.146
 1373   HD21  LEU 193          HD21      LEU 193  20.135  -4.895  -0.362
 1374   HD22  LEU 193          HD22      LEU 193  20.226  -4.390  -2.048
 1375   HD23  LEU 193          HD23      LEU 193  20.733  -3.284  -0.769
 1376    H    ARG 194           H        ARG 194  19.842  -0.668   0.833
 1377    HA   ARG 194           HA       ARG 194  22.579  -0.523  -0.256
 1378    HB2  ARG 194           HB2      ARG 194  21.335   1.115   1.954
 1379    HB3  ARG 194           HB3      ARG 194  23.065   1.035   1.666
 1380    HG2  ARG 194           HG2      ARG 194  21.031   2.018  -0.318
 1381    HG3  ARG 194           HG3      ARG 194  22.012   3.045   0.727
 1382    HD2  ARG 194           HD2      ARG 194  22.975   1.202  -1.452
 1383    HD3  ARG 194           HD3      ARG 194  23.014   2.967  -1.449
 1384    HE   ARG 194           HE       ARG 194  24.481   1.716   0.717
 1385   HH11  ARG 194          HH11      ARG 194  24.589   2.992  -2.546
 1386   HH12  ARG 194          HH12      ARG 194  26.315   3.188  -2.555
 1387   HH21  ARG 194          HH21      ARG 194  26.763   1.957   0.707
 1388   HH22  ARG 194          HH22      ARG 194  27.556   2.573  -0.713
 1389    H    ARG 195           H        ARG 195  24.119  -1.681   0.802
 1390    HA   ARG 195           HA       ARG 195  23.128  -3.564   2.778
 1391    HB2  ARG 195           HB2      ARG 195  24.545  -4.309   0.872
 1392    HB3  ARG 195           HB3      ARG 195  25.879  -3.378   1.544
 1393    HG2  ARG 195           HG2      ARG 195  25.946  -4.747   3.494
 1394    HG3  ARG 195           HG3      ARG 195  24.464  -5.577   3.023
 1395    HD2  ARG 195           HD2      ARG 195  25.662  -6.394   0.992
 1396    HD3  ARG 195           HD3      ARG 195  27.143  -5.702   1.654
 1397    HE   ARG 195           HE       ARG 195  26.443  -7.222   3.675
 1398   HH11  ARG 195          HH11      ARG 195  26.319  -7.968   0.244
 1399   HH12  ARG 195          HH12      ARG 195  26.507  -9.677   0.488
 1400   HH21  ARG 195          HH21      ARG 195  26.720  -9.474   3.962
 1401   HH22  ARG 195          HH22      ARG 195  26.729 -10.529   2.578
 1402    H    LYS 196           H        LYS 196  23.412  -3.391   4.883
 1403    HA   LYS 196           HA       LYS 196  25.315  -1.380   5.871
 1404    HB2  LYS 196           HB2      LYS 196  23.078  -0.900   6.601
 1405    HB3  LYS 196           HB3      LYS 196  22.827  -2.563   7.116
 1406    HG2  LYS 196           HG2      LYS 196  24.557  -2.247   8.853
 1407    HG3  LYS 196           HG3      LYS 196  24.690  -0.557   8.371
 1408    HD2  LYS 196           HD2      LYS 196  22.100  -1.810   9.252
 1409    HD3  LYS 196           HD3      LYS 196  23.221  -1.041  10.376
 1410    HE2  LYS 196           HE2      LYS 196  21.941   0.292   7.995
 1411    HE3  LYS 196           HE3      LYS 196  21.411   0.466   9.667
 1412    HZ1  LYS 196           HZ1      LYS 196  23.611   1.387  10.197
 1413    HZ2  LYS 196           HZ2      LYS 196  22.780   2.330   9.059
 1414    HZ3  LYS 196           HZ3      LYS 196  24.037   1.309   8.556
 1415    H    PHE 197           H        PHE 197  24.107  -4.667   6.459
 1416    HA   PHE 197           HA       PHE 197  26.251  -5.144   8.376
 1417    HB2  PHE 197           HB2      PHE 197  23.923  -6.874   7.534
 1418    HB3  PHE 197           HB3      PHE 197  25.105  -7.316   8.756
 1419    HD1  PHE 197           HD1      PHE 197  22.271  -5.124   7.959
 1420    HD2  PHE 197           HD2      PHE 197  25.028  -6.366  10.944
 1421    HE1  PHE 197           HE1      PHE 197  20.932  -3.976   9.676
 1422    HE2  PHE 197           HE2      PHE 197  23.723  -5.210  12.659
 1423    HZ   PHE 197           HZ       PHE 197  21.514  -4.172  12.018
 1424    H    PHE 198           H        PHE 198  27.703  -6.831   8.217
 1425    HA   PHE 198           HA       PHE 198  27.993  -8.070   5.567
 1426    HB2  PHE 198           HB2      PHE 198  30.224  -7.358   7.492
 1427    HB3  PHE 198           HB3      PHE 198  30.414  -8.093   5.903
 1428    HD1  PHE 198           HD1      PHE 198  29.438  -6.720   3.906
 1429    HD2  PHE 198           HD2      PHE 198  30.413  -5.075   7.707
 1430    HE1  PHE 198           HE1      PHE 198  29.584  -4.483   2.896
 1431    HE2  PHE 198           HE2      PHE 198  30.557  -2.833   6.704
 1432    HZ   PHE 198           HZ       PHE 198  30.142  -2.535   4.294
 1433    H    TYR 199           H        TYR 199  26.592  -9.650   6.417
 1434    HA   TYR 199           HA       TYR 199  27.127 -11.049   8.829
 1435    HB2  TYR 199           HB2      TYR 199  25.219 -12.463   8.161
 1436    HB3  TYR 199           HB3      TYR 199  24.856 -10.745   8.071
 1437    HD1  TYR 199           HD1      TYR 199  25.413 -13.805   6.134
 1438    HD2  TYR 199           HD2      TYR 199  24.399  -9.675   5.915
 1439    HE1  TYR 199           HE1      TYR 199  24.715 -14.103   3.797
 1440    HE2  TYR 199           HE2      TYR 199  23.700  -9.969   3.580
 1441    HH   TYR 199           HH       TYR 199  24.231 -11.554   1.692
 1442    H    SER 200           H        SER 200  29.144 -11.260   6.480
 1443    HA   SER 200           HA       SER 200  30.434 -12.783   5.477
 1444    HB2  SER 200           HB2      SER 200  31.003 -14.820   6.878
 1445    HB3  SER 200           HB3      SER 200  31.264 -13.258   7.646
 1446    HG   SER 200           HG       SER 200  28.758 -14.275   8.079
 1447    H    ASP 201           H        ASP 201  28.808 -12.911   3.840
 1448    HA   ASP 201           HA       ASP 201  26.970 -15.032   3.578
 1449    HB2  ASP 201           HB2      ASP 201  28.427 -14.175   1.140
 1450    HB3  ASP 201           HB3      ASP 201  26.698 -14.296   1.416
 1451    H    GLN 202           H        GLN 202  30.334 -14.661   3.244
 1452    HA   GLN 202           HA       GLN 202  30.801 -17.218   1.954
 1453    HB2  GLN 202           HB2      GLN 202  32.613 -14.965   2.839
 1454    HB3  GLN 202           HB3      GLN 202  33.161 -16.402   1.964
 1455    HG2  GLN 202           HG2      GLN 202  31.228 -14.321   0.957
 1456    HG3  GLN 202           HG3      GLN 202  32.911 -14.501   0.472
 1457   HE21  GLN 202          HE21      GLN 202  29.703 -15.822   0.239
 1458   HE22  GLN 202          HE22      GLN 202  30.019 -16.882  -1.094
  Start of MODEL   15
    1    H1   GLY  -5           H1       GLY  -5 -41.352  -3.670   2.936
    2    H2   GLY  -5           H2       GLY  -5 -40.228  -2.623   3.655
    3    H3   GLY  -5           H3       GLY  -5 -41.887  -2.363   3.879
    4    HA2  GLY  -5           HA2      GLY  -5 -41.053  -3.326   5.866
    5    HA3  GLY  -5           HA3      GLY  -5 -42.025  -4.537   5.035
    6    H    ILE  -4           H        ILE  -4 -40.777  -5.998   3.538
    7    HA   ILE  -4           HA       ILE  -4 -38.391  -6.939   4.892
    8    HB   ILE  -4           HB       ILE  -4 -39.655  -8.048   2.375
    9   HG12  ILE  -4          HG12      ILE  -4 -40.129  -8.892   5.244
   10   HG13  ILE  -4          HG13      ILE  -4 -41.268  -7.974   4.266
   11   HG21  ILE  -4          HG21      ILE  -4 -38.503 -10.119   3.024
   12   HG22  ILE  -4          HG22      ILE  -4 -37.369  -8.795   2.760
   13   HG23  ILE  -4          HG23      ILE  -4 -37.790  -9.282   4.402
   14   HD11  ILE  -4          HD11      ILE  -4 -41.868 -10.326   4.369
   15   HD12  ILE  -4          HD12      ILE  -4 -41.456  -9.848   2.721
   16   HD13  ILE  -4          HD13      ILE  -4 -40.301 -10.764   3.688
   17    H    ASP  -3           H        ASP  -3 -37.314  -4.874   4.381
   18    HA   ASP  -3           HA       ASP  -3 -36.535  -4.555   1.574
   19    HB2  ASP  -3           HB2      ASP  -3 -36.335  -2.667   3.929
   20    HB3  ASP  -3           HB3      ASP  -3 -35.721  -2.306   2.320
   21    HA   PRO  -2           HA       PRO  -2 -32.540  -6.289   2.750
   22    HB2  PRO  -2           HB2      PRO  -2 -31.967  -5.740  -0.087
   23    HB3  PRO  -2           HB3      PRO  -2 -31.880  -7.266   0.795
   24    HG2  PRO  -2           HG2      PRO  -2 -33.806  -6.792  -1.014
   25    HG3  PRO  -2           HG3      PRO  -2 -34.110  -7.751   0.448
   26    HD2  PRO  -2           HD2      PRO  -2 -34.814  -4.898  -0.131
   27    HD3  PRO  -2           HD3      PRO  -2 -35.766  -6.148   0.697
   28    H    PHE  -1           H        PHE  -1 -30.654  -5.240   3.252
   29    HA   PHE  -1           HA       PHE  -1 -29.491  -3.490   4.006
   30    HB2  PHE  -1           HB2      PHE  -1 -29.805  -3.086   1.092
   31    HB3  PHE  -1           HB3      PHE  -1 -29.064  -1.815   2.038
   32    HD1  PHE  -1           HD1      PHE  -1 -26.945  -2.212   3.218
   33    HD2  PHE  -1           HD2      PHE  -1 -28.676  -5.130   0.652
   34    HE1  PHE  -1           HE1      PHE  -1 -24.791  -3.400   3.121
   35    HE2  PHE  -1           HE2      PHE  -1 -26.527  -6.327   0.555
   36    HZ   PHE  -1           HZ       PHE  -1 -24.581  -5.459   1.791
   37    H    THR   0           H        THR   0 -30.937  -2.673   5.502
   38    HA   THR   0           HA       THR   0 -32.932  -0.751   4.841
   39    HB   THR   0           HB       THR   0 -32.750  -0.332   7.412
   40    HG1  THR   0           HG1      THR   0 -31.509  -1.721   8.518
   41   HG21  THR   0          HG21      THR   0 -34.564  -1.574   6.346
   42   HG22  THR   0          HG22      THR   0 -34.075  -2.349   7.853
   43   HG23  THR   0          HG23      THR   0 -33.559  -3.023   6.307
   44    H    MET   1           H        MET   1 -32.454   1.230   6.860
   45    HA   MET   1           HA       MET   1 -30.603   2.861   5.344
   46    HB2  MET   1           HB2      MET   1 -32.828   3.707   6.158
   47    HB3  MET   1           HB3      MET   1 -32.184   3.650   7.791
   48    HG2  MET   1           HG2      MET   1 -32.073   5.899   6.970
   49    HG3  MET   1           HG3      MET   1 -30.441   5.261   7.136
   50    HE1  MET   1           HE1      MET   1 -29.048   5.156   3.600
   51    HE2  MET   1           HE2      MET   1 -28.693   5.410   5.309
   52    HE3  MET   1           HE3      MET   1 -29.396   3.886   4.770
   53    H    VAL   2           H        VAL   2 -29.315   0.842   6.451
   54    HA   VAL   2           HA       VAL   2 -27.444   2.222   8.205
   55    HB   VAL   2           HB       VAL   2 -26.997   0.096   9.436
   56   HG11  VAL   2          HG11      VAL   2 -29.798   1.180   9.704
   57   HG12  VAL   2          HG12      VAL   2 -28.943   0.236  10.925
   58   HG13  VAL   2          HG13      VAL   2 -28.347   1.830  10.464
   59   HG21  VAL   2          HG21      VAL   2 -28.650  -1.694   9.400
   60   HG22  VAL   2          HG22      VAL   2 -29.565  -0.841   8.155
   61   HG23  VAL   2          HG23      VAL   2 -27.948  -1.453   7.798
   62    H    ALA   3           H        ALA   3 -26.963   2.381   5.769
   63    HA   ALA   3           HA       ALA   3 -24.948   0.352   5.171
   64    HB1  ALA   3           HB1      ALA   3 -26.979   1.403   3.189
   65    HB2  ALA   3           HB2      ALA   3 -25.583   0.405   2.781
   66    HB3  ALA   3           HB3      ALA   3 -26.869  -0.249   3.796
   67    H    LEU   4           H        LEU   4 -23.288   1.131   3.828
   68    HA   LEU   4           HA       LEU   4 -22.984   4.048   4.061
   69    HB2  LEU   4           HB2      LEU   4 -21.118   1.772   4.447
   70    HB3  LEU   4           HB3      LEU   4 -20.460   3.232   3.738
   71    HG   LEU   4           HG       LEU   4 -21.054   4.517   5.701
   72   HD11  LEU   4          HD11      LEU   4 -22.223   1.979   6.812
   73   HD12  LEU   4          HD12      LEU   4 -22.048   3.514   7.666
   74   HD13  LEU   4          HD13      LEU   4 -23.137   3.393   6.285
   75   HD21  LEU   4          HD21      LEU   4 -19.612   3.444   7.333
   76   HD22  LEU   4          HD22      LEU   4 -19.739   1.920   6.450
   77   HD23  LEU   4          HD23      LEU   4 -18.940   3.306   5.708
   78    H    SER   5           H        SER   5 -22.750   5.167   2.267
   79    HA   SER   5           HA       SER   5 -22.637   3.707  -0.267
   80    HB2  SER   5           HB2      SER   5 -23.340   6.606   0.260
   81    HB3  SER   5           HB3      SER   5 -23.434   5.789  -1.295
   82    HG   SER   5           HG       SER   5 -25.014   5.421   1.008
   83    H    LEU   6           H        LEU   6 -20.614   3.349  -0.869
   84    HA   LEU   6           HA       LEU   6 -18.610   5.434  -0.310
   85    HB2  LEU   6           HB2      LEU   6 -18.081   2.474  -0.564
   86    HB3  LEU   6           HB3      LEU   6 -16.987   3.713   0.032
   87    HG   LEU   6           HG       LEU   6 -19.492   2.746   1.416
   88   HD11  LEU   6          HD11      LEU   6 -17.972   1.826   3.073
   89   HD12  LEU   6          HD12      LEU   6 -17.666   1.130   1.483
   90   HD13  LEU   6          HD13      LEU   6 -16.587   2.370   2.124
   91   HD21  LEU   6          HD21      LEU   6 -19.142   5.094   1.855
   92   HD22  LEU   6          HD22      LEU   6 -18.739   4.145   3.286
   93   HD23  LEU   6          HD23      LEU   6 -17.452   4.793   2.267
   94    H    LYS   7           H        LYS   7 -17.350   6.125  -1.930
   95    HA   LYS   7           HA       LYS   7 -17.844   5.169  -4.619
   96    HB2  LYS   7           HB2      LYS   7 -16.262   7.404  -3.416
   97    HB3  LYS   7           HB3      LYS   7 -15.902   6.888  -5.056
   98    HG2  LYS   7           HG2      LYS   7 -18.230   7.325  -5.689
   99    HG3  LYS   7           HG3      LYS   7 -18.557   7.882  -4.044
  100    HD2  LYS   7           HD2      LYS   7 -17.122   9.736  -4.274
  101    HD3  LYS   7           HD3      LYS   7 -16.379   9.080  -5.733
  102    HE2  LYS   7           HE2      LYS   7 -18.440   9.403  -6.960
  103    HE3  LYS   7           HE3      LYS   7 -19.247   9.978  -5.500
  104    HZ1  LYS   7           HZ1      LYS   7 -16.901  11.295  -6.764
  105    HZ2  LYS   7           HZ2      LYS   7 -17.793  11.872  -5.442
  106    HZ3  LYS   7           HZ3      LYS   7 -18.511  11.786  -6.974
  107    H    ILE   8           H        ILE   8 -16.893   3.315  -5.211
  108    HA   ILE   8           HA       ILE   8 -14.364   2.517  -4.044
  109    HB   ILE   8           HB       ILE   8 -16.012   1.137  -6.173
  110   HG12  ILE   8          HG12      ILE   8 -17.268   1.238  -4.096
  111   HG13  ILE   8          HG13      ILE   8 -16.681  -0.405  -4.353
  112   HG21  ILE   8          HG21      ILE   8 -14.662  -0.836  -5.627
  113   HG22  ILE   8          HG22      ILE   8 -13.676   0.489  -6.247
  114   HG23  ILE   8          HG23      ILE   8 -13.697   0.140  -4.518
  115   HD11  ILE   8          HD11      ILE   8 -14.885  -0.012  -2.754
  116   HD12  ILE   8          HD12      ILE   8 -15.466   1.634  -2.501
  117   HD13  ILE   8          HD13      ILE   8 -16.469   0.262  -2.028
  118    H    SER   9           H        SER   9 -12.754   3.755  -4.827
  119    HA   SER   9           HA       SER   9 -12.514   4.164  -7.699
  120    HB2  SER   9           HB2      SER   9 -11.946   6.070  -6.318
  121    HB3  SER   9           HB3      SER   9 -10.831   5.102  -5.362
  122    HG   SER   9           HG       SER   9  -9.343   5.417  -6.805
  123    H    ILE  10           H        ILE  10 -11.279   2.888  -8.973
  124    HA   ILE  10           HA       ILE  10  -9.264   1.198  -7.648
  125    HB   ILE  10           HB       ILE  10 -10.915   0.358 -10.040
  126   HG12  ILE  10          HG12      ILE  10 -11.155  -0.573  -7.169
  127   HG13  ILE  10          HG13      ILE  10 -12.262   0.556  -7.941
  128   HG21  ILE  10          HG21      ILE  10  -9.010  -1.181  -8.275
  129   HG22  ILE  10          HG22      ILE  10  -9.950  -1.853  -9.607
  130   HG23  ILE  10          HG23      ILE  10  -8.697  -0.656  -9.930
  131   HD11  ILE  10          HD11      ILE  10 -11.794  -2.294  -8.778
  132   HD12  ILE  10          HD12      ILE  10 -13.178  -1.691  -7.867
  133   HD13  ILE  10          HD13      ILE  10 -12.920  -1.164  -9.529
  134    H    GLY  11           H        GLY  11  -7.683   2.732  -8.147
  135    HA2  GLY  11           HA2      GLY  11  -5.856   3.346  -9.415
  136    HA3  GLY  11           HA3      GLY  11  -6.511   2.407 -10.748
  137    H    ASN  12           H        ASN  12  -8.482   3.397 -11.786
  138    HA   ASN  12           HA       ASN  12  -8.307   6.326 -11.867
  139    HB2  ASN  12           HB2      ASN  12  -8.347   6.291 -14.329
  140    HB3  ASN  12           HB3      ASN  12  -6.906   5.505 -13.693
  141   HD21  ASN  12          HD21      ASN  12  -8.360   5.254 -16.269
  142   HD22  ASN  12          HD22      ASN  12  -8.678   3.556 -16.439
  143    H    VAL  13           H        VAL  13 -10.191   3.500 -11.897
  144    HA   VAL  13           HA       VAL  13 -12.543   4.888 -12.951
  145    HB   VAL  13           HB       VAL  13 -12.023   2.593 -13.774
  146   HG11  VAL  13          HG11      VAL  13 -12.685   1.749 -10.959
  147   HG12  VAL  13          HG12      VAL  13 -12.461   0.666 -12.332
  148   HG13  VAL  13          HG13      VAL  13 -11.110   1.636 -11.744
  149   HG21  VAL  13          HG21      VAL  13 -14.628   2.837 -12.277
  150   HG22  VAL  13          HG22      VAL  13 -14.299   3.439 -13.901
  151   HG23  VAL  13          HG23      VAL  13 -14.294   1.703 -13.585
  152    H    VAL  14           H        VAL  14 -14.554   4.845 -11.727
  153    HA   VAL  14           HA       VAL  14 -14.283   4.286  -8.878
  154    HB   VAL  14           HB       VAL  14 -13.773   6.622  -8.889
  155   HG11  VAL  14          HG11      VAL  14 -15.247   8.314  -9.863
  156   HG12  VAL  14          HG12      VAL  14 -14.600   7.219 -11.084
  157   HG13  VAL  14          HG13      VAL  14 -16.263   7.035 -10.530
  158   HG21  VAL  14          HG21      VAL  14 -15.657   7.563  -7.598
  159   HG22  VAL  14          HG22      VAL  14 -16.650   6.193  -8.093
  160   HG23  VAL  14          HG23      VAL  14 -15.225   5.930  -7.088
  161    H    LYS  15           H        LYS  15 -15.945   3.227  -8.137
  162    HA   LYS  15           HA       LYS  15 -18.491   3.300  -9.620
  163    HB2  LYS  15           HB2      LYS  15 -17.066   0.884  -8.489
  164    HB3  LYS  15           HB3      LYS  15 -18.728   0.865  -9.061
  165    HG2  LYS  15           HG2      LYS  15 -16.303   1.513 -10.727
  166    HG3  LYS  15           HG3      LYS  15 -17.191  -0.014 -10.735
  167    HD2  LYS  15           HD2      LYS  15 -19.193   1.143 -11.510
  168    HD3  LYS  15           HD3      LYS  15 -18.333   2.682 -11.467
  169    HE2  LYS  15           HE2      LYS  15 -16.778   1.858 -13.166
  170    HE3  LYS  15           HE3      LYS  15 -17.633   0.315 -13.202
  171    HZ1  LYS  15           HZ1      LYS  15 -19.619   1.476 -13.944
  172    HZ2  LYS  15           HZ2      LYS  15 -18.330   1.745 -15.015
  173    HZ3  LYS  15           HZ3      LYS  15 -18.790   2.956 -13.921
  174    H    THR  16           H        THR  16 -20.376   2.947  -8.339
  175    HA   THR  16           HA       THR  16 -19.915   3.859  -5.586
  176    HB   THR  16           HB       THR  16 -22.485   3.912  -7.182
  177    HG1  THR  16           HG1      THR  16 -20.726   5.281  -7.992
  178   HG21  THR  16          HG21      THR  16 -23.227   5.498  -5.458
  179   HG22  THR  16          HG22      THR  16 -21.705   5.271  -4.597
  180   HG23  THR  16          HG23      THR  16 -22.834   3.926  -4.759
  181    H    MET  17           H        MET  17 -20.122   2.445  -3.985
  182    HA   MET  17           HA       MET  17 -21.928   0.159  -4.319
  183    HB2  MET  17           HB2      MET  17 -18.995   0.111  -3.875
  184    HB3  MET  17           HB3      MET  17 -19.936  -0.967  -2.857
  185    HG2  MET  17           HG2      MET  17 -20.246  -0.929  -5.836
  186    HG3  MET  17           HG3      MET  17 -19.011  -1.895  -5.032
  187    HE1  MET  17           HE1      MET  17 -21.182  -4.339  -2.846
  188    HE2  MET  17           HE2      MET  17 -19.549  -3.888  -3.335
  189    HE3  MET  17           HE3      MET  17 -20.507  -2.789  -2.344
  190    H    GLN  18           H        GLN  18 -22.814  -0.622  -2.420
  191    HA   GLN  18           HA       GLN  18 -22.319   1.058  -0.061
  192    HB2  GLN  18           HB2      GLN  18 -24.843  -0.227  -1.066
  193    HB3  GLN  18           HB3      GLN  18 -24.674   0.320   0.601
  194    HG2  GLN  18           HG2      GLN  18 -24.600   2.526   0.024
  195    HG3  GLN  18           HG3      GLN  18 -23.989   2.193  -1.597
  196   HE21  GLN  18          HE21      GLN  18 -25.496   3.417  -2.626
  197   HE22  GLN  18          HE22      GLN  18 -27.159   2.976  -2.731
  198    H    PHE  19           H        PHE  19 -21.968   0.120   1.879
  199    HA   PHE  19           HA       PHE  19 -21.984  -2.805   2.028
  200    HB2  PHE  19           HB2      PHE  19 -19.794  -1.001   3.100
  201    HB3  PHE  19           HB3      PHE  19 -19.872  -2.747   3.275
  202    HD1  PHE  19           HD1      PHE  19 -19.541  -4.194   1.297
  203    HD2  PHE  19           HD2      PHE  19 -18.932   0.008   1.155
  204    HE1  PHE  19           HE1      PHE  19 -18.267  -4.459  -0.791
  205    HE2  PHE  19           HE2      PHE  19 -17.657  -0.242  -0.937
  206    HZ   PHE  19           HZ       PHE  19 -17.241  -2.483  -1.861
  207    H    GLU  20           H        GLU  20 -22.191  -3.531   4.267
  208    HA   GLU  20           HA       GLU  20 -23.773  -1.772   5.877
  209    HB2  GLU  20           HB2      GLU  20 -22.526  -4.438   6.571
  210    HB3  GLU  20           HB3      GLU  20 -23.706  -3.582   7.551
  211    HG2  GLU  20           HG2      GLU  20 -25.346  -3.800   5.747
  212    HG3  GLU  20           HG3      GLU  20 -24.159  -4.689   4.792
  213    HA   PRO  21           HA       PRO  21 -20.698   0.495   8.123
  214    HB2  PRO  21           HB2      PRO  21 -22.077   0.045  10.600
  215    HB3  PRO  21           HB3      PRO  21 -22.064   1.503   9.614
  216    HG2  PRO  21           HG2      PRO  21 -24.093  -0.611   9.786
  217    HG3  PRO  21           HG3      PRO  21 -24.255   1.056   9.198
  218    HD2  PRO  21           HD2      PRO  21 -24.305  -1.101   7.567
  219    HD3  PRO  21           HD3      PRO  21 -23.699   0.487   7.059
  220    H    SER  22           H        SER  22 -21.938  -2.554   9.474
  221    HA   SER  22           HA       SER  22 -19.431  -2.961  10.895
  222    HB2  SER  22           HB2      SER  22 -22.030  -4.501  10.914
  223    HB3  SER  22           HB3      SER  22 -20.614  -4.934  11.872
  224    HG   SER  22           HG       SER  22 -20.781  -2.997  12.972
  225    H    THR  23           H        THR  23 -20.058  -3.403   7.787
  226    HA   THR  23           HA       THR  23 -19.282  -6.131   7.449
  227    HB   THR  23           HB       THR  23 -19.148  -3.890   5.422
  228    HG1  THR  23           HG1      THR  23 -21.188  -5.618   6.283
  229   HG21  THR  23          HG21      THR  23 -19.093  -5.694   3.769
  230   HG22  THR  23          HG22      THR  23 -19.052  -6.883   5.072
  231   HG23  THR  23          HG23      THR  23 -17.703  -5.767   4.854
  232    H    MET  24           H        MET  24 -17.482  -6.620   8.342
  233    HA   MET  24           HA       MET  24 -15.164  -5.120   8.609
  234    HB2  MET  24           HB2      MET  24 -15.988  -7.575   9.408
  235    HB3  MET  24           HB3      MET  24 -14.805  -8.017   8.185
  236    HG2  MET  24           HG2      MET  24 -13.059  -7.082   9.349
  237    HG3  MET  24           HG3      MET  24 -14.115  -6.020  10.286
  238    HE1  MET  24           HE1      MET  24 -12.086  -7.139  11.995
  239    HE2  MET  24           HE2      MET  24 -13.555  -6.405  12.650
  240    HE3  MET  24           HE3      MET  24 -12.967  -7.942  13.297
  241    H    VAL  25           H        VAL  25 -13.369  -4.845   7.392
  242    HA   VAL  25           HA       VAL  25 -13.404  -4.404   4.765
  243    HB   VAL  25           HB       VAL  25 -11.100  -5.315   6.450
  244   HG11  VAL  25          HG11      VAL  25 -10.575  -6.043   4.173
  245   HG12  VAL  25          HG12      VAL  25 -10.950  -4.430   3.567
  246   HG13  VAL  25          HG13      VAL  25  -9.576  -4.668   4.646
  247   HG21  VAL  25          HG21      VAL  25 -12.064  -3.132   6.880
  248   HG22  VAL  25          HG22      VAL  25 -10.450  -2.971   6.185
  249   HG23  VAL  25          HG23      VAL  25 -11.874  -2.698   5.181
  250    H    TYR  26           H        TYR  26 -12.341  -7.546   6.076
  251    HA   TYR  26           HA       TYR  26 -11.748  -8.720   3.631
  252    HB2  TYR  26           HB2      TYR  26 -11.859 -10.890   4.714
  253    HB3  TYR  26           HB3      TYR  26 -11.063  -9.725   5.760
  254    HD1  TYR  26           HD1      TYR  26 -14.229 -11.588   5.220
  255    HD2  TYR  26           HD2      TYR  26 -11.891  -9.279   7.933
  256    HE1  TYR  26           HE1      TYR  26 -15.725 -12.234   7.059
  257    HE2  TYR  26           HE2      TYR  26 -13.389  -9.914   9.772
  258    HH   TYR  26           HH       TYR  26 -15.654 -10.703  10.124
  259    H    ASP  27           H        ASP  27 -14.849  -8.294   5.172
  260    HA   ASP  27           HA       ASP  27 -16.175 -10.227   3.490
  261    HB2  ASP  27           HB2      ASP  27 -16.808  -9.493   5.909
  262    HB3  ASP  27           HB3      ASP  27 -17.610  -8.146   5.108
  263    H    ALA  28           H        ALA  28 -15.838  -6.721   3.672
  264    HA   ALA  28           HA       ALA  28 -17.608  -6.049   1.601
  265    HB1  ALA  28           HB1      ALA  28 -15.103  -4.608   2.475
  266    HB2  ALA  28           HB2      ALA  28 -16.418  -3.921   1.521
  267    HB3  ALA  28           HB3      ALA  28 -16.703  -4.414   3.190
  268    H    CYS  29           H        CYS  29 -14.168  -6.761   1.623
  269    HA   CYS  29           HA       CYS  29 -13.533  -6.343  -1.030
  270    HB2  CYS  29           HB2      CYS  29 -12.475  -8.395   0.911
  271    HB3  CYS  29           HB3      CYS  29 -11.723  -8.025  -0.632
  272    HG   CYS  29           HG       CYS  29 -12.037  -5.945   2.057
  273    H    ARG  30           H        ARG  30 -15.378  -8.950   0.348
  274    HA   ARG  30           HA       ARG  30 -14.988 -10.694  -1.921
  275    HB2  ARG  30           HB2      ARG  30 -16.147 -12.314  -0.786
  276    HB3  ARG  30           HB3      ARG  30 -15.586 -11.340   0.562
  277    HG2  ARG  30           HG2      ARG  30 -17.758 -10.270   0.736
  278    HG3  ARG  30           HG3      ARG  30 -18.323 -11.162  -0.681
  279    HD2  ARG  30           HD2      ARG  30 -19.158 -12.318   1.209
  280    HD3  ARG  30           HD3      ARG  30 -17.818 -13.277   0.586
  281    HE   ARG  30           HE       ARG  30 -17.778 -11.636   3.026
  282   HH11  ARG  30          HH11      ARG  30 -16.388 -14.153   1.019
  283   HH12  ARG  30          HH12      ARG  30 -15.264 -14.676   2.241
  284   HH21  ARG  30          HH21      ARG  30 -16.320 -12.318   4.618
  285   HH22  ARG  30          HH22      ARG  30 -15.205 -13.614   4.290
  286    H    MET  31           H        MET  31 -17.463  -8.436  -0.835
  287    HA   MET  31           HA       MET  31 -19.298  -9.164  -2.922
  288    HB2  MET  31           HB2      MET  31 -19.344  -6.760  -1.096
  289    HB3  MET  31           HB3      MET  31 -20.680  -7.373  -2.060
  290    HG2  MET  31           HG2      MET  31 -20.732  -9.410  -0.772
  291    HG3  MET  31           HG3      MET  31 -19.333  -8.888   0.156
  292    HE1  MET  31           HE1      MET  31 -19.275  -7.009   1.824
  293    HE2  MET  31           HE2      MET  31 -19.871  -5.831   0.651
  294    HE3  MET  31           HE3      MET  31 -20.627  -5.951   2.243
  295    H    ILE  32           H        ILE  32 -16.879  -6.668  -2.428
  296    HA   ILE  32           HA       ILE  32 -17.746  -4.993  -4.538
  297    HB   ILE  32           HB       ILE  32 -16.163  -4.456  -2.579
  298   HG12  ILE  32          HG12      ILE  32 -16.792  -2.907  -4.450
  299   HG13  ILE  32          HG13      ILE  32 -15.237  -2.575  -3.703
  300   HG21  ILE  32          HG21      ILE  32 -13.767  -4.562  -3.072
  301   HG22  ILE  32          HG22      ILE  32 -14.501  -6.160  -2.930
  302   HG23  ILE  32          HG23      ILE  32 -14.121  -5.502  -4.522
  303   HD11  ILE  32          HD11      ILE  32 -15.669  -3.982  -6.325
  304   HD12  ILE  32          HD12      ILE  32 -15.155  -2.307  -6.107
  305   HD13  ILE  32          HD13      ILE  32 -14.107  -3.628  -5.584
  306    H    ARG  33           H        ARG  33 -15.242  -7.509  -4.383
  307    HA   ARG  33           HA       ARG  33 -14.600  -7.599  -7.109
  308    HB2  ARG  33           HB2      ARG  33 -14.511  -9.677  -4.937
  309    HB3  ARG  33           HB3      ARG  33 -14.027 -10.054  -6.584
  310    HG2  ARG  33           HG2      ARG  33 -12.316  -8.322  -6.488
  311    HG3  ARG  33           HG3      ARG  33 -12.812  -7.922  -4.841
  312    HD2  ARG  33           HD2      ARG  33 -11.886 -10.664  -5.668
  313    HD3  ARG  33           HD3      ARG  33 -10.797  -9.424  -5.048
  314    HE   ARG  33           HE       ARG  33 -12.556  -9.478  -3.098
  315   HH11  ARG  33          HH11      ARG  33 -11.279 -12.208  -4.880
  316   HH12  ARG  33          HH12      ARG  33 -11.272 -13.265  -3.499
  317   HH21  ARG  33          HH21      ARG  33 -12.576 -10.876  -1.291
  318   HH22  ARG  33          HH22      ARG  33 -12.040 -12.519  -1.459
  319    H    GLU  34           H        GLU  34 -17.344  -8.742  -5.407
  320    HA   GLU  34           HA       GLU  34 -18.148 -10.850  -7.110
  321    HB2  GLU  34           HB2      GLU  34 -19.008 -10.770  -4.899
  322    HB3  GLU  34           HB3      GLU  34 -19.591  -9.128  -5.106
  323    HG2  GLU  34           HG2      GLU  34 -21.229 -10.009  -6.770
  324    HG3  GLU  34           HG3      GLU  34 -20.717 -11.637  -6.312
  325    H    ARG  35           H        ARG  35 -19.575  -7.584  -6.774
  326    HA   ARG  35           HA       ARG  35 -20.935  -7.916  -9.294
  327    HB2  ARG  35           HB2      ARG  35 -21.614  -5.448  -8.794
  328    HB3  ARG  35           HB3      ARG  35 -22.308  -6.767  -7.864
  329    HG2  ARG  35           HG2      ARG  35 -19.859  -5.737  -6.692
  330    HG3  ARG  35           HG3      ARG  35 -21.121  -4.512  -6.850
  331    HD2  ARG  35           HD2      ARG  35 -21.650  -7.228  -5.674
  332    HD3  ARG  35           HD3      ARG  35 -21.089  -5.874  -4.696
  333    HE   ARG  35           HE       ARG  35 -23.287  -4.943  -6.084
  334   HH11  ARG  35          HH11      ARG  35 -22.714  -7.630  -3.917
  335   HH12  ARG  35          HH12      ARG  35 -24.241  -7.464  -3.106
  336   HH21  ARG  35          HH21      ARG  35 -25.296  -4.725  -5.032
  337   HH22  ARG  35          HH22      ARG  35 -25.723  -5.821  -3.748
  338    H    ILE  36           H        ILE  36 -18.105  -6.133  -8.184
  339    HA   ILE  36           HA       ILE  36 -17.990  -4.759 -10.779
  340    HB   ILE  36           HB       ILE  36 -16.360  -4.181  -8.300
  341   HG12  ILE  36          HG12      ILE  36 -18.809  -2.762  -9.375
  342   HG13  ILE  36          HG13      ILE  36 -18.777  -3.790  -7.946
  343   HG21  ILE  36          HG21      ILE  36 -15.850  -2.064  -9.428
  344   HG22  ILE  36          HG22      ILE  36 -15.292  -3.452 -10.364
  345   HG23  ILE  36          HG23      ILE  36 -16.763  -2.601 -10.840
  346   HD11  ILE  36          HD11      ILE  36 -17.285  -1.201  -8.299
  347   HD12  ILE  36          HD12      ILE  36 -18.745  -1.446  -7.340
  348   HD13  ILE  36          HD13      ILE  36 -17.237  -2.231  -6.868
  349    HA   PRO  37           HA       PRO  37 -14.825  -7.834 -11.708
  350    HB2  PRO  37           HB2      PRO  37 -14.954  -6.807 -14.425
  351    HB3  PRO  37           HB3      PRO  37 -15.447  -8.387 -13.813
  352    HG2  PRO  37           HG2      PRO  37 -17.215  -6.527 -14.707
  353    HG3  PRO  37           HG3      PRO  37 -17.612  -7.717 -13.454
  354    HD2  PRO  37           HD2      PRO  37 -16.853  -4.833 -13.158
  355    HD3  PRO  37           HD3      PRO  37 -18.106  -5.761 -12.307
  356    H    GLU  38           H        GLU  38 -14.745  -4.451 -11.954
  357    HA   GLU  38           HA       GLU  38 -12.135  -4.170 -13.099
  358    HB2  GLU  38           HB2      GLU  38 -13.892  -2.262 -11.548
  359    HB3  GLU  38           HB3      GLU  38 -12.342  -1.811 -12.243
  360    HG2  GLU  38           HG2      GLU  38 -14.633  -2.903 -13.853
  361    HG3  GLU  38           HG3      GLU  38 -14.346  -1.182 -13.594
  362    H    ALA  39           H        ALA  39 -13.219  -5.229 -10.132
  363    HA   ALA  39           HA       ALA  39 -11.334  -3.990  -8.400
  364    HB1  ALA  39           HB1      ALA  39 -12.946  -6.506  -8.001
  365    HB2  ALA  39           HB2      ALA  39 -12.116  -5.593  -6.743
  366    HB3  ALA  39           HB3      ALA  39 -13.472  -4.871  -7.607
  367    H    LEU  40           H        LEU  40 -11.487  -7.213  -9.904
  368    HA   LEU  40           HA       LEU  40  -8.891  -7.801  -8.754
  369    HB2  LEU  40           HB2      LEU  40  -9.352 -10.120  -9.859
  370    HB3  LEU  40           HB3      LEU  40 -10.111  -9.668  -8.351
  371    HG   LEU  40           HG       LEU  40 -11.572 -10.879 -10.008
  372   HD11  LEU  40          HD11      LEU  40 -13.538  -9.485  -9.616
  373   HD12  LEU  40          HD12      LEU  40 -12.542  -9.642  -8.170
  374   HD13  LEU  40          HD13      LEU  40 -12.491  -8.156  -9.118
  375   HD21  LEU  40          HD21      LEU  40 -12.583  -9.492 -11.797
  376   HD22  LEU  40          HD22      LEU  40 -11.346  -8.271 -11.481
  377   HD23  LEU  40          HD23      LEU  40 -10.879  -9.870 -12.058
  378    H    ALA  41           H        ALA  41  -7.980  -6.124 -10.205
  379    HA   ALA  41           HA       ALA  41  -7.550  -6.840 -12.947
  380    HB1  ALA  41           HB1      ALA  41  -6.113  -4.814 -11.236
  381    HB2  ALA  41           HB2      ALA  41  -6.014  -4.942 -12.991
  382    HB3  ALA  41           HB3      ALA  41  -7.539  -4.499 -12.225
  383    H    GLY  42           H        GLY  42  -6.683  -8.488 -10.475
  384    HA2  GLY  42           HA2      GLY  42  -4.552  -9.884 -11.602
  385    HA3  GLY  42           HA3      GLY  42  -3.885  -8.737 -10.440
  386    HA   PRO  43           HA       PRO  43  -4.980 -12.436  -7.884
  387    HB2  PRO  43           HB2      PRO  43  -2.851 -11.306  -6.193
  388    HB3  PRO  43           HB3      PRO  43  -3.036 -12.948  -6.815
  389    HG2  PRO  43           HG2      PRO  43  -1.156 -11.277  -7.764
  390    HG3  PRO  43           HG3      PRO  43  -1.973 -12.460  -8.803
  391    HD2  PRO  43           HD2      PRO  43  -2.433  -9.515  -8.551
  392    HD3  PRO  43           HD3      PRO  43  -2.445 -10.538 -10.003
  393    HA   PRO  44           HA       PRO  44  -7.594  -9.477  -5.713
  394    HB2  PRO  44           HB2      PRO  44  -9.107 -11.370  -4.437
  395    HB3  PRO  44           HB3      PRO  44  -9.383 -10.835  -6.097
  396    HG2  PRO  44           HG2      PRO  44  -7.951 -13.264  -5.102
  397    HG3  PRO  44           HG3      PRO  44  -9.086 -13.105  -6.456
  398    HD2  PRO  44           HD2      PRO  44  -6.432 -13.230  -6.849
  399    HD3  PRO  44           HD3      PRO  44  -7.475 -12.209  -7.861
  400    H    ASN  45           H        ASN  45  -5.573 -11.898  -4.382
  401    HA   ASN  45           HA       ASN  45  -6.049 -11.357  -1.616
  402    HB2  ASN  45           HB2      ASN  45  -3.653 -12.659  -2.935
  403    HB3  ASN  45           HB3      ASN  45  -4.076 -12.749  -1.228
  404   HD21  ASN  45          HD21      ASN  45  -3.731 -14.847  -3.272
  405   HD22  ASN  45          HD22      ASN  45  -5.219 -15.748  -3.254
  406    H    ASP  46           H        ASP  46  -4.256  -9.889  -4.122
  407    HA   ASP  46           HA       ASP  46  -2.524  -8.442  -2.258
  408    HB2  ASP  46           HB2      ASP  46  -2.522  -8.607  -5.277
  409    HB3  ASP  46           HB3      ASP  46  -1.427  -7.589  -4.344
  410    H    PHE  47           H        PHE  47  -5.544  -8.089  -3.154
  411    HA   PHE  47           HA       PHE  47  -5.333  -5.192  -3.628
  412    HB2  PHE  47           HB2      PHE  47  -7.452  -7.185  -4.406
  413    HB3  PHE  47           HB3      PHE  47  -7.792  -5.461  -4.348
  414    HD1  PHE  47           HD1      PHE  47  -6.574  -3.922  -5.856
  415    HD2  PHE  47           HD2      PHE  47  -6.250  -8.143  -6.219
  416    HE1  PHE  47           HE1      PHE  47  -5.716  -3.655  -8.144
  417    HE2  PHE  47           HE2      PHE  47  -5.384  -7.885  -8.501
  418    HZ   PHE  47           HZ       PHE  47  -5.116  -5.639  -9.469
  419    H    GLY  48           H        GLY  48  -5.985  -3.865  -2.083
  420    HA2  GLY  48           HA2      GLY  48  -7.663  -4.976   0.083
  421    HA3  GLY  48           HA3      GLY  48  -6.226  -4.030   0.432
  422    H    LEU  49           H        LEU  49  -8.157  -3.008   1.664
  423    HA   LEU  49           HA       LEU  49  -9.635  -1.151  -0.056
  424    HB2  LEU  49           HB2      LEU  49 -10.080  -1.885   2.839
  425    HB3  LEU  49           HB3      LEU  49 -11.091  -0.807   1.895
  426    HG   LEU  49           HG       LEU  49 -10.719  -3.770   1.455
  427   HD11  LEU  49          HD11      LEU  49 -13.156  -2.178   2.235
  428   HD12  LEU  49          HD12      LEU  49 -13.068  -3.927   2.007
  429   HD13  LEU  49          HD13      LEU  49 -12.185  -3.163   3.330
  430   HD21  LEU  49          HD21      LEU  49 -12.348  -1.786  -0.122
  431   HD22  LEU  49          HD22      LEU  49 -10.895  -2.616  -0.680
  432   HD23  LEU  49          HD23      LEU  49 -12.360  -3.537  -0.338
  433    H    PHE  50           H        PHE  50  -8.479   0.570  -0.400
  434    HA   PHE  50           HA       PHE  50  -7.037   1.898   1.773
  435    HB2  PHE  50           HB2      PHE  50  -5.890   1.608  -0.399
  436    HB3  PHE  50           HB3      PHE  50  -7.145   2.560  -1.181
  437    HD1  PHE  50           HD1      PHE  50  -4.263   2.661   1.084
  438    HD2  PHE  50           HD2      PHE  50  -7.183   4.951  -1.001
  439    HE1  PHE  50           HE1      PHE  50  -2.970   4.707   1.527
  440    HE2  PHE  50           HE2      PHE  50  -5.898   7.001  -0.556
  441    HZ   PHE  50           HZ       PHE  50  -3.789   6.881   0.709
  442    H    LEU  51           H        LEU  51  -7.764   3.703   2.736
  443    HA   LEU  51           HA       LEU  51 -10.387   4.665   1.898
  444    HB2  LEU  51           HB2      LEU  51  -9.921   4.006   4.283
  445    HB3  LEU  51           HB3      LEU  51  -8.827   5.369   4.390
  446    HG   LEU  51           HG       LEU  51 -11.238   5.586   5.326
  447   HD11  LEU  51          HD11      LEU  51 -11.296   7.962   4.781
  448   HD12  LEU  51          HD12      LEU  51  -9.667   7.437   5.204
  449   HD13  LEU  51          HD13      LEU  51 -10.096   7.705   3.515
  450   HD21  LEU  51          HD21      LEU  51 -12.869   6.425   3.705
  451   HD22  LEU  51          HD22      LEU  51 -11.739   6.083   2.394
  452   HD23  LEU  51          HD23      LEU  51 -12.401   4.760   3.355
  453    H    SER  52           H        SER  52 -10.430   6.274   0.512
  454    HA   SER  52           HA       SER  52  -8.140   8.006   0.185
  455    HB2  SER  52           HB2      SER  52 -10.807   8.047  -1.251
  456    HB3  SER  52           HB3      SER  52  -9.340   8.897  -1.741
  457    HG   SER  52           HG       SER  52  -9.012   6.193  -1.338
  458    H    ASP  53           H        ASP  53  -8.220   8.970   2.253
  459    HA   ASP  53           HA       ASP  53 -10.435  10.401   3.253
  460    HB2  ASP  53           HB2      ASP  53  -8.489   9.608   4.608
  461    HB3  ASP  53           HB3      ASP  53  -7.500  10.848   3.847
  462    H    ASP  54           H        ASP  54  -7.389  11.597   1.862
  463    HA   ASP  54           HA       ASP  54  -8.429  13.428   0.066
  464    HB2  ASP  54           HB2      ASP  54  -9.340  14.474   2.220
  465    HB3  ASP  54           HB3      ASP  54  -7.670  14.860   2.619
  466    H    ASP  55           H        ASP  55  -6.062  13.910   2.647
  467    HA   ASP  55           HA       ASP  55  -3.968  14.472   0.717
  468    HB2  ASP  55           HB2      ASP  55  -4.253  15.866   2.748
  469    HB3  ASP  55           HB3      ASP  55  -3.917  14.460   3.749
  470    HA   PRO  56           HA       PRO  56  -2.067  10.447   0.557
  471    HB2  PRO  56           HB2      PRO  56   0.578  11.340   0.949
  472    HB3  PRO  56           HB3      PRO  56  -0.233  11.074  -0.594
  473    HG2  PRO  56           HG2      PRO  56   0.175  13.598   0.924
  474    HG3  PRO  56           HG3      PRO  56   0.124  13.332  -0.829
  475    HD2  PRO  56           HD2      PRO  56  -1.928  14.460   0.456
  476    HD3  PRO  56           HD3      PRO  56  -2.201  13.321  -0.881
  477    H    LYS  57           H        LYS  57  -1.231  12.648   3.210
  478    HA   LYS  57           HA       LYS  57  -0.081  10.552   4.832
  479    HB2  LYS  57           HB2      LYS  57  -0.957  13.349   5.576
  480    HB3  LYS  57           HB3      LYS  57  -0.056  12.259   6.619
  481    HG2  LYS  57           HG2      LYS  57   0.938  13.281   3.971
  482    HG3  LYS  57           HG3      LYS  57   1.326  13.999   5.534
  483    HD2  LYS  57           HD2      LYS  57   2.005  11.215   4.598
  484    HD3  LYS  57           HD3      LYS  57   3.128  12.551   4.847
  485    HE2  LYS  57           HE2      LYS  57   1.491  11.170   6.970
  486    HE3  LYS  57           HE3      LYS  57   3.219  10.983   6.702
  487    HZ1  LYS  57           HZ1      LYS  57   2.822  12.474   8.517
  488    HZ2  LYS  57           HZ2      LYS  57   1.835  13.468   7.562
  489    HZ3  LYS  57           HZ3      LYS  57   3.494  13.347   7.225
  490    H    LYS  58           H        LYS  58  -3.202  11.958   4.347
  491    HA   LYS  58           HA       LYS  58  -4.282  10.890   6.817
  492    HB2  LYS  58           HB2      LYS  58  -5.667  12.352   4.560
  493    HB3  LYS  58           HB3      LYS  58  -6.334  12.029   6.157
  494    HG2  LYS  58           HG2      LYS  58  -4.729  13.474   7.191
  495    HG3  LYS  58           HG3      LYS  58  -3.866  13.682   5.667
  496    HD2  LYS  58           HD2      LYS  58  -5.186  15.636   6.042
  497    HD3  LYS  58           HD3      LYS  58  -5.926  14.720   4.729
  498    HE2  LYS  58           HE2      LYS  58  -7.635  15.541   6.238
  499    HE3  LYS  58           HE3      LYS  58  -7.549  13.783   6.320
  500    HZ1  LYS  58           HZ1      LYS  58  -6.317  15.658   8.273
  501    HZ2  LYS  58           HZ2      LYS  58  -6.283  13.962   8.364
  502    HZ3  LYS  58           HZ3      LYS  58  -7.752  14.790   8.511
  503    H    GLY  59           H        GLY  59  -3.852   9.903   3.601
  504    HA2  GLY  59           HA2      GLY  59  -6.061   8.076   3.430
  505    HA3  GLY  59           HA3      GLY  59  -4.646   8.105   2.382
  506    H    ILE  60           H        ILE  60  -6.018   5.803   3.674
  507    HA   ILE  60           HA       ILE  60  -3.742   4.659   5.089
  508    HB   ILE  60           HB       ILE  60  -5.297   3.826   6.915
  509   HG12  ILE  60          HG12      ILE  60  -6.988   6.168   6.018
  510   HG13  ILE  60          HG13      ILE  60  -7.373   4.490   5.658
  511   HG21  ILE  60          HG21      ILE  60  -5.031   5.841   8.268
  512   HG22  ILE  60          HG22      ILE  60  -3.586   5.513   7.310
  513   HG23  ILE  60          HG23      ILE  60  -4.706   6.781   6.811
  514   HD11  ILE  60          HD11      ILE  60  -7.599   4.011   8.015
  515   HD12  ILE  60          HD12      ILE  60  -7.136   5.668   8.413
  516   HD13  ILE  60          HD13      ILE  60  -8.642   5.354   7.550
  517    H    TRP  61           H        TRP  61  -4.036   2.358   5.545
  518    HA   TRP  61           HA       TRP  61  -5.793   1.068   3.580
  519    HB2  TRP  61           HB2      TRP  61  -3.439   0.001   5.150
  520    HB3  TRP  61           HB3      TRP  61  -4.457  -0.991   4.107
  521    HD1  TRP  61           HD1      TRP  61  -1.627   1.484   4.024
  522    HE1  TRP  61           HE1      TRP  61  -0.763   1.744   1.617
  523    HE3  TRP  61           HE3      TRP  61  -5.288  -1.112   1.608
  524    HZ2  TRP  61           HZ2      TRP  61  -1.547   0.918  -0.976
  525    HZ3  TRP  61           HZ3      TRP  61  -5.165  -1.335  -0.837
  526    HH2  TRP  61           HH2      TRP  61  -3.329  -0.338  -2.101
  527    H    LEU  62           H        LEU  62  -7.544   0.059   4.182
  528    HA   LEU  62           HA       LEU  62  -8.262  -0.068   6.980
  529    HB2  LEU  62           HB2      LEU  62  -9.769  -1.062   4.561
  530    HB3  LEU  62           HB3      LEU  62 -10.429  -0.756   6.157
  531    HG   LEU  62           HG       LEU  62  -9.269   1.397   4.386
  532   HD11  LEU  62          HD11      LEU  62 -11.245   0.428   3.342
  533   HD12  LEU  62          HD12      LEU  62 -12.153   0.645   4.839
  534   HD13  LEU  62          HD13      LEU  62 -11.575   2.052   3.944
  535   HD21  LEU  62          HD21      LEU  62 -10.921   1.500   6.901
  536   HD22  LEU  62          HD22      LEU  62  -9.215   1.927   6.750
  537   HD23  LEU  62          HD23      LEU  62 -10.443   2.894   5.930
  538    H    GLU  63           H        GLU  63  -7.459  -1.739   8.152
  539    HA   GLU  63           HA       GLU  63  -6.553  -4.139   6.945
  540    HB2  GLU  63           HB2      GLU  63  -6.118  -4.883   9.245
  541    HB3  GLU  63           HB3      GLU  63  -5.509  -3.257   8.973
  542    HG2  GLU  63           HG2      GLU  63  -7.404  -2.313  10.132
  543    HG3  GLU  63           HG3      GLU  63  -8.118  -3.913  10.324
  544    H    ALA  64           H        ALA  64  -7.329  -6.266   7.288
  545    HA   ALA  64           HA       ALA  64 -10.157  -6.526   7.095
  546    HB1  ALA  64           HB1      ALA  64  -8.613  -8.059   5.973
  547    HB2  ALA  64           HB2      ALA  64  -8.074  -8.661   7.541
  548    HB3  ALA  64           HB3      ALA  64  -9.739  -8.924   7.019
  549    H    GLY  65           H        GLY  65  -8.116  -6.165   9.730
  550    HA2  GLY  65           HA2      GLY  65  -9.641  -7.840  11.545
  551    HA3  GLY  65           HA3      GLY  65  -8.204  -6.913  11.937
  552    H    LYS  66           H        LYS  66 -10.542  -5.048  10.278
  553    HA   LYS  66           HA       LYS  66 -11.911  -4.320  12.743
  554    HB2  LYS  66           HB2      LYS  66 -11.111  -2.234  12.986
  555    HB3  LYS  66           HB3      LYS  66  -9.760  -2.795  12.011
  556    HG2  LYS  66           HG2      LYS  66 -12.202  -1.462  10.861
  557    HG3  LYS  66           HG3      LYS  66 -10.757  -0.585  11.359
  558    HD2  LYS  66           HD2      LYS  66  -9.457  -1.537   9.669
  559    HD3  LYS  66           HD3      LYS  66 -10.598  -2.861   9.413
  560    HE2  LYS  66           HE2      LYS  66 -11.149   0.041   8.787
  561    HE3  LYS  66           HE3      LYS  66 -10.662  -1.170   7.604
  562    HZ1  LYS  66           HZ1      LYS  66 -13.153  -1.093   9.193
  563    HZ2  LYS  66           HZ2      LYS  66 -12.672  -2.435   8.280
  564    HZ3  LYS  66           HZ3      LYS  66 -12.995  -0.962   7.510
  565    H    ALA  67           H        ALA  67 -13.788  -2.908  12.366
  566    HA   ALA  67           HA       ALA  67 -15.055  -3.685   9.847
  567    HB1  ALA  67           HB1      ALA  67 -16.185  -4.159  11.992
  568    HB2  ALA  67           HB2      ALA  67 -16.286  -2.421  12.290
  569    HB3  ALA  67           HB3      ALA  67 -17.140  -3.130  10.917
  570    H    LEU  68           H        LEU  68 -16.415  -1.979   8.749
  571    HA   LEU  68           HA       LEU  68 -14.566   0.014   7.965
  572    HB2  LEU  68           HB2      LEU  68 -17.463  -0.351   7.304
  573    HB3  LEU  68           HB3      LEU  68 -16.435   0.831   6.529
  574    HG   LEU  68           HG       LEU  68 -16.073  -2.166   6.427
  575   HD11  LEU  68          HD11      LEU  68 -16.666  -1.928   4.071
  576   HD12  LEU  68          HD12      LEU  68 -17.983  -1.416   5.127
  577   HD13  LEU  68          HD13      LEU  68 -16.977  -0.210   4.322
  578   HD21  LEU  68          HD21      LEU  68 -14.329  -1.686   4.781
  579   HD22  LEU  68          HD22      LEU  68 -14.535   0.043   5.066
  580   HD23  LEU  68          HD23      LEU  68 -13.938  -1.000   6.358
  581    H    ASP  69           H        ASP  69 -17.710   0.300   9.610
  582    HA   ASP  69           HA       ASP  69 -17.618   3.139   9.738
  583    HB2  ASP  69           HB2      ASP  69 -19.750   2.031   9.667
  584    HB3  ASP  69           HB3      ASP  69 -19.378   1.103  11.113
  585    H    TYR  70           H        TYR  70 -16.239   0.673  11.644
  586    HA   TYR  70           HA       TYR  70 -15.930   1.969  14.093
  587    HB2  TYR  70           HB2      TYR  70 -15.309  -0.300  14.017
  588    HB3  TYR  70           HB3      TYR  70 -14.293  -0.088  12.596
  589    HD1  TYR  70           HD1      TYR  70 -14.558   0.719  16.197
  590    HD2  TYR  70           HD2      TYR  70 -11.996   0.299  12.836
  591    HE1  TYR  70           HE1      TYR  70 -12.603   0.924  17.672
  592    HE2  TYR  70           HE2      TYR  70 -10.030   0.503  14.296
  593    HH   TYR  70           HH       TYR  70 -10.193   0.242  17.653
  594    H    TYR  71           H        TYR  71 -14.384   2.417  11.007
  595    HA   TYR  71           HA       TYR  71 -12.445   4.316  11.985
  596    HB2  TYR  71           HB2      TYR  71 -13.119   3.083   9.399
  597    HB3  TYR  71           HB3      TYR  71 -12.527   4.737   9.292
  598    HD1  TYR  71           HD1      TYR  71 -10.307   5.268  10.436
  599    HD2  TYR  71           HD2      TYR  71 -11.642   1.297   9.716
  600    HE1  TYR  71           HE1      TYR  71  -7.998   4.453  10.670
  601    HE2  TYR  71           HE2      TYR  71  -9.337   0.471   9.951
  602    HH   TYR  71           HH       TYR  71  -7.044   1.310   9.761
  603    H    MET  72           H        MET  72 -12.708   6.253   9.893
  604    HA   MET  72           HA       MET  72 -14.899   7.821  11.055
  605    HB2  MET  72           HB2      MET  72 -12.568   8.729   9.360
  606    HB3  MET  72           HB3      MET  72 -13.748   9.775  10.131
  607    HG2  MET  72           HG2      MET  72 -12.964   8.986  12.328
  608    HG3  MET  72           HG3      MET  72 -11.737   8.017  11.512
  609    HE1  MET  72           HE1      MET  72 -11.131  10.081   9.053
  610    HE2  MET  72           HE2      MET  72  -9.693  10.886   9.683
  611    HE3  MET  72           HE3      MET  72  -9.879   9.143   9.867
  612    H    LEU  73           H        LEU  73 -15.108   5.763   8.755
  613    HA   LEU  73           HA       LEU  73 -15.888   7.644   6.641
  614    HB2  LEU  73           HB2      LEU  73 -15.829   5.591   5.144
  615    HB3  LEU  73           HB3      LEU  73 -14.302   6.240   5.697
  616    HG   LEU  73           HG       LEU  73 -14.288   4.435   7.465
  617   HD11  LEU  73          HD11      LEU  73 -15.687   2.497   7.114
  618   HD12  LEU  73          HD12      LEU  73 -16.679   3.923   7.412
  619   HD13  LEU  73          HD13      LEU  73 -16.503   3.301   5.771
  620   HD21  LEU  73          HD21      LEU  73 -13.545   2.706   5.914
  621   HD22  LEU  73          HD22      LEU  73 -14.306   3.573   4.580
  622   HD23  LEU  73          HD23      LEU  73 -12.945   4.296   5.438
  623    H    ARG  74           H        ARG  74 -17.719   7.340   5.455
  624    HA   ARG  74           HA       ARG  74 -19.820   5.610   6.237
  625    HB2  ARG  74           HB2      ARG  74 -21.310   7.602   6.985
  626    HB3  ARG  74           HB3      ARG  74 -20.212   6.881   8.143
  627    HG2  ARG  74           HG2      ARG  74 -20.041   9.194   8.465
  628    HG3  ARG  74           HG3      ARG  74 -18.593   8.741   7.571
  629    HD2  ARG  74           HD2      ARG  74 -20.707   9.426   5.750
  630    HD3  ARG  74           HD3      ARG  74 -20.470  10.722   6.920
  631    HE   ARG  74           HE       ARG  74 -18.159   9.616   5.464
  632   HH11  ARG  74          HH11      ARG  74 -20.278  12.319   6.206
  633   HH12  ARG  74          HH12      ARG  74 -19.253  13.491   5.431
  634   HH21  ARG  74          HH21      ARG  74 -16.812  11.145   4.466
  635   HH22  ARG  74          HH22      ARG  74 -17.275  12.826   4.441
  636    H    ASN  75           H        ASN  75 -21.918   7.377   5.454
  637    HA   ASN  75           HA       ASN  75 -21.885   6.949   2.692
  638    HB2  ASN  75           HB2      ASN  75 -23.652   8.486   4.546
  639    HB3  ASN  75           HB3      ASN  75 -23.858   8.688   2.809
  640   HD21  ASN  75          HD21      ASN  75 -23.939   6.390   5.451
  641   HD22  ASN  75          HD22      ASN  75 -24.889   5.200   4.616
  642    H    GLY  76           H        GLY  76 -20.637   7.910   1.250
  643    HA2  GLY  76           HA2      GLY  76 -20.631  10.005  -0.075
  644    HA3  GLY  76           HA3      GLY  76 -20.370  10.847   1.443
  645    H    ASP  77           H        ASP  77 -18.544   8.397   2.097
  646    HA   ASP  77           HA       ASP  77 -16.158   9.812   1.335
  647    HB2  ASP  77           HB2      ASP  77 -16.559   7.256   2.892
  648    HB3  ASP  77           HB3      ASP  77 -14.980   7.965   2.573
  649    H    THR  78           H        THR  78 -14.520   9.148   0.042
  650    HA   THR  78           HA       THR  78 -15.116   7.128  -1.953
  651    HB   THR  78           HB       THR  78 -12.582   8.754  -1.662
  652    HG1  THR  78           HG1      THR  78 -14.299  10.204  -1.783
  653   HG21  THR  78          HG21      THR  78 -13.893   7.445  -4.052
  654   HG22  THR  78          HG22      THR  78 -12.446   6.874  -3.221
  655   HG23  THR  78          HG23      THR  78 -12.415   8.409  -4.090
  656    H    MET  79           H        MET  79 -14.397   5.073  -1.829
  657    HA   MET  79           HA       MET  79 -12.198   4.509   0.027
  658    HB2  MET  79           HB2      MET  79 -14.615   3.887   0.815
  659    HB3  MET  79           HB3      MET  79 -14.460   2.567  -0.338
  660    HG2  MET  79           HG2      MET  79 -12.376   3.041   1.756
  661    HG3  MET  79           HG3      MET  79 -13.850   2.147   2.118
  662    HE1  MET  79           HE1      MET  79 -13.603  -1.010  -0.016
  663    HE2  MET  79           HE2      MET  79 -14.341  -0.255   1.402
  664    HE3  MET  79           HE3      MET  79 -14.582   0.445  -0.201
  665    H    GLU  80           H        GLU  80 -10.594   3.759  -1.079
  666    HA   GLU  80           HA       GLU  80 -11.014   3.010  -3.855
  667    HB2  GLU  80           HB2      GLU  80  -9.310   4.721  -3.054
  668    HB3  GLU  80           HB3      GLU  80  -8.403   3.378  -2.379
  669    HG2  GLU  80           HG2      GLU  80  -7.807   2.554  -4.435
  670    HG3  GLU  80           HG3      GLU  80  -9.156   3.335  -5.259
  671    H    TYR  81           H        TYR  81 -11.022   0.918  -4.536
  672    HA   TYR  81           HA       TYR  81  -9.805  -1.091  -2.807
  673    HB2  TYR  81           HB2      TYR  81 -12.119  -1.498  -3.666
  674    HB3  TYR  81           HB3      TYR  81 -11.485  -1.448  -5.307
  675    HD1  TYR  81           HD1      TYR  81 -11.533  -3.362  -2.167
  676    HD2  TYR  81           HD2      TYR  81 -10.313  -3.329  -6.238
  677    HE1  TYR  81           HE1      TYR  81 -11.053  -5.767  -2.033
  678    HE2  TYR  81           HE2      TYR  81  -9.830  -5.736  -6.117
  679    HH   TYR  81           HH       TYR  81  -9.235  -7.403  -4.264
  680    H    ARG  82           H        ARG  82  -7.700  -1.231  -3.180
  681    HA   ARG  82           HA       ARG  82  -6.769  -1.150  -5.951
  682    HB2  ARG  82           HB2      ARG  82  -4.904   0.383  -5.312
  683    HB3  ARG  82           HB3      ARG  82  -6.494   1.131  -5.284
  684    HG2  ARG  82           HG2      ARG  82  -6.563   0.877  -2.850
  685    HG3  ARG  82           HG3      ARG  82  -4.949   0.160  -2.890
  686    HD2  ARG  82           HD2      ARG  82  -5.650   2.930  -3.854
  687    HD3  ARG  82           HD3      ARG  82  -4.939   2.557  -2.286
  688    HE   ARG  82           HE       ARG  82  -3.126   1.481  -3.894
  689   HH11  ARG  82          HH11      ARG  82  -4.816   4.541  -4.192
  690   HH12  ARG  82          HH12      ARG  82  -3.457   5.358  -4.915
  691   HH21  ARG  82          HH21      ARG  82  -1.359   2.538  -4.864
  692   HH22  ARG  82          HH22      ARG  82  -1.495   4.218  -5.318
  693    H    LYS  83           H        LYS  83  -4.480  -1.802  -6.143
  694    HA   LYS  83           HA       LYS  83  -4.018  -4.212  -4.727
  695    HB2  LYS  83           HB2      LYS  83  -3.226  -3.613  -7.069
  696    HB3  LYS  83           HB3      LYS  83  -1.998  -2.612  -6.313
  697    HG2  LYS  83           HG2      LYS  83  -1.008  -4.547  -5.263
  698    HG3  LYS  83           HG3      LYS  83  -2.294  -5.581  -5.903
  699    HD2  LYS  83           HD2      LYS  83  -1.581  -4.947  -8.193
  700    HD3  LYS  83           HD3      LYS  83  -0.245  -4.036  -7.490
  701    HE2  LYS  83           HE2      LYS  83   0.617  -6.144  -8.166
  702    HE3  LYS  83           HE3      LYS  83   0.515  -6.161  -6.406
  703    HZ1  LYS  83           HZ1      LYS  83  -1.532  -7.335  -8.211
  704    HZ2  LYS  83           HZ2      LYS  83  -1.461  -7.477  -6.524
  705    HZ3  LYS  83           HZ3      LYS  83  -0.281  -8.222  -7.484
  706    H    LYS  84           H        LYS  84  -3.140  -4.467  -2.765
  707    HA   LYS  84           HA       LYS  84  -2.414  -2.290  -1.149
  708    HB2  LYS  84           HB2      LYS  84  -1.791  -5.225  -0.844
  709    HB3  LYS  84           HB3      LYS  84  -1.405  -4.019   0.374
  710    HG2  LYS  84           HG2      LYS  84  -3.906  -3.454   0.305
  711    HG3  LYS  84           HG3      LYS  84  -4.080  -5.013  -0.510
  712    HD2  LYS  84           HD2      LYS  84  -2.769  -6.015   1.405
  713    HD3  LYS  84           HD3      LYS  84  -2.953  -4.460   2.226
  714    HE2  LYS  84           HE2      LYS  84  -5.327  -4.676   2.258
  715    HE3  LYS  84           HE3      LYS  84  -5.271  -6.089   1.204
  716    HZ1  LYS  84           HZ1      LYS  84  -4.086  -5.996   3.927
  717    HZ2  LYS  84           HZ2      LYS  84  -4.245  -7.359   2.925
  718    HZ3  LYS  84           HZ3      LYS  84  -5.624  -6.621   3.574
  719    H    GLN  85           H        GLN  85  -0.625  -4.170  -3.429
  720    HA   GLN  85           HA       GLN  85   1.915  -3.213  -2.407
  721    HB2  GLN  85           HB2      GLN  85   1.880  -4.691  -4.940
  722    HB3  GLN  85           HB3      GLN  85   2.871  -4.939  -3.511
  723    HG2  GLN  85           HG2      GLN  85   0.747  -5.931  -2.473
  724    HG3  GLN  85           HG3      GLN  85   0.159  -6.022  -4.133
  725   HE21  GLN  85          HE21      GLN  85   2.322  -7.288  -1.788
  726   HE22  GLN  85          HE22      GLN  85   2.919  -8.608  -2.732
  727    H    ARG  86           H        ARG  86   3.192  -1.836  -3.563
  728    HA   ARG  86           HA       ARG  86   1.906  -0.509  -5.849
  729    HB2  ARG  86           HB2      ARG  86   3.344   1.499  -4.816
  730    HB3  ARG  86           HB3      ARG  86   1.690   1.160  -4.321
  731    HG2  ARG  86           HG2      ARG  86   2.695   1.350  -2.287
  732    HG3  ARG  86           HG3      ARG  86   2.864  -0.384  -2.557
  733    HD2  ARG  86           HD2      ARG  86   4.976   0.269  -1.826
  734    HD3  ARG  86           HD3      ARG  86   5.148   0.220  -3.583
  735    HE   ARG  86           HE       ARG  86   5.478   2.480  -3.581
  736   HH11  ARG  86          HH11      ARG  86   4.267   1.454  -0.493
  737   HH12  ARG  86          HH12      ARG  86   4.191   3.042   0.197
  738   HH21  ARG  86          HH21      ARG  86   5.458   4.638  -2.674
  739   HH22  ARG  86          HH22      ARG  86   4.908   4.849  -1.042
  740    HA   PRO  87           HA       PRO  87   5.470  -1.419  -8.177
  741    HB2  PRO  87           HB2      PRO  87   5.558   0.730  -9.865
  742    HB3  PRO  87           HB3      PRO  87   4.412  -0.605 -10.030
  743    HG2  PRO  87           HG2      PRO  87   4.011   2.097  -8.813
  744    HG3  PRO  87           HG3      PRO  87   2.923   1.167  -9.861
  745    HD2  PRO  87           HD2      PRO  87   2.581   1.301  -7.189
  746    HD3  PRO  87           HD3      PRO  87   2.175  -0.153  -8.123
  747    H    LEU  88           H        LEU  88   7.293  -1.348  -7.026
  748    HA   LEU  88           HA       LEU  88   8.363   1.270  -6.252
  749    HB2  LEU  88           HB2      LEU  88   8.715  -1.473  -5.103
  750    HB3  LEU  88           HB3      LEU  88   9.899  -0.216  -4.791
  751    HG   LEU  88           HG       LEU  88   6.961  -0.060  -4.104
  752   HD11  LEU  88          HD11      LEU  88   7.739  -0.165  -1.787
  753   HD12  LEU  88          HD12      LEU  88   8.145  -1.628  -2.682
  754   HD13  LEU  88          HD13      LEU  88   9.388  -0.420  -2.356
  755   HD21  LEU  88          HD21      LEU  88   7.605   1.988  -2.910
  756   HD22  LEU  88          HD22      LEU  88   9.237   1.839  -3.565
  757   HD23  LEU  88          HD23      LEU  88   7.875   2.118  -4.650
  758    H    LYS  89           H        LYS  89  10.042   2.050  -7.280
  759    HA   LYS  89           HA       LYS  89  11.579   0.322  -9.048
  760    HB2  LYS  89           HB2      LYS  89  11.286   3.281  -8.729
  761    HB3  LYS  89           HB3      LYS  89  12.770   2.660  -9.434
  762    HG2  LYS  89           HG2      LYS  89  11.229   3.252 -11.181
  763    HG3  LYS  89           HG3      LYS  89  11.446   1.502 -11.155
  764    HD2  LYS  89           HD2      LYS  89   9.123   1.942 -11.478
  765    HD3  LYS  89           HD3      LYS  89   9.327   1.349  -9.828
  766    HE2  LYS  89           HE2      LYS  89   9.238   3.635  -8.985
  767    HE3  LYS  89           HE3      LYS  89   9.076   4.246 -10.632
  768    HZ1  LYS  89           HZ1      LYS  89   7.133   2.498  -9.218
  769    HZ2  LYS  89           HZ2      LYS  89   6.984   3.018 -10.823
  770    HZ3  LYS  89           HZ3      LYS  89   6.933   4.143  -9.561
  771    H    ILE  90           H        ILE  90  13.208  -0.729  -8.194
  772    HA   ILE  90           HA       ILE  90  14.504   0.391  -5.792
  773    HB   ILE  90           HB       ILE  90  13.976  -2.533  -6.374
  774   HG12  ILE  90          HG12      ILE  90  11.924  -1.317  -5.752
  775   HG13  ILE  90          HG13      ILE  90  12.405  -2.460  -4.502
  776   HG21  ILE  90          HG21      ILE  90  14.792  -2.885  -4.061
  777   HG22  ILE  90          HG22      ILE  90  16.030  -2.274  -5.162
  778   HG23  ILE  90          HG23      ILE  90  15.261  -1.185  -4.006
  779   HD11  ILE  90          HD11      ILE  90  11.639  -0.375  -3.538
  780   HD12  ILE  90          HD12      ILE  90  13.352  -0.623  -3.200
  781   HD13  ILE  90          HD13      ILE  90  12.856   0.516  -4.452
  782    H    ARG  91           H        ARG  91  16.709   0.567  -5.906
  783    HA   ARG  91           HA       ARG  91  18.029  -0.807  -8.134
  784    HB2  ARG  91           HB2      ARG  91  18.308   1.548  -8.340
  785    HB3  ARG  91           HB3      ARG  91  18.705   1.731  -6.638
  786    HG2  ARG  91           HG2      ARG  91  20.792   0.460  -7.046
  787    HG3  ARG  91           HG3      ARG  91  20.381   0.406  -8.763
  788    HD2  ARG  91           HD2      ARG  91  20.718   2.940  -7.166
  789    HD3  ARG  91           HD3      ARG  91  21.980   2.215  -8.159
  790    HE   ARG  91           HE       ARG  91  20.220   2.490 -10.018
  791   HH11  ARG  91          HH11      ARG  91  20.669   4.702  -7.341
  792   HH12  ARG  91          HH12      ARG  91  20.137   6.092  -8.235
  793   HH21  ARG  91          HH21      ARG  91  19.564   4.315 -11.207
  794   HH22  ARG  91          HH22      ARG  91  19.543   5.879 -10.438
  795    H    MET  92           H        MET  92  19.293  -2.442  -7.645
  796    HA   MET  92           HA       MET  92  19.790  -3.148  -4.903
  797    HB2  MET  92           HB2      MET  92  19.922  -4.429  -7.546
  798    HB3  MET  92           HB3      MET  92  21.139  -4.986  -6.410
  799    HG2  MET  92           HG2      MET  92  18.941  -6.242  -6.544
  800    HG3  MET  92           HG3      MET  92  19.559  -5.840  -4.947
  801    HE1  MET  92           HE1      MET  92  17.698  -3.675  -7.644
  802    HE2  MET  92           HE2      MET  92  16.812  -5.198  -7.643
  803    HE3  MET  92           HE3      MET  92  16.041  -3.729  -7.041
  804    H    LEU  93           H        LEU  93  22.036  -4.180  -4.508
  805    HA   LEU  93           HA       LEU  93  23.744  -2.099  -3.959
  806    HB2  LEU  93           HB2      LEU  93  24.502  -5.007  -4.268
  807    HB3  LEU  93           HB3      LEU  93  25.463  -3.792  -3.458
  808    HG   LEU  93           HG       LEU  93  24.504  -4.926  -1.698
  809   HD11  LEU  93          HD11      LEU  93  22.801  -3.495  -0.697
  810   HD12  LEU  93          HD12      LEU  93  24.105  -2.555  -1.426
  811   HD13  LEU  93          HD13      LEU  93  22.554  -2.705  -2.254
  812   HD21  LEU  93          HD21      LEU  93  22.291  -5.809  -1.583
  813   HD22  LEU  93          HD22      LEU  93  21.826  -4.985  -3.070
  814   HD23  LEU  93          HD23      LEU  93  23.000  -6.299  -3.121
  815    H    ASP  94           H        ASP  94  23.898  -4.368  -6.669
  816    HA   ASP  94           HA       ASP  94  26.407  -3.337  -7.613
  817    HB2  ASP  94           HB2      ASP  94  26.268  -4.963  -9.324
  818    HB3  ASP  94           HB3      ASP  94  25.561  -5.720  -7.901
  819    H    GLY  95           H        GLY  95  23.324  -2.160  -7.735
  820    HA2  GLY  95           HA2      GLY  95  22.962   0.004  -8.670
  821    HA3  GLY  95           HA3      GLY  95  24.107  -0.385  -9.947
  822    H    THR  96           H        THR  96  22.141  -3.024  -9.449
  823    HA   THR  96           HA       THR  96  20.794  -2.503 -11.953
  824    HB   THR  96           HB       THR  96  20.736  -4.934 -10.153
  825    HG1  THR  96           HG1      THR  96  22.694  -5.005 -11.048
  826   HG21  THR  96          HG21      THR  96  18.703  -4.796 -11.512
  827   HG22  THR  96          HG22      THR  96  19.748  -6.103 -12.071
  828   HG23  THR  96          HG23      THR  96  19.682  -4.584 -12.963
  829    H    VAL  97           H        VAL  97  18.657  -2.060 -12.236
  830    HA   VAL  97           HA       VAL  97  17.129  -1.616  -9.782
  831    HB   VAL  97           HB       VAL  97  15.673  -0.299 -11.563
  832   HG11  VAL  97          HG11      VAL  97  16.843   1.749 -10.903
  833   HG12  VAL  97          HG12      VAL  97  16.626   0.658  -9.535
  834   HG13  VAL  97          HG13      VAL  97  18.198   0.778 -10.326
  835   HG21  VAL  97          HG21      VAL  97  17.075  -0.878 -13.463
  836   HG22  VAL  97          HG22      VAL  97  17.071   0.863 -13.176
  837   HG23  VAL  97          HG23      VAL  97  18.454  -0.110 -12.674
  838    H    LYS  98           H        LYS  98  15.199  -2.457  -9.516
  839    HA   LYS  98           HA       LYS  98  13.867  -3.791 -11.758
  840    HB2  LYS  98           HB2      LYS  98  13.407  -5.812 -10.639
  841    HB3  LYS  98           HB3      LYS  98  15.117  -5.523 -10.366
  842    HG2  LYS  98           HG2      LYS  98  14.781  -4.966  -8.121
  843    HG3  LYS  98           HG3      LYS  98  13.050  -4.714  -8.351
  844    HD2  LYS  98           HD2      LYS  98  14.377  -7.394  -8.720
  845    HD3  LYS  98           HD3      LYS  98  13.725  -6.870  -7.165
  846    HE2  LYS  98           HE2      LYS  98  12.027  -8.156  -8.141
  847    HE3  LYS  98           HE3      LYS  98  11.529  -6.483  -8.392
  848    HZ1  LYS  98           HZ1      LYS  98  12.282  -6.613 -10.669
  849    HZ2  LYS  98           HZ2      LYS  98  11.201  -7.877 -10.363
  850    HZ3  LYS  98           HZ3      LYS  98  12.866  -8.186 -10.437
  851    H    THR  99           H        THR  99  11.544  -4.052 -11.430
  852    HA   THR  99           HA       THR  99  10.528  -2.310  -9.290
  853    HB   THR  99           HB       THR  99   9.239  -2.931 -11.959
  854    HG1  THR  99           HG1      THR  99  11.146  -1.171 -11.309
  855   HG21  THR  99          HG21      THR  99   7.632  -1.201 -11.338
  856   HG22  THR  99          HG22      THR  99   8.452  -0.980  -9.792
  857   HG23  THR  99          HG23      THR  99   7.636  -2.502 -10.147
  858    H    ILE 100           H        ILE 100   9.506  -3.389  -7.736
  859    HA   ILE 100           HA       ILE 100   8.111  -5.867  -8.438
  860    HB   ILE 100           HB       ILE 100  10.287  -6.372  -7.352
  861   HG12  ILE 100          HG12      ILE 100   7.981  -7.634  -6.935
  862   HG13  ILE 100          HG13      ILE 100   9.469  -8.130  -6.142
  863   HG21  ILE 100          HG21      ILE 100  10.538  -4.392  -5.994
  864   HG22  ILE 100          HG22      ILE 100   9.163  -4.869  -4.999
  865   HG23  ILE 100          HG23      ILE 100  10.637  -5.836  -4.988
  866   HD11  ILE 100          HD11      ILE 100   7.317  -6.406  -4.934
  867   HD12  ILE 100          HD12      ILE 100   7.597  -8.114  -4.598
  868   HD13  ILE 100          HD13      ILE 100   8.804  -6.915  -4.134
  869    H    MET 101           H        MET 101   6.205  -6.233  -7.268
  870    HA   MET 101           HA       MET 101   5.037  -3.797  -6.213
  871    HB2  MET 101           HB2      MET 101   3.827  -6.548  -6.577
  872    HB3  MET 101           HB3      MET 101   2.943  -5.068  -6.237
  873    HG2  MET 101           HG2      MET 101   4.553  -5.595  -8.724
  874    HG3  MET 101           HG3      MET 101   2.802  -5.746  -8.589
  875    HE1  MET 101           HE1      MET 101   1.211  -3.679  -7.964
  876    HE2  MET 101           HE2      MET 101   2.245  -3.271  -6.594
  877    HE3  MET 101           HE3      MET 101   1.802  -2.028  -7.765
  878    H    VAL 102           H        VAL 102   5.415  -3.307  -4.220
  879    HA   VAL 102           HA       VAL 102   5.323  -5.424  -2.170
  880    HB   VAL 102           HB       VAL 102   6.637  -2.860  -1.503
  881   HG11  VAL 102          HG11      VAL 102   6.551  -4.528   0.168
  882   HG12  VAL 102          HG12      VAL 102   7.139  -5.768  -0.943
  883   HG13  VAL 102          HG13      VAL 102   8.218  -4.481  -0.411
  884   HG21  VAL 102          HG21      VAL 102   7.896  -4.852  -3.382
  885   HG22  VAL 102          HG22      VAL 102   7.544  -3.152  -3.706
  886   HG23  VAL 102          HG23      VAL 102   8.777  -3.589  -2.521
  887    H    ASP 103           H        ASP 103   4.045  -5.168  -0.462
  888    HA   ASP 103           HA       ASP 103   1.774  -3.553  -0.703
  889    HB2  ASP 103           HB2      ASP 103   2.680  -4.764   1.895
  890    HB3  ASP 103           HB3      ASP 103   1.036  -4.556   1.293
  891    H    ASP 104           H        ASP 104   1.274  -1.590  -0.023
  892    HA   ASP 104           HA       ASP 104   3.240   0.012   1.396
  893    HB2  ASP 104           HB2      ASP 104   2.069   1.004  -0.495
  894    HB3  ASP 104           HB3      ASP 104   0.514   0.664   0.247
  895    H    SER 105           H        SER 105   0.666  -1.996   2.112
  896    HA   SER 105           HA       SER 105  -0.324  -0.615   4.429
  897    HB2  SER 105           HB2      SER 105  -1.569  -2.836   4.713
  898    HB3  SER 105           HB3      SER 105  -1.909  -1.907   3.252
  899    HG   SER 105           HG       SER 105  -0.570  -4.331   3.565
  900    H    LYS 106           H        LYS 106   2.600  -1.654   4.227
  901    HA   LYS 106           HA       LYS 106   2.658  -2.664   6.941
  902    HB2  LYS 106           HB2      LYS 106   4.257  -4.524   6.234
  903    HB3  LYS 106           HB3      LYS 106   2.547  -4.766   5.927
  904    HG2  LYS 106           HG2      LYS 106   3.470  -5.494   3.966
  905    HG3  LYS 106           HG3      LYS 106   3.124  -3.814   3.572
  906    HD2  LYS 106           HD2      LYS 106   5.419  -3.203   3.937
  907    HD3  LYS 106           HD3      LYS 106   5.793  -4.824   4.536
  908    HE2  LYS 106           HE2      LYS 106   4.914  -4.114   1.739
  909    HE3  LYS 106           HE3      LYS 106   6.548  -4.546   2.234
  910    HZ1  LYS 106           HZ1      LYS 106   5.536  -6.722   3.004
  911    HZ2  LYS 106           HZ2      LYS 106   5.634  -6.486   1.333
  912    HZ3  LYS 106           HZ3      LYS 106   4.152  -6.288   2.122
  913    H    THR 107           H        THR 107   4.998  -2.983   7.677
  914    HA   THR 107           HA       THR 107   6.208  -0.418   7.344
  915    HB   THR 107           HB       THR 107   7.939  -1.484   8.950
  916    HG1  THR 107           HG1      THR 107   6.850  -3.308  10.092
  917   HG21  THR 107          HG21      THR 107   6.395  -1.189  10.861
  918   HG22  THR 107          HG22      THR 107   5.040  -1.137   9.733
  919   HG23  THR 107          HG23      THR 107   6.278   0.123   9.687
  920    H    VAL 108           H        VAL 108   8.802  -0.584   7.518
  921    HA   VAL 108           HA       VAL 108   9.593  -1.010   4.845
  922    HB   VAL 108           HB       VAL 108  11.403  -0.598   7.213
  923   HG11  VAL 108          HG11      VAL 108  12.879   0.468   5.578
  924   HG12  VAL 108          HG12      VAL 108  12.553  -1.216   5.171
  925   HG13  VAL 108          HG13      VAL 108  11.730   0.076   4.297
  926   HG21  VAL 108          HG21      VAL 108   9.970   1.481   5.566
  927   HG22  VAL 108          HG22      VAL 108   9.643   1.081   7.254
  928   HG23  VAL 108          HG23      VAL 108  11.186   1.805   6.801
  929    H    THR 109           H        THR 109  10.497  -2.629   7.850
  930    HA   THR 109           HA       THR 109  12.267  -4.504   7.082
  931    HB   THR 109           HB       THR 109   9.940  -5.078   8.915
  932    HG1  THR 109           HG1      THR 109  11.649  -4.278  10.480
  933   HG21  THR 109          HG21      THR 109  11.306  -7.047   8.398
  934   HG22  THR 109          HG22      THR 109  11.550  -6.536  10.069
  935   HG23  THR 109          HG23      THR 109  12.764  -6.161   8.847
  936    H    ASP 110           H        ASP 110   8.737  -5.132   7.030
  937    HA   ASP 110           HA       ASP 110   8.986  -7.648   5.774
  938    HB2  ASP 110           HB2      ASP 110   6.978  -6.873   7.052
  939    HB3  ASP 110           HB3      ASP 110   6.587  -5.805   5.708
  940    H    MET 111           H        MET 111   8.534  -4.398   4.538
  941    HA   MET 111           HA       MET 111   8.083  -5.028   1.838
  942    HB2  MET 111           HB2      MET 111   7.602  -2.827   2.595
  943    HB3  MET 111           HB3      MET 111   9.229  -2.604   3.212
  944    HG2  MET 111           HG2      MET 111  10.120  -2.425   1.005
  945    HG3  MET 111           HG3      MET 111   8.586  -2.905   0.305
  946    HE1  MET 111           HE1      MET 111   8.478   0.830   2.875
  947    HE2  MET 111           HE2      MET 111   8.048  -0.823   3.329
  948    HE3  MET 111           HE3      MET 111   9.738  -0.398   3.044
  949    H    LEU 112           H        LEU 112  11.085  -4.317   3.586
  950    HA   LEU 112           HA       LEU 112  12.815  -4.506   1.374
  951    HB2  LEU 112           HB2      LEU 112  13.193  -3.652   3.824
  952    HB3  LEU 112           HB3      LEU 112  13.667  -5.314   4.127
  953    HG   LEU 112           HG       LEU 112  15.346  -5.066   2.250
  954   HD11  LEU 112          HD11      LEU 112  14.611  -2.161   2.596
  955   HD12  LEU 112          HD12      LEU 112  15.987  -2.770   1.671
  956   HD13  LEU 112          HD13      LEU 112  14.341  -3.142   1.155
  957   HD21  LEU 112          HD21      LEU 112  16.917  -3.757   3.652
  958   HD22  LEU 112          HD22      LEU 112  15.570  -3.346   4.710
  959   HD23  LEU 112          HD23      LEU 112  16.069  -5.028   4.532
  960    H    MET 113           H        MET 113  11.809  -6.869   3.805
  961    HA   MET 113           HA       MET 113  13.258  -9.087   2.960
  962    HB2  MET 113           HB2      MET 113  11.933  -8.995   5.033
  963    HB3  MET 113           HB3      MET 113  10.453  -8.974   4.094
  964    HG2  MET 113           HG2      MET 113  12.347 -11.245   3.745
  965    HG3  MET 113           HG3      MET 113  11.323 -11.188   5.177
  966    HE1  MET 113           HE1      MET 113   8.693 -11.224   5.123
  967    HE2  MET 113           HE2      MET 113   8.704  -9.796   4.090
  968    HE3  MET 113           HE3      MET 113   7.737 -11.200   3.641
  969    H    THR 114           H        THR 114  10.158  -7.851   1.901
  970    HA   THR 114           HA       THR 114   9.465  -9.859   0.087
  971    HB   THR 114           HB       THR 114   8.789  -6.923   0.137
  972    HG1  THR 114           HG1      THR 114   8.077  -8.240   1.929
  973   HG21  THR 114          HG21      THR 114   8.424  -7.781  -2.116
  974   HG22  THR 114          HG22      THR 114   6.876  -7.507  -1.314
  975   HG23  THR 114          HG23      THR 114   7.512  -9.145  -1.466
  976    H    ILE 115           H        ILE 115  11.463  -6.953  -0.306
  977    HA   ILE 115           HA       ILE 115  11.555  -7.189  -3.174
  978    HB   ILE 115           HB       ILE 115  13.171  -5.420  -1.332
  979   HG12  ILE 115          HG12      ILE 115  10.703  -4.771  -2.960
  980   HG13  ILE 115          HG13      ILE 115  10.704  -5.067  -1.225
  981   HG21  ILE 115          HG21      ILE 115  13.594  -4.085  -3.349
  982   HG22  ILE 115          HG22      ILE 115  14.247  -5.717  -3.493
  983   HG23  ILE 115          HG23      ILE 115  12.745  -5.291  -4.317
  984   HD11  ILE 115          HD11      ILE 115  10.640  -2.695  -1.710
  985   HD12  ILE 115          HD12      ILE 115  12.146  -3.124  -0.898
  986   HD13  ILE 115          HD13      ILE 115  12.136  -2.829  -2.637
  987    H    CYS 116           H        CYS 116  13.855  -7.686  -0.497
  988    HA   CYS 116           HA       CYS 116  16.068  -8.273  -2.155
  989    HB2  CYS 116           HB2      CYS 116  17.165  -9.037  -0.143
  990    HB3  CYS 116           HB3      CYS 116  16.221  -7.604   0.246
  991    HG   CYS 116           HG       CYS 116  15.791 -10.800   1.260
  992    H    ALA 117           H        ALA 117  13.457 -10.190  -0.887
  993    HA   ALA 117           HA       ALA 117  14.510 -12.756  -1.385
  994    HB1  ALA 117           HB1      ALA 117  12.581 -12.359   0.066
  995    HB2  ALA 117           HB2      ALA 117  11.627 -11.876  -1.338
  996    HB3  ALA 117           HB3      ALA 117  12.213 -13.534  -1.197
  997    H    ARG 118           H        ARG 118  13.106 -10.362  -3.476
  998    HA   ARG 118           HA       ARG 118  12.374 -12.123  -5.594
  999    HB2  ARG 118           HB2      ARG 118  13.075  -9.178  -5.799
 1000    HB3  ARG 118           HB3      ARG 118  12.181 -10.136  -6.976
 1001    HG2  ARG 118           HG2      ARG 118  11.274  -9.415  -4.199
 1002    HG3  ARG 118           HG3      ARG 118  10.655  -8.771  -5.719
 1003    HD2  ARG 118           HD2      ARG 118  10.464 -11.634  -4.793
 1004    HD3  ARG 118           HD3      ARG 118   9.153 -10.457  -4.802
 1005    HE   ARG 118           HE       ARG 118  10.200 -10.669  -7.405
 1006   HH11  ARG 118          HH11      ARG 118   8.316 -12.513  -5.095
 1007   HH12  ARG 118          HH12      ARG 118   7.513 -13.461  -6.308
 1008   HH21  ARG 118          HH21      ARG 118   9.135 -11.898  -9.006
 1009   HH22  ARG 118          HH22      ARG 118   8.003 -13.130  -8.536
 1010    H    ILE 119           H        ILE 119  15.298 -10.384  -4.726
 1011    HA   ILE 119           HA       ILE 119  16.681 -11.065  -7.157
 1012    HB   ILE 119           HB       ILE 119  18.107 -10.295  -4.638
 1013   HG12  ILE 119          HG12      ILE 119  16.143  -8.806  -4.751
 1014   HG13  ILE 119          HG13      ILE 119  17.646  -7.933  -5.024
 1015   HG21  ILE 119          HG21      ILE 119  19.401 -10.778  -6.637
 1016   HG22  ILE 119          HG22      ILE 119  18.480  -9.575  -7.541
 1017   HG23  ILE 119          HG23      ILE 119  19.529  -9.069  -6.216
 1018   HD11  ILE 119          HD11      ILE 119  15.931  -7.163  -6.533
 1019   HD12  ILE 119          HD12      ILE 119  17.209  -7.977  -7.436
 1020   HD13  ILE 119          HD13      ILE 119  15.682  -8.804  -7.128
 1021    H    GLY 120           H        GLY 120  16.519 -12.202  -3.837
 1022    HA2  GLY 120           HA2      GLY 120  16.791 -14.662  -3.568
 1023    HA3  GLY 120           HA3      GLY 120  18.207 -14.500  -4.597
 1024    H    ILE 121           H        ILE 121  17.294 -12.226  -2.106
 1025    HA   ILE 121           HA       ILE 121  19.748 -12.930  -0.636
 1026    HB   ILE 121           HB       ILE 121  18.249 -10.321  -0.451
 1027   HG12  ILE 121          HG12      ILE 121  20.655 -10.888  -2.196
 1028   HG13  ILE 121          HG13      ILE 121  19.007 -10.742  -2.799
 1029   HG21  ILE 121          HG21      ILE 121  19.752 -10.819   1.388
 1030   HG22  ILE 121          HG22      ILE 121  21.071 -11.096   0.252
 1031   HG23  ILE 121          HG23      ILE 121  20.377  -9.484   0.420
 1032   HD11  ILE 121          HD11      ILE 121  18.928  -8.428  -2.022
 1033   HD12  ILE 121          HD12      ILE 121  20.578  -8.576  -1.416
 1034   HD13  ILE 121          HD13      ILE 121  20.261  -8.692  -3.147
 1035    H    THR 122           H        THR 122  19.324 -14.066   1.181
 1036    HA   THR 122           HA       THR 122  16.635 -13.990   2.272
 1037    HB   THR 122           HB       THR 122  17.849 -16.159   1.932
 1038    HG1  THR 122           HG1      THR 122  16.075 -15.837   3.466
 1039   HG21  THR 122          HG21      THR 122  19.450 -15.252   4.328
 1040   HG22  THR 122          HG22      THR 122  20.073 -15.485   2.695
 1041   HG23  THR 122          HG23      THR 122  19.480 -16.866   3.618
 1042    H    ASN 123           H        ASN 123  19.867 -12.938   3.156
 1043    HA   ASN 123           HA       ASN 123  18.994 -12.009   5.749
 1044    HB2  ASN 123           HB2      ASN 123  21.249 -10.897   5.837
 1045    HB3  ASN 123           HB3      ASN 123  21.312 -12.638   5.637
 1046   HD21  ASN 123          HD21      ASN 123  23.227 -10.468   5.003
 1047   HD22  ASN 123          HD22      ASN 123  23.609 -10.684   3.321
 1048    H    HIS 124           H        HIS 124  17.891 -10.201   6.043
 1049    HA   HIS 124           HA       HIS 124  18.171  -8.086   4.018
 1050    HB2  HIS 124           HB2      HIS 124  15.760  -7.682   4.047
 1051    HB3  HIS 124           HB3      HIS 124  16.123  -9.318   3.511
 1052    HD1  HIS 124           HD1      HIS 124  14.343  -7.403   6.118
 1053    HD2  HIS 124           HD2      HIS 124  15.428 -11.354   5.404
 1054    HE1  HIS 124           HE1      HIS 124  12.920  -8.782   7.652
 1055    HE2  HIS 124           HE2      HIS 124  13.756 -11.148   7.371
 1056    H    ASP 125           H        ASP 125  18.405  -8.883   7.204
 1057    HA   ASP 125           HA       ASP 125  17.298  -6.518   8.377
 1058    HB2  ASP 125           HB2      ASP 125  18.286  -7.315  10.443
 1059    HB3  ASP 125           HB3      ASP 125  17.544  -8.677   9.609
 1060    H    GLU 126           H        GLU 126  20.189  -7.401   6.797
 1061    HA   GLU 126           HA       GLU 126  21.891  -5.491   8.112
 1062    HB2  GLU 126           HB2      GLU 126  22.362  -7.148   5.635
 1063    HB3  GLU 126           HB3      GLU 126  23.587  -6.227   6.499
 1064    HG2  GLU 126           HG2      GLU 126  23.161  -7.625   8.493
 1065    HG3  GLU 126           HG3      GLU 126  22.041  -8.587   7.537
 1066    H    TYR 127           H        TYR 127  19.530  -5.228   5.805
 1067    HA   TYR 127           HA       TYR 127  20.906  -3.022   4.433
 1068    HB2  TYR 127           HB2      TYR 127  18.436  -4.521   3.553
 1069    HB3  TYR 127           HB3      TYR 127  19.284  -3.278   2.638
 1070    HD1  TYR 127           HD1      TYR 127  21.755  -3.772   2.060
 1071    HD2  TYR 127           HD2      TYR 127  18.965  -6.728   3.258
 1072    HE1  TYR 127           HE1      TYR 127  23.169  -5.497   1.051
 1073    HE2  TYR 127           HE2      TYR 127  20.360  -8.471   2.265
 1074    HH   TYR 127           HH       TYR 127  22.096  -8.675   0.522
 1075    H    SER 128           H        SER 128  19.939  -1.045   4.233
 1076    HA   SER 128           HA       SER 128  17.399  -0.668   5.667
 1077    HB2  SER 128           HB2      SER 128  19.653   1.342   5.377
 1078    HB3  SER 128           HB3      SER 128  18.144   1.582   6.259
 1079    HG   SER 128           HG       SER 128  19.368  -0.661   7.098
 1080    H    LEU 129           H        LEU 129  15.856   0.533   4.596
 1081    HA   LEU 129           HA       LEU 129  16.232   0.676   1.737
 1082    HB2  LEU 129           HB2      LEU 129  14.098   0.040   3.240
 1083    HB3  LEU 129           HB3      LEU 129  13.782   1.753   3.042
 1084    HG   LEU 129           HG       LEU 129  14.153  -0.210   0.767
 1085   HD11  LEU 129          HD11      LEU 129  11.636   1.005   1.892
 1086   HD12  LEU 129          HD12      LEU 129  11.743   0.011   0.438
 1087   HD13  LEU 129          HD13      LEU 129  12.123  -0.685   2.013
 1088   HD21  LEU 129          HD21      LEU 129  13.254   2.669   0.777
 1089   HD22  LEU 129          HD22      LEU 129  14.774   2.046   0.133
 1090   HD23  LEU 129          HD23      LEU 129  13.245   1.597  -0.623
 1091    H    VAL 130           H        VAL 130  16.494   2.536   0.568
 1092    HA   VAL 130           HA       VAL 130  16.295   5.071   2.019
 1093    HB   VAL 130           HB       VAL 130  18.583   4.917   2.167
 1094   HG11  VAL 130          HG11      VAL 130  18.593   3.508  -0.481
 1095   HG12  VAL 130          HG12      VAL 130  20.033   3.918   0.451
 1096   HG13  VAL 130          HG13      VAL 130  18.848   2.792   1.110
 1097   HG21  VAL 130          HG21      VAL 130  19.656   6.256   0.413
 1098   HG22  VAL 130          HG22      VAL 130  18.220   6.074  -0.593
 1099   HG23  VAL 130          HG23      VAL 130  18.120   6.955   0.933
 1100    H    ARG 131           H        ARG 131  14.947   6.319   1.006
 1101    HA   ARG 131           HA       ARG 131  14.338   5.742  -1.811
 1102    HB2  ARG 131           HB2      ARG 131  12.707   7.393   0.109
 1103    HB3  ARG 131           HB3      ARG 131  12.185   6.662  -1.403
 1104    HG2  ARG 131           HG2      ARG 131  12.374   4.451  -0.414
 1105    HG3  ARG 131           HG3      ARG 131  12.945   5.169   1.099
 1106    HD2  ARG 131           HD2      ARG 131  10.617   4.716   1.351
 1107    HD3  ARG 131           HD3      ARG 131  10.820   6.468   1.189
 1108    HE   ARG 131           HE       ARG 131  10.079   6.236  -1.127
 1109   HH11  ARG 131          HH11      ARG 131   9.398   3.600   1.067
 1110   HH12  ARG 131          HH12      ARG 131   8.067   2.992   0.142
 1111   HH21  ARG 131          HH21      ARG 131   8.311   5.457  -2.360
 1112   HH22  ARG 131          HH22      ARG 131   7.446   4.058  -1.815
 1113    H    GLU 132           H        GLU 132  15.755   7.038  -2.949
 1114    HA   GLU 132           HA       GLU 132  16.047   9.807  -2.343
 1115    HB2  GLU 132           HB2      GLU 132  16.648   8.239  -4.866
 1116    HB3  GLU 132           HB3      GLU 132  17.031   9.941  -4.662
 1117    HG2  GLU 132           HG2      GLU 132  18.448   9.314  -2.713
 1118    HG3  GLU 132           HG3      GLU 132  18.158   7.622  -3.118
 1119    H    LEU 133           H        LEU 133  14.207  10.980  -2.312
 1120    HA   LEU 133           HA       LEU 133  12.271  10.473  -4.456
 1121    HB2  LEU 133           HB2      LEU 133  11.753  11.973  -1.903
 1122    HB3  LEU 133           HB3      LEU 133  10.572  11.384  -3.048
 1123    HG   LEU 133           HG       LEU 133  12.285   9.700  -1.224
 1124   HD11  LEU 133          HD11      LEU 133  10.447  10.821  -0.091
 1125   HD12  LEU 133          HD12      LEU 133   9.313  10.212  -1.297
 1126   HD13  LEU 133          HD13      LEU 133  10.137   9.087  -0.215
 1127   HD21  LEU 133          HD21      LEU 133  11.033   7.794  -2.101
 1128   HD22  LEU 133          HD22      LEU 133  10.224   8.853  -3.257
 1129   HD23  LEU 133          HD23      LEU 133  11.965   8.590  -3.370
 1130    H    MET 134           H        MET 134  10.789  12.556  -4.568
 1131    HA   MET 134           HA       MET 134  12.498  14.710  -5.572
 1132    HB2  MET 134           HB2      MET 134  10.322  15.446  -6.660
 1133    HB3  MET 134           HB3      MET 134  10.963  13.904  -7.214
 1134    HG2  MET 134           HG2      MET 134   8.661  13.558  -6.950
 1135    HG3  MET 134           HG3      MET 134   9.415  12.806  -5.547
 1136    HE1  MET 134           HE1      MET 134   6.356  13.274  -5.512
 1137    HE2  MET 134           HE2      MET 134   7.246  12.698  -4.102
 1138    HE3  MET 134           HE3      MET 134   6.108  14.035  -3.941
 1139    H    GLU 135           H        GLU 135  11.315  13.925  -2.808
 1140    HA   GLU 135           HA       GLU 135   9.415  15.524  -1.790
 1141    HB2  GLU 135           HB2      GLU 135  11.730  14.117  -0.737
 1142    HB3  GLU 135           HB3      GLU 135  11.285  15.517   0.229
 1143    HG2  GLU 135           HG2      GLU 135   9.325  13.408  -0.588
 1144    HG3  GLU 135           HG3      GLU 135  10.239  13.368   0.923
 1145    H    GLU 136           H        GLU 136   9.076  17.606  -1.886
 1146    HA   GLU 136           HA       GLU 136  11.255  19.500  -2.032
 1147    HB2  GLU 136           HB2      GLU 136   9.529  21.137  -2.443
 1148    HB3  GLU 136           HB3      GLU 136   9.204  19.704  -3.412
 1149    HG2  GLU 136           HG2      GLU 136   7.518  18.982  -1.832
 1150    HG3  GLU 136           HG3      GLU 136   7.857  20.377  -0.808
 1151    H    LYS 137           H        LYS 137   9.392  18.040   0.404
 1152    HA   LYS 137           HA       LYS 137   9.494  20.372   2.166
 1153    HB2  LYS 137           HB2      LYS 137   8.262  17.663   2.698
 1154    HB3  LYS 137           HB3      LYS 137   8.032  19.129   3.641
 1155    HG2  LYS 137           HG2      LYS 137   6.956  20.165   1.653
 1156    HG3  LYS 137           HG3      LYS 137   7.066  18.600   0.842
 1157    HD2  LYS 137           HD2      LYS 137   5.757  17.604   2.698
 1158    HD3  LYS 137           HD3      LYS 137   5.567  19.218   3.384
 1159    HE2  LYS 137           HE2      LYS 137   4.526  19.906   1.199
 1160    HE3  LYS 137           HE3      LYS 137   4.527  18.201   0.747
 1161    HZ1  LYS 137           HZ1      LYS 137   2.401  18.822   1.661
 1162    HZ2  LYS 137           HZ2      LYS 137   3.130  19.400   3.078
 1163    HZ3  LYS 137           HZ3      LYS 137   3.170  17.742   2.723
 1164    H    LYS 138           H        LYS 138  10.303  16.920   2.269
 1165    HA   LYS 138           HA       LYS 138  12.098  17.294   4.507
 1166    HB2  LYS 138           HB2      LYS 138  11.651  14.894   2.721
 1167    HB3  LYS 138           HB3      LYS 138  12.585  14.894   4.210
 1168    HG2  LYS 138           HG2      LYS 138  10.560  15.478   5.462
 1169    HG3  LYS 138           HG3      LYS 138   9.647  15.437   3.950
 1170    HD2  LYS 138           HD2      LYS 138  11.268  13.056   4.638
 1171    HD3  LYS 138           HD3      LYS 138   9.793  13.330   5.572
 1172    HE2  LYS 138           HE2      LYS 138   9.957  13.198   2.564
 1173    HE3  LYS 138           HE3      LYS 138   9.444  11.872   3.608
 1174    HZ1  LYS 138           HZ1      LYS 138   7.739  13.555   2.503
 1175    HZ2  LYS 138           HZ2      LYS 138   8.050  14.418   3.931
 1176    HZ3  LYS 138           HZ3      LYS 138   7.455  12.834   4.010
 1177    H    ASP 169           H        ASP 169  12.369  16.373   1.139
 1178    HA   ASP 169           HA       ASP 169  14.066  16.099  -0.284
 1179    HB2  ASP 169           HB2      ASP 169  14.115  18.554  -0.199
 1180    HB3  ASP 169           HB3      ASP 169  15.196  18.495   1.189
 1181    H    GLU 170           H        GLU 170  14.510  14.106   0.650
 1182    HA   GLU 170           HA       GLU 170  17.144  13.963   1.871
 1183    HB2  GLU 170           HB2      GLU 170  14.666  12.753   3.102
 1184    HB3  GLU 170           HB3      GLU 170  16.302  12.311   3.560
 1185    HG2  GLU 170           HG2      GLU 170  16.712  14.628   4.262
 1186    HG3  GLU 170           HG3      GLU 170  15.044  15.028   3.849
 1187    H    LEU 171           H        LEU 171  17.924  11.752   2.037
 1188    HA   LEU 171           HA       LEU 171  17.340  10.167  -0.280
 1189    HB2  LEU 171           HB2      LEU 171  18.971   9.373   2.129
 1190    HB3  LEU 171           HB3      LEU 171  19.065   8.703   0.510
 1191    HG   LEU 171           HG       LEU 171  19.933  11.443   1.387
 1192   HD11  LEU 171          HD11      LEU 171  22.151  10.665   0.717
 1193   HD12  LEU 171          HD12      LEU 171  21.472   9.657   1.993
 1194   HD13  LEU 171          HD13      LEU 171  21.479   9.083   0.325
 1195   HD21  LEU 171          HD21      LEU 171  18.913  11.562  -0.809
 1196   HD22  LEU 171          HD22      LEU 171  20.664  11.748  -0.934
 1197   HD23  LEU 171          HD23      LEU 171  19.911  10.210  -1.361
 1198    H    ASN 172           H        ASN 172  15.942  10.548   2.712
 1199    HA   ASN 172           HA       ASN 172  14.465   9.381   3.975
 1200    HB2  ASN 172           HB2      ASN 172  13.802   8.416   1.200
 1201    HB3  ASN 172           HB3      ASN 172  12.865   7.930   2.598
 1202   HD21  ASN 172          HD21      ASN 172  13.556  10.377   0.356
 1203   HD22  ASN 172          HD22      ASN 172  12.406  11.547   0.911
 1204    H    TRP 173           H        TRP 173  16.237   8.223   5.053
 1205    HA   TRP 173           HA       TRP 173  16.811   5.556   4.049
 1206    HB2  TRP 173           HB2      TRP 173  18.014   7.384   6.089
 1207    HB3  TRP 173           HB3      TRP 173  18.261   5.649   6.267
 1208    HD1  TRP 173           HD1      TRP 173  19.094   8.576   3.917
 1209    HE1  TRP 173           HE1      TRP 173  21.138   7.927   2.512
 1210    HE3  TRP 173           HE3      TRP 173  19.555   3.694   5.362
 1211    HZ2  TRP 173           HZ2      TRP 173  22.743   5.644   2.064
 1212    HZ3  TRP 173           HZ3      TRP 173  21.374   2.348   4.400
 1213    HH2  TRP 173           HH2      TRP 173  22.935   3.304   2.785
 1214    H    LEU 174           H        LEU 174  14.942   4.458   4.419
 1215    HA   LEU 174           HA       LEU 174  13.301   4.748   6.694
 1216    HB2  LEU 174           HB2      LEU 174  13.510   2.323   4.922
 1217    HB3  LEU 174           HB3      LEU 174  12.162   2.768   5.944
 1218    HG   LEU 174           HG       LEU 174  13.009   3.981   3.335
 1219   HD11  LEU 174          HD11      LEU 174  10.534   3.578   2.930
 1220   HD12  LEU 174          HD12      LEU 174  11.559   2.148   3.085
 1221   HD13  LEU 174          HD13      LEU 174  10.552   2.655   4.440
 1222   HD21  LEU 174          HD21      LEU 174  12.618   5.873   4.793
 1223   HD22  LEU 174          HD22      LEU 174  11.258   5.694   3.683
 1224   HD23  LEU 174          HD23      LEU 174  11.106   5.162   5.359
 1225    H    ASP 175           H        ASP 175  13.651   4.109   8.666
 1226    HA   ASP 175           HA       ASP 175  15.930   2.382   9.183
 1227    HB2  ASP 175           HB2      ASP 175  15.647   4.674  10.248
 1228    HB3  ASP 175           HB3      ASP 175  14.367   3.952  11.221
 1229    H    HIS 176           H        HIS 176  13.104   1.543   8.429
 1230    HA   HIS 176           HA       HIS 176  11.830  -0.315   8.778
 1231    HB2  HIS 176           HB2      HIS 176  14.080  -1.094  10.647
 1232    HB3  HIS 176           HB3      HIS 176  12.785  -2.167  10.128
 1233    HD1  HIS 176           HD1      HIS 176  12.823  -2.930   7.634
 1234    HD2  HIS 176           HD2      HIS 176  16.150  -0.774   8.847
 1235    HE1  HIS 176           HE1      HIS 176  14.502  -3.205   5.795
 1236    HE2  HIS 176           HE2      HIS 176  16.613  -2.187   6.731
 1237    H    GLY 177           H        GLY 177  11.023   1.912  10.127
 1238    HA2  GLY 177           HA2      GLY 177   9.869   0.707  12.536
 1239    HA3  GLY 177           HA3      GLY 177  10.812   2.172  12.751
 1240    H    ARG 178           H        ARG 178   9.921   3.340  10.212
 1241    HA   ARG 178           HA       ARG 178   7.378   4.310  11.278
 1242    HB2  ARG 178           HB2      ARG 178   9.015   6.027  10.920
 1243    HB3  ARG 178           HB3      ARG 178   9.290   5.493   9.266
 1244    HG2  ARG 178           HG2      ARG 178   7.312   6.381   8.504
 1245    HG3  ARG 178           HG3      ARG 178   6.566   6.366  10.103
 1246    HD2  ARG 178           HD2      ARG 178   7.040   8.627   9.498
 1247    HD3  ARG 178           HD3      ARG 178   8.126   8.152  10.797
 1248    HE   ARG 178           HE       ARG 178   9.469   7.700   8.403
 1249   HH11  ARG 178          HH11      ARG 178   8.166  10.375  10.253
 1250   HH12  ARG 178          HH12      ARG 178   9.260  11.548   9.574
 1251   HH21  ARG 178          HH21      ARG 178  10.917   9.241   7.512
 1252   HH22  ARG 178          HH22      ARG 178  10.833  10.900   8.024
 1253    H    THR 179           H        THR 179   5.490   4.276  10.225
 1254    HA   THR 179           HA       THR 179   5.148   2.476   8.034
 1255    HB   THR 179           HB       THR 179   3.356   2.613   9.595
 1256    HG1  THR 179           HG1      THR 179   2.616   2.289   7.485
 1257   HG21  THR 179          HG21      THR 179   2.047   4.637   9.986
 1258   HG22  THR 179          HG22      THR 179   3.127   5.542   8.926
 1259   HG23  THR 179          HG23      THR 179   3.734   4.873  10.441
 1260    H    LEU 180           H        LEU 180   4.338   2.956   5.982
 1261    HA   LEU 180           HA       LEU 180   5.895   4.956   4.728
 1262    HB2  LEU 180           HB2      LEU 180   3.681   3.343   3.487
 1263    HB3  LEU 180           HB3      LEU 180   5.113   3.996   2.704
 1264    HG   LEU 180           HG       LEU 180   5.161   1.847   4.822
 1265   HD11  LEU 180          HD11      LEU 180   4.100   0.949   2.892
 1266   HD12  LEU 180          HD12      LEU 180   5.334   1.633   1.830
 1267   HD13  LEU 180          HD13      LEU 180   5.757   0.341   2.956
 1268   HD21  LEU 180          HD21      LEU 180   7.189   3.201   4.716
 1269   HD22  LEU 180          HD22      LEU 180   7.476   1.552   4.157
 1270   HD23  LEU 180          HD23      LEU 180   7.322   2.865   2.989
 1271    H    ARG 181           H        ARG 181   2.511   4.724   5.594
 1272    HA   ARG 181           HA       ARG 181   1.664   6.969   4.052
 1273    HB2  ARG 181           HB2      ARG 181   0.429   5.383   6.283
 1274    HB3  ARG 181           HB3      ARG 181  -0.355   6.831   5.656
 1275    HG2  ARG 181           HG2      ARG 181   0.400   4.396   4.052
 1276    HG3  ARG 181           HG3      ARG 181  -1.223   4.796   4.626
 1277    HD2  ARG 181           HD2      ARG 181  -1.534   6.373   3.042
 1278    HD3  ARG 181           HD3      ARG 181   0.143   6.916   3.109
 1279    HE   ARG 181           HE       ARG 181  -0.131   4.323   1.927
 1280   HH11  ARG 181          HH11      ARG 181  -0.387   7.763   1.269
 1281   HH12  ARG 181          HH12      ARG 181   0.025   7.593  -0.412
 1282   HH21  ARG 181          HH21      ARG 181   0.396   4.113  -0.262
 1283   HH22  ARG 181          HH22      ARG 181   0.461   5.518  -1.284
 1284    H    GLU 182           H        GLU 182   3.460   6.691   6.872
 1285    HA   GLU 182           HA       GLU 182   2.687   9.360   7.823
 1286    HB2  GLU 182           HB2      GLU 182   2.795   7.462   9.442
 1287    HB3  GLU 182           HB3      GLU 182   4.510   7.308   9.103
 1288    HG2  GLU 182           HG2      GLU 182   4.126   8.477  11.174
 1289    HG3  GLU 182           HG3      GLU 182   4.900   9.537   9.993
 1290    H    GLN 183           H        GLN 183   4.883   7.875   5.806
 1291    HA   GLN 183           HA       GLN 183   7.118   9.646   6.340
 1292    HB2  GLN 183           HB2      GLN 183   6.726   7.834   3.959
 1293    HB3  GLN 183           HB3      GLN 183   8.237   8.517   4.546
 1294    HG2  GLN 183           HG2      GLN 183   8.169   7.136   6.499
 1295    HG3  GLN 183           HG3      GLN 183   6.558   6.551   6.079
 1296   HE21  GLN 183          HE21      GLN 183   8.893   4.977   6.534
 1297   HE22  GLN 183          HE22      GLN 183   9.221   4.134   5.062
 1298    H    GLY 184           H        GLY 184   4.525   9.241   3.999
 1299    HA2  GLY 184           HA2      GLY 184   3.565  10.906   2.661
 1300    HA3  GLY 184           HA3      GLY 184   4.898  11.977   3.075
 1301    H    VAL 185           H        VAL 185   5.476   8.730   1.995
 1302    HA   VAL 185           HA       VAL 185   6.943   9.746  -0.283
 1303    HB   VAL 185           HB       VAL 185   7.740   7.475  -0.582
 1304   HG11  VAL 185          HG11      VAL 185   7.759   8.305   2.316
 1305   HG12  VAL 185          HG12      VAL 185   8.876   7.162   1.568
 1306   HG13  VAL 185          HG13      VAL 185   8.876   8.852   1.065
 1307   HG21  VAL 185          HG21      VAL 185   7.040   5.670   0.937
 1308   HG22  VAL 185          HG22      VAL 185   5.817   6.741   1.622
 1309   HG23  VAL 185          HG23      VAL 185   5.714   6.251  -0.070
 1310    H    GLU 186           H        GLU 186   6.769   8.501  -2.361
 1311    HA   GLU 186           HA       GLU 186   3.964   7.910  -3.016
 1312    HB2  GLU 186           HB2      GLU 186   4.712   8.909  -5.330
 1313    HB3  GLU 186           HB3      GLU 186   4.237   9.979  -4.023
 1314    HG2  GLU 186           HG2      GLU 186   6.284  10.672  -5.262
 1315    HG3  GLU 186           HG3      GLU 186   6.493  10.507  -3.518
 1316    H    GLU 187           H        GLU 187   4.406   7.076  -5.689
 1317    HA   GLU 187           HA       GLU 187   6.151   4.740  -5.241
 1318    HB2  GLU 187           HB2      GLU 187   3.606   4.715  -6.856
 1319    HB3  GLU 187           HB3      GLU 187   4.588   3.337  -6.393
 1320    HG2  GLU 187           HG2      GLU 187   2.801   3.192  -4.955
 1321    HG3  GLU 187           HG3      GLU 187   4.002   4.030  -3.977
 1322    H    HIS 188           H        HIS 188   6.976   7.183  -6.651
 1323    HA   HIS 188           HA       HIS 188   7.411   5.926  -9.269
 1324    HB2  HIS 188           HB2      HIS 188   7.107   8.168 -10.383
 1325    HB3  HIS 188           HB3      HIS 188   5.646   7.385  -9.800
 1326    HD1  HIS 188           HD1      HIS 188   4.179   8.713  -8.305
 1327    HD2  HIS 188           HD2      HIS 188   7.971  10.378  -8.696
 1328    HE1  HIS 188           HE1      HIS 188   4.060  10.951  -7.160
 1329    HE2  HIS 188           HE2      HIS 188   6.275  12.045  -7.674
 1330    H    GLU 189           H        GLU 189   8.839   7.402  -6.636
 1331    HA   GLU 189           HA       GLU 189  11.132   8.307  -8.207
 1332    HB2  GLU 189           HB2      GLU 189  10.521   8.471  -5.260
 1333    HB3  GLU 189           HB3      GLU 189  12.044   8.995  -5.969
 1334    HG2  GLU 189           HG2      GLU 189   9.306  10.102  -6.535
 1335    HG3  GLU 189           HG3      GLU 189  10.618  10.896  -5.664
 1336    H    THR 190           H        THR 190  13.319   7.587  -7.600
 1337    HA   THR 190           HA       THR 190  13.367   4.730  -7.544
 1338    HB   THR 190           HB       THR 190  15.721   6.627  -7.468
 1339    HG1  THR 190           HG1      THR 190  13.905   6.061  -9.447
 1340   HG21  THR 190          HG21      THR 190  16.303   4.311  -6.926
 1341   HG22  THR 190          HG22      THR 190  16.924   4.749  -8.518
 1342   HG23  THR 190          HG23      THR 190  15.476   3.752  -8.380
 1343    H    LEU 191           H        LEU 191  13.622   3.436  -5.891
 1344    HA   LEU 191           HA       LEU 191  14.615   4.550  -3.345
 1345    HB2  LEU 191           HB2      LEU 191  13.092   1.959  -3.584
 1346    HB3  LEU 191           HB3      LEU 191  13.348   2.939  -2.159
 1347    HG   LEU 191           HG       LEU 191  11.104   3.250  -2.596
 1348   HD11  LEU 191          HD11      LEU 191  12.147   5.412  -2.347
 1349   HD12  LEU 191          HD12      LEU 191  12.429   5.500  -4.085
 1350   HD13  LEU 191          HD13      LEU 191  10.781   5.509  -3.458
 1351   HD21  LEU 191          HD21      LEU 191  11.728   3.462  -5.532
 1352   HD22  LEU 191          HD22      LEU 191  11.011   2.076  -4.712
 1353   HD23  LEU 191          HD23      LEU 191  10.127   3.599  -4.805
 1354    H    LEU 192           H        LEU 192  16.454   3.563  -2.455
 1355    HA   LEU 192           HA       LEU 192  17.700   1.594  -4.251
 1356    HB2  LEU 192           HB2      LEU 192  19.227   3.184  -2.238
 1357    HB3  LEU 192           HB3      LEU 192  19.761   2.538  -3.776
 1358    HG   LEU 192           HG       LEU 192  17.862   4.865  -3.524
 1359   HD11  LEU 192          HD11      LEU 192  19.773   6.282  -4.006
 1360   HD12  LEU 192          HD12      LEU 192  20.010   5.399  -2.498
 1361   HD13  LEU 192          HD13      LEU 192  20.840   4.877  -3.964
 1362   HD21  LEU 192          HD21      LEU 192  18.451   5.262  -5.849
 1363   HD22  LEU 192          HD22      LEU 192  19.511   3.852  -5.836
 1364   HD23  LEU 192          HD23      LEU 192  17.770   3.647  -5.648
 1365    H    LEU 193           H        LEU 193  18.343  -0.350  -3.422
 1366    HA   LEU 193           HA       LEU 193  18.026  -0.823  -0.586
 1367    HB2  LEU 193           HB2      LEU 193  17.367  -2.481  -2.356
 1368    HB3  LEU 193           HB3      LEU 193  19.065  -2.677  -2.736
 1369    HG   LEU 193           HG       LEU 193  18.140  -3.178   0.066
 1370   HD11  LEU 193          HD11      LEU 193  17.940  -5.143  -2.209
 1371   HD12  LEU 193          HD12      LEU 193  17.667  -5.491  -0.502
 1372   HD13  LEU 193          HD13      LEU 193  16.577  -4.406  -1.364
 1373   HD21  LEU 193          HD21      LEU 193  19.963  -4.794   0.018
 1374   HD22  LEU 193          HD22      LEU 193  20.258  -4.427  -1.682
 1375   HD23  LEU 193          HD23      LEU 193  20.534  -3.192  -0.453
 1376    H    ARG 194           H        ARG 194  19.587  -0.382   0.787
 1377    HA   ARG 194           HA       ARG 194  22.394  -0.505  -0.097
 1378    HB2  ARG 194           HB2      ARG 194  21.093   1.578   1.669
 1379    HB3  ARG 194           HB3      ARG 194  22.828   1.399   1.483
 1380    HG2  ARG 194           HG2      ARG 194  20.993   1.948  -0.831
 1381    HG3  ARG 194           HG3      ARG 194  21.730   3.223   0.137
 1382    HD2  ARG 194           HD2      ARG 194  23.094   1.178  -1.595
 1383    HD3  ARG 194           HD3      ARG 194  23.108   2.939  -1.756
 1384    HE   ARG 194           HE       ARG 194  24.343   1.596   0.557
 1385   HH11  ARG 194          HH11      ARG 194  24.521   3.856  -2.116
 1386   HH12  ARG 194          HH12      ARG 194  26.137   4.375  -1.726
 1387   HH21  ARG 194          HH21      ARG 194  26.444   2.284   1.082
 1388   HH22  ARG 194          HH22      ARG 194  27.232   3.484   0.093
 1389    H    ARG 195           H        ARG 195  23.854  -1.306   1.467
 1390    HA   ARG 195           HA       ARG 195  22.494  -2.624   3.701
 1391    HB2  ARG 195           HB2      ARG 195  24.276  -4.151   3.844
 1392    HB3  ARG 195           HB3      ARG 195  23.984  -3.943   2.127
 1393    HG2  ARG 195           HG2      ARG 195  25.911  -2.495   1.941
 1394    HG3  ARG 195           HG3      ARG 195  26.178  -2.592   3.684
 1395    HD2  ARG 195           HD2      ARG 195  26.448  -4.772   1.629
 1396    HD3  ARG 195           HD3      ARG 195  27.682  -4.127   2.717
 1397    HE   ARG 195           HE       ARG 195  25.993  -5.101   4.496
 1398   HH11  ARG 195          HH11      ARG 195  26.999  -6.545   1.458
 1399   HH12  ARG 195          HH12      ARG 195  26.874  -8.175   2.052
 1400   HH21  ARG 195          HH21      ARG 195  25.789  -7.248   5.261
 1401   HH22  ARG 195          HH22      ARG 195  26.179  -8.576   4.206
 1402    H    LYS 196           H        LYS 196  22.814  -2.115   5.747
 1403    HA   LYS 196           HA       LYS 196  24.701   0.049   6.352
 1404    HB2  LYS 196           HB2      LYS 196  22.348   0.413   7.018
 1405    HB3  LYS 196           HB3      LYS 196  22.403  -1.044   8.000
 1406    HG2  LYS 196           HG2      LYS 196  24.009  -0.057   9.481
 1407    HG3  LYS 196           HG3      LYS 196  24.160   1.359   8.440
 1408    HD2  LYS 196           HD2      LYS 196  21.817   1.922   8.871
 1409    HD3  LYS 196           HD3      LYS 196  21.667   0.503   9.911
 1410    HE2  LYS 196           HE2      LYS 196  23.288   1.404  11.450
 1411    HE3  LYS 196           HE3      LYS 196  23.610   2.764  10.374
 1412    HZ1  LYS 196           HZ1      LYS 196  20.995   2.213  11.679
 1413    HZ2  LYS 196           HZ2      LYS 196  21.374   3.556  10.716
 1414    HZ3  LYS 196           HZ3      LYS 196  22.131   3.351  12.221
 1415    H    PHE 197           H        PHE 197  23.700  -3.198   7.294
 1416    HA   PHE 197           HA       PHE 197  26.151  -3.479   8.887
 1417    HB2  PHE 197           HB2      PHE 197  24.009  -5.581   8.575
 1418    HB3  PHE 197           HB3      PHE 197  25.237  -5.459   9.826
 1419    HD1  PHE 197           HD1      PHE 197  24.930  -2.635  10.594
 1420    HD2  PHE 197           HD2      PHE 197  21.990  -5.595   9.769
 1421    HE1  PHE 197           HE1      PHE 197  23.367  -1.467  12.073
 1422    HE2  PHE 197           HE2      PHE 197  20.398  -4.424  11.239
 1423    HZ   PHE 197           HZ       PHE 197  20.971  -2.445  12.339
 1424    H    PHE 198           H        PHE 198  27.666  -5.049   8.368
 1425    HA   PHE 198           HA       PHE 198  27.179  -6.698   6.033
 1426    HB2  PHE 198           HB2      PHE 198  29.717  -6.099   5.467
 1427    HB3  PHE 198           HB3      PHE 198  28.349  -5.213   4.818
 1428    HD1  PHE 198           HD1      PHE 198  30.775  -5.184   7.601
 1429    HD2  PHE 198           HD2      PHE 198  28.220  -2.898   5.083
 1430    HE1  PHE 198           HE1      PHE 198  31.690  -3.124   8.561
 1431    HE2  PHE 198           HE2      PHE 198  29.138  -0.821   6.035
 1432    HZ   PHE 198           HZ       PHE 198  30.828  -0.866   7.675
 1433    H    TYR 199           H        TYR 199  26.911  -8.109   7.936
 1434    HA   TYR 199           HA       TYR 199  29.538  -9.270   8.582
 1435    HB2  TYR 199           HB2      TYR 199  28.647 -10.057  10.719
 1436    HB3  TYR 199           HB3      TYR 199  28.535  -8.307  10.600
 1437    HD1  TYR 199           HD1      TYR 199  26.310  -7.238  10.238
 1438    HD2  TYR 199           HD2      TYR 199  26.686 -11.418  11.011
 1439    HE1  TYR 199           HE1      TYR 199  23.930  -7.338  10.844
 1440    HE2  TYR 199           HE2      TYR 199  24.309 -11.513  11.625
 1441    HH   TYR 199           HH       TYR 199  22.103  -9.038  10.953
 1442    H    SER 200           H        SER 200  26.123  -9.910   7.956
 1443    HA   SER 200           HA       SER 200  24.936 -11.771   7.534
 1444    HB2  SER 200           HB2      SER 200  26.350 -11.729   5.490
 1445    HB3  SER 200           HB3      SER 200  27.508 -12.778   6.304
 1446    HG   SER 200           HG       SER 200  25.465 -13.538   4.906
 1447    H    ASP 201           H        ASP 201  24.352 -13.684   8.522
 1448    HA   ASP 201           HA       ASP 201  26.010 -14.573  10.709
 1449    HB2  ASP 201           HB2      ASP 201  24.143 -16.120  11.179
 1450    HB3  ASP 201           HB3      ASP 201  23.578 -14.466  11.002
 1451    H    GLN 202           H        GLN 202  26.673 -14.849   7.820
 1452    HA   GLN 202           HA       GLN 202  26.506 -17.205   6.579
 1453    HB2  GLN 202           HB2      GLN 202  28.785 -16.693   5.645
 1454    HB3  GLN 202           HB3      GLN 202  27.630 -15.363   5.583
 1455    HG2  GLN 202           HG2      GLN 202  28.663 -14.313   7.486
 1456    HG3  GLN 202           HG3      GLN 202  29.766 -15.675   7.680
 1457   HE21  GLN 202          HE21      GLN 202  31.449 -15.941   6.252
 1458   HE22  GLN 202          HE22      GLN 202  31.992 -14.670   5.201
  Start of MODEL   16
    1    H1   GLY  -5           H1       GLY  -5 -29.645  -0.682  -7.969
    2    H2   GLY  -5           H2       GLY  -5 -30.181  -1.065  -6.406
    3    H3   GLY  -5           H3       GLY  -5 -30.913  -1.786  -7.754
    4    HA2  GLY  -5           HA2      GLY  -5 -28.920  -2.987  -8.281
    5    HA3  GLY  -5           HA3      GLY  -5 -28.080  -2.173  -6.967
    6    H    ILE  -4           H        ILE  -4 -27.652  -3.749  -5.558
    7    HA   ILE  -4           HA       ILE  -4 -29.431  -5.898  -4.963
    8    HB   ILE  -4           HB       ILE  -4 -26.995  -4.871  -3.486
    9   HG12  ILE  -4          HG12      ILE  -4 -26.530  -5.654  -5.761
   10   HG13  ILE  -4          HG13      ILE  -4 -25.835  -6.741  -4.564
   11   HG21  ILE  -4          HG21      ILE  -4 -28.463  -7.480  -3.125
   12   HG22  ILE  -4          HG22      ILE  -4 -26.929  -7.051  -2.369
   13   HG23  ILE  -4          HG23      ILE  -4 -28.392  -6.153  -1.966
   14   HD11  ILE  -4          HD11      ILE  -4 -27.682  -8.294  -4.895
   15   HD12  ILE  -4          HD12      ILE  -4 -28.391  -7.201  -6.083
   16   HD13  ILE  -4          HD13      ILE  -4 -26.835  -7.966  -6.406
   17    H    ASP  -3           H        ASP  -3 -30.580  -6.260  -3.003
   18    HA   ASP  -3           HA       ASP  -3 -32.187  -4.235  -2.056
   19    HB2  ASP  -3           HB2      ASP  -3 -31.343  -6.828  -0.762
   20    HB3  ASP  -3           HB3      ASP  -3 -32.495  -5.741   0.002
   21    HA   PRO  -2           HA       PRO  -2 -29.280  -1.840   0.386
   22    HB2  PRO  -2           HB2      PRO  -2 -31.762  -0.423   1.142
   23    HB3  PRO  -2           HB3      PRO  -2 -30.283   0.211   0.413
   24    HG2  PRO  -2           HG2      PRO  -2 -32.537  -0.025  -1.009
   25    HG3  PRO  -2           HG3      PRO  -2 -30.948  -0.333  -1.736
   26    HD2  PRO  -2           HD2      PRO  -2 -33.003  -2.286  -0.772
   27    HD3  PRO  -2           HD3      PRO  -2 -31.986  -2.344  -2.228
   28    H    PHE  -1           H        PHE  -1 -28.715  -1.989   2.493
   29    HA   PHE  -1           HA       PHE  -1 -30.292  -3.755   4.139
   30    HB2  PHE  -1           HB2      PHE  -1 -27.539  -2.580   4.535
   31    HB3  PHE  -1           HB3      PHE  -1 -28.314  -3.704   5.650
   32    HD1  PHE  -1           HD1      PHE  -1 -29.501  -5.720   4.051
   33    HD2  PHE  -1           HD2      PHE  -1 -25.869  -3.609   3.409
   34    HE1  PHE  -1           HE1      PHE  -1 -28.651  -7.608   2.714
   35    HE2  PHE  -1           HE2      PHE  -1 -25.005  -5.489   2.065
   36    HZ   PHE  -1           HZ       PHE  -1 -26.471  -7.533   1.734
   37    H    THR   0           H        THR   0 -31.941  -2.159   4.211
   38    HA   THR   0           HA       THR   0 -33.167  -0.535   5.162
   39    HB   THR   0           HB       THR   0 -33.200  -0.501   7.624
   40    HG1  THR   0           HG1      THR   0 -31.438  -2.557   7.995
   41   HG21  THR   0          HG21      THR   0 -34.429  -2.229   6.427
   42   HG22  THR   0          HG22      THR   0 -33.777  -2.866   7.937
   43   HG23  THR   0          HG23      THR   0 -32.993  -3.254   6.406
   44    H    MET   1           H        MET   1 -31.556   0.514   7.805
   45    HA   MET   1           HA       MET   1 -30.199   2.638   6.308
   46    HB2  MET   1           HB2      MET   1 -32.303   3.326   7.561
   47    HB3  MET   1           HB3      MET   1 -31.429   2.968   9.040
   48    HG2  MET   1           HG2      MET   1 -31.360   5.323   8.654
   49    HG3  MET   1           HG3      MET   1 -29.745   4.667   8.408
   50    HE1  MET   1           HE1      MET   1 -29.144   3.785   5.687
   51    HE2  MET   1           HE2      MET   1 -28.953   5.270   4.756
   52    HE3  MET   1           HE3      MET   1 -28.333   5.177   6.405
   53    H    VAL   2           H        VAL   2 -29.198   0.171   7.100
   54    HA   VAL   2           HA       VAL   2 -26.972   1.076   8.771
   55    HB   VAL   2           HB       VAL   2 -26.727  -1.196   9.717
   56   HG11  VAL   2          HG11      VAL   2 -29.416   0.056  10.258
   57   HG12  VAL   2          HG12      VAL   2 -28.586  -1.094  11.307
   58   HG13  VAL   2          HG13      VAL   2 -27.887   0.500  11.017
   59   HG21  VAL   2          HG21      VAL   2 -29.396  -1.737   8.426
   60   HG22  VAL   2          HG22      VAL   2 -27.850  -2.449   7.961
   61   HG23  VAL   2          HG23      VAL   2 -28.549  -2.811   9.540
   62    H    ALA   3           H        ALA   3 -27.002   1.366   6.176
   63    HA   ALA   3           HA       ALA   3 -24.937  -0.514   5.304
   64    HB1  ALA   3           HB1      ALA   3 -27.249   0.461   3.611
   65    HB2  ALA   3           HB2      ALA   3 -25.827  -0.370   2.979
   66    HB3  ALA   3           HB3      ALA   3 -26.919  -1.206   4.086
   67    H    LEU   4           H        LEU   4 -23.364   0.442   4.030
   68    HA   LEU   4           HA       LEU   4 -23.355   3.368   4.284
   69    HB2  LEU   4           HB2      LEU   4 -21.202   1.310   4.540
   70    HB3  LEU   4           HB3      LEU   4 -20.783   2.933   4.033
   71    HG   LEU   4           HG       LEU   4 -21.684   3.841   6.120
   72   HD11  LEU   4          HD11      LEU   4 -22.203   0.983   6.901
   73   HD12  LEU   4          HD12      LEU   4 -22.392   2.405   7.928
   74   HD13  LEU   4          HD13      LEU   4 -23.437   2.187   6.523
   75   HD21  LEU   4          HD21      LEU   4 -19.337   3.110   5.965
   76   HD22  LEU   4          HD22      LEU   4 -19.993   3.006   7.602
   77   HD23  LEU   4          HD23      LEU   4 -19.818   1.545   6.628
   78    H    SER   5           H        SER   5 -23.247   4.522   2.519
   79    HA   SER   5           HA       SER   5 -23.037   3.117  -0.039
   80    HB2  SER   5           HB2      SER   5 -23.958   5.948   0.533
   81    HB3  SER   5           HB3      SER   5 -24.020   5.136  -1.031
   82    HG   SER   5           HG       SER   5 -25.997   5.165   0.367
   83    H    LEU   6           H        LEU   6 -20.960   2.914  -0.578
   84    HA   LEU   6           HA       LEU   6 -19.166   5.184  -0.045
   85    HB2  LEU   6           HB2      LEU   6 -18.404   2.281  -0.367
   86    HB3  LEU   6           HB3      LEU   6 -17.364   3.597   0.158
   87    HG   LEU   6           HG       LEU   6 -19.689   2.428   1.692
   88   HD11  LEU   6          HD11      LEU   6 -17.992   1.707   3.271
   89   HD12  LEU   6          HD12      LEU   6 -17.694   1.024   1.674
   90   HD13  LEU   6          HD13      LEU   6 -16.728   2.385   2.244
   91   HD21  LEU   6          HD21      LEU   6 -17.831   4.686   2.427
   92   HD22  LEU   6          HD22      LEU   6 -19.555   4.821   2.068
   93   HD23  LEU   6          HD23      LEU   6 -19.018   3.938   3.497
   94    H    LYS   7           H        LYS   7 -18.156   6.109  -1.696
   95    HA   LYS   7           HA       LYS   7 -18.619   5.132  -4.375
   96    HB2  LYS   7           HB2      LYS   7 -17.853   7.641  -3.176
   97    HB3  LYS   7           HB3      LYS   7 -16.742   7.214  -4.477
   98    HG2  LYS   7           HG2      LYS   7 -18.537   7.035  -6.038
   99    HG3  LYS   7           HG3      LYS   7 -19.732   7.266  -4.760
  100    HD2  LYS   7           HD2      LYS   7 -19.279   9.282  -6.143
  101    HD3  LYS   7           HD3      LYS   7 -19.034   9.514  -4.413
  102    HE2  LYS   7           HE2      LYS   7 -16.617   9.218  -4.736
  103    HE3  LYS   7           HE3      LYS   7 -16.885   9.026  -6.470
  104    HZ1  LYS   7           HZ1      LYS   7 -17.700  11.255  -6.603
  105    HZ2  LYS   7           HZ2      LYS   7 -16.194  11.292  -5.818
  106    HZ3  LYS   7           HZ3      LYS   7 -17.623  11.451  -4.920
  107    H    ILE   8           H        ILE   8 -17.437   3.552  -5.127
  108    HA   ILE   8           HA       ILE   8 -14.818   3.024  -3.972
  109    HB   ILE   8           HB       ILE   8 -16.370   1.427  -6.019
  110   HG12  ILE   8          HG12      ILE   8 -17.572   1.531  -3.893
  111   HG13  ILE   8          HG13      ILE   8 -16.901  -0.078  -4.133
  112   HG21  ILE   8          HG21      ILE   8 -13.979   1.012  -6.111
  113   HG22  ILE   8          HG22      ILE   8 -13.948   0.710  -4.374
  114   HG23  ILE   8          HG23      ILE   8 -14.826  -0.383  -5.443
  115   HD11  ILE   8          HD11      ILE   8 -16.648   0.656  -1.833
  116   HD12  ILE   8          HD12      ILE   8 -15.074   0.457  -2.605
  117   HD13  ILE   8          HD13      ILE   8 -15.744   2.072  -2.371
  118    H    SER   9           H        SER   9 -13.381   4.419  -4.804
  119    HA   SER   9           HA       SER   9 -13.297   4.898  -7.669
  120    HB2  SER   9           HB2      SER   9 -12.859   6.794  -6.184
  121    HB3  SER   9           HB3      SER   9 -11.539   5.919  -5.421
  122    HG   SER   9           HG       SER   9 -10.322   6.746  -6.913
  123    H    ILE  10           H        ILE  10 -12.328   3.446  -8.932
  124    HA   ILE  10           HA       ILE  10 -10.046   1.961  -7.814
  125    HB   ILE  10           HB       ILE  10 -11.750   1.074 -10.147
  126   HG12  ILE  10          HG12      ILE  10 -11.924   0.162  -7.264
  127   HG13  ILE  10          HG13      ILE  10 -13.086   1.227  -8.046
  128   HG21  ILE  10          HG21      ILE  10 -10.714  -1.110  -9.707
  129   HG22  ILE  10          HG22      ILE  10  -9.508   0.124 -10.074
  130   HG23  ILE  10          HG23      ILE  10  -9.765  -0.390  -8.406
  131   HD11  ILE  10          HD11      ILE  10 -13.664  -0.546  -9.611
  132   HD12  ILE  10          HD12      ILE  10 -12.491  -1.614  -8.837
  133   HD13  ILE  10          HD13      ILE  10 -13.904  -1.055  -7.939
  134    H    GLY  11           H        GLY  11  -8.919   3.981  -8.410
  135    HA2  GLY  11           HA2      GLY  11  -7.293   4.951  -9.693
  136    HA3  GLY  11           HA3      GLY  11  -7.422   3.578 -10.777
  137    H    ASN  12           H        ASN  12  -9.112   3.625 -12.382
  138    HA   ASN  12           HA       ASN  12  -9.318   6.334 -13.490
  139    HB2  ASN  12           HB2      ASN  12  -9.648   5.208 -15.644
  140    HB3  ASN  12           HB3      ASN  12  -8.189   4.631 -14.855
  141   HD21  ASN  12          HD21      ASN  12  -8.148   2.540 -13.965
  142   HD22  ASN  12          HD22      ASN  12  -9.304   1.339 -14.449
  143    H    VAL  13           H        VAL  13 -11.211   4.122 -11.877
  144    HA   VAL  13           HA       VAL  13 -13.659   5.129 -13.148
  145    HB   VAL  13           HB       VAL  13 -12.901   2.786 -13.890
  146   HG11  VAL  13          HG11      VAL  13 -13.939   2.083 -11.153
  147   HG12  VAL  13          HG12      VAL  13 -13.576   0.935 -12.442
  148   HG13  VAL  13          HG13      VAL  13 -12.282   1.898 -11.729
  149   HG21  VAL  13          HG21      VAL  13 -15.665   3.193 -12.783
  150   HG22  VAL  13          HG22      VAL  13 -15.083   3.663 -14.382
  151   HG23  VAL  13          HG23      VAL  13 -15.200   1.957 -13.953
  152    H    VAL  14           H        VAL  14 -15.603   4.830 -11.758
  153    HA   VAL  14           HA       VAL  14 -15.029   4.297  -8.951
  154    HB   VAL  14           HB       VAL  14 -14.819   6.705  -9.021
  155   HG11  VAL  14          HG11      VAL  14 -16.642   8.162  -9.732
  156   HG12  VAL  14          HG12      VAL  14 -16.045   7.168 -11.061
  157   HG13  VAL  14          HG13      VAL  14 -17.561   6.753 -10.261
  158   HG21  VAL  14          HG21      VAL  14 -15.878   5.795  -7.040
  159   HG22  VAL  14          HG22      VAL  14 -16.598   7.356  -7.433
  160   HG23  VAL  14          HG23      VAL  14 -17.457   5.864  -7.821
  161    H    LYS  15           H        LYS  15 -16.499   3.060  -8.075
  162    HA   LYS  15           HA       LYS  15 -19.077   2.721  -9.472
  163    HB2  LYS  15           HB2      LYS  15 -17.507   0.643  -7.925
  164    HB3  LYS  15           HB3      LYS  15 -19.049   0.383  -8.726
  165    HG2  LYS  15           HG2      LYS  15 -16.458   1.081 -10.090
  166    HG3  LYS  15           HG3      LYS  15 -17.192  -0.521 -10.019
  167    HD2  LYS  15           HD2      LYS  15 -19.143   0.326 -11.235
  168    HD3  LYS  15           HD3      LYS  15 -18.402   1.925 -11.307
  169    HE2  LYS  15           HE2      LYS  15 -16.521   0.970 -12.574
  170    HE3  LYS  15           HE3      LYS  15 -17.313  -0.604 -12.537
  171    HZ1  LYS  15           HZ1      LYS  15 -19.140   0.298 -13.808
  172    HZ2  LYS  15           HZ2      LYS  15 -17.682   0.580 -14.628
  173    HZ3  LYS  15           HZ3      LYS  15 -18.439   1.844 -13.787
  174    H    THR  16           H        THR  16 -20.924   2.465  -8.158
  175    HA   THR  16           HA       THR  16 -20.524   3.490  -5.438
  176    HB   THR  16           HB       THR  16 -23.123   3.284  -6.972
  177    HG1  THR  16           HG1      THR  16 -22.019   4.809  -8.075
  178   HG21  THR  16          HG21      THR  16 -23.929   4.889  -5.303
  179   HG22  THR  16          HG22      THR  16 -22.361   4.842  -4.496
  180   HG23  THR  16          HG23      THR  16 -23.377   3.401  -4.535
  181    H    MET  17           H        MET  17 -20.509   2.039  -3.851
  182    HA   MET  17           HA       MET  17 -22.143  -0.376  -4.126
  183    HB2  MET  17           HB2      MET  17 -19.215  -0.219  -3.982
  184    HB3  MET  17           HB3      MET  17 -19.913  -1.265  -2.756
  185    HG2  MET  17           HG2      MET  17 -20.630  -1.519  -5.656
  186    HG3  MET  17           HG3      MET  17 -19.222  -2.321  -4.961
  187    HE1  MET  17           HE1      MET  17 -20.768  -4.837  -2.440
  188    HE2  MET  17           HE2      MET  17 -19.310  -4.336  -3.295
  189    HE3  MET  17           HE3      MET  17 -20.063  -3.251  -2.125
  190    H    GLN  18           H        GLN  18 -22.817  -1.266  -2.165
  191    HA   GLN  18           HA       GLN  18 -22.403   0.501   0.141
  192    HB2  GLN  18           HB2      GLN  18 -24.852  -0.998  -0.752
  193    HB3  GLN  18           HB3      GLN  18 -24.666  -0.418   0.903
  194    HG2  GLN  18           HG2      GLN  18 -24.790   1.779   0.304
  195    HG3  GLN  18           HG3      GLN  18 -24.219   1.478  -1.339
  196   HE21  GLN  18          HE21      GLN  18 -25.862   2.572  -2.312
  197   HE22  GLN  18          HE22      GLN  18 -27.489   1.996  -2.354
  198    H    PHE  19           H        PHE  19 -21.892  -0.383   2.069
  199    HA   PHE  19           HA       PHE  19 -21.565  -3.293   2.179
  200    HB2  PHE  19           HB2      PHE  19 -19.593  -1.232   3.216
  201    HB3  PHE  19           HB3      PHE  19 -19.438  -2.977   3.370
  202    HD1  PHE  19           HD1      PHE  19 -18.839  -4.342   1.451
  203    HD2  PHE  19           HD2      PHE  19 -19.100  -0.109   1.156
  204    HE1  PHE  19           HE1      PHE  19 -17.597  -4.417  -0.673
  205    HE2  PHE  19           HE2      PHE  19 -17.857  -0.173  -0.966
  206    HZ   PHE  19           HZ       PHE  19 -17.102  -2.330  -1.883
  207    H    GLU  20           H        GLU  20 -21.569  -4.063   4.432
  208    HA   GLU  20           HA       GLU  20 -23.389  -2.478   6.028
  209    HB2  GLU  20           HB2      GLU  20 -22.165  -5.194   6.557
  210    HB3  GLU  20           HB3      GLU  20 -23.414  -4.432   7.536
  211    HG2  GLU  20           HG2      GLU  20 -24.891  -4.420   5.544
  212    HG3  GLU  20           HG3      GLU  20 -23.651  -5.321   4.671
  213    HA   PRO  21           HA       PRO  21 -20.506  -0.358   8.581
  214    HB2  PRO  21           HB2      PRO  21 -21.856  -1.014  11.009
  215    HB3  PRO  21           HB3      PRO  21 -21.963   0.480  10.084
  216    HG2  PRO  21           HG2      PRO  21 -23.807  -1.809  10.155
  217    HG3  PRO  21           HG3      PRO  21 -24.118  -0.123   9.698
  218    HD2  PRO  21           HD2      PRO  21 -24.019  -2.144   7.903
  219    HD3  PRO  21           HD3      PRO  21 -23.549  -0.478   7.514
  220    H    SER  22           H        SER  22 -21.501  -3.645   9.450
  221    HA   SER  22           HA       SER  22 -18.945  -3.988  10.867
  222    HB2  SER  22           HB2      SER  22 -21.141  -4.475  12.050
  223    HB3  SER  22           HB3      SER  22 -21.324  -5.846  10.959
  224    HG   SER  22           HG       SER  22 -20.042  -6.916  12.216
  225    H    THR  23           H        THR  23 -19.770  -4.235   7.835
  226    HA   THR  23           HA       THR  23 -19.361  -6.856   6.985
  227    HB   THR  23           HB       THR  23 -18.763  -4.205   5.699
  228    HG1  THR  23           HG1      THR  23 -20.616  -6.315   5.180
  229   HG21  THR  23          HG21      THR  23 -18.307  -6.915   4.457
  230   HG22  THR  23          HG22      THR  23 -17.069  -5.714   4.830
  231   HG23  THR  23          HG23      THR  23 -18.285  -5.375   3.596
  232    H    MET  24           H        MET  24 -16.983  -4.286   7.505
  233    HA   MET  24           HA       MET  24 -14.798  -4.329   8.109
  234    HB2  MET  24           HB2      MET  24 -15.652  -6.481   9.362
  235    HB3  MET  24           HB3      MET  24 -14.700  -7.314   8.149
  236    HG2  MET  24           HG2      MET  24 -12.709  -6.253   8.901
  237    HG3  MET  24           HG3      MET  24 -13.624  -5.175   9.958
  238    HE1  MET  24           HE1      MET  24 -12.679  -5.602  12.218
  239    HE2  MET  24           HE2      MET  24 -12.098  -7.174  12.779
  240    HE3  MET  24           HE3      MET  24 -11.366  -6.417  11.364
  241    H    VAL  25           H        VAL  25 -12.911  -4.357   7.060
  242    HA   VAL  25           HA       VAL  25 -12.787  -4.087   4.411
  243    HB   VAL  25           HB       VAL  25 -10.586  -5.079   6.203
  244   HG11  VAL  25          HG11      VAL  25  -9.012  -4.260   4.534
  245   HG12  VAL  25          HG12      VAL  25 -10.007  -5.560   3.875
  246   HG13  VAL  25          HG13      VAL  25 -10.348  -3.883   3.444
  247   HG21  VAL  25          HG21      VAL  25 -11.584  -2.964   6.848
  248   HG22  VAL  25          HG22      VAL  25  -9.954  -2.710   6.224
  249   HG23  VAL  25          HG23      VAL  25 -11.353  -2.338   5.216
  250    H    TYR  26           H        TYR  26 -11.786  -7.168   5.932
  251    HA   TYR  26           HA       TYR  26 -11.066  -8.417   3.543
  252    HB2  TYR  26           HB2      TYR  26 -11.042 -10.512   4.731
  253    HB3  TYR  26           HB3      TYR  26 -10.404  -9.248   5.773
  254    HD1  TYR  26           HD1      TYR  26 -11.817  -8.386   7.653
  255    HD2  TYR  26           HD2      TYR  26 -12.951 -11.771   5.339
  256    HE1  TYR  26           HE1      TYR  26 -13.388  -9.060   9.422
  257    HE2  TYR  26           HE2      TYR  26 -14.523 -12.457   7.097
  258    HH   TYR  26           HH       TYR  26 -15.597 -10.485   9.472
  259    H    ASP  27           H        ASP  27 -14.226  -8.153   5.031
  260    HA   ASP  27           HA       ASP  27 -15.418 -10.120   3.281
  261    HB2  ASP  27           HB2      ASP  27 -16.291  -9.575   5.592
  262    HB3  ASP  27           HB3      ASP  27 -16.866  -8.046   4.935
  263    H    ALA  28           H        ALA  28 -15.205  -6.604   3.477
  264    HA   ALA  28           HA       ALA  28 -16.849  -5.934   1.333
  265    HB1  ALA  28           HB1      ALA  28 -15.924  -4.304   2.910
  266    HB2  ALA  28           HB2      ALA  28 -14.321  -4.549   2.218
  267    HB3  ALA  28           HB3      ALA  28 -15.606  -3.844   1.238
  268    H    CYS  29           H        CYS  29 -13.369  -6.603   1.368
  269    HA   CYS  29           HA       CYS  29 -12.856  -6.219  -1.342
  270    HB2  CYS  29           HB2      CYS  29 -11.093  -6.416   0.343
  271    HB3  CYS  29           HB3      CYS  29 -11.493  -8.113   0.581
  272    HG   CYS  29           HG       CYS  29 -10.396  -6.889  -2.423
  273    H    ARG  30           H        ARG  30 -14.275  -8.979   0.279
  274    HA   ARG  30           HA       ARG  30 -13.783 -10.761  -1.922
  275    HB2  ARG  30           HB2      ARG  30 -14.805 -12.449  -0.696
  276    HB3  ARG  30           HB3      ARG  30 -14.071 -11.434   0.532
  277    HG2  ARG  30           HG2      ARG  30 -16.229 -10.418   1.016
  278    HG3  ARG  30           HG3      ARG  30 -16.970 -11.383  -0.268
  279    HD2  ARG  30           HD2      ARG  30 -16.397 -13.431   0.898
  280    HD3  ARG  30           HD3      ARG  30 -15.581 -12.507   2.159
  281    HE   ARG  30           HE       ARG  30 -17.868 -11.493   2.545
  282   HH11  ARG  30          HH11      ARG  30 -17.418 -14.752   1.328
  283   HH12  ARG  30          HH12      ARG  30 -18.905 -15.345   2.020
  284   HH21  ARG  30          HH21      ARG  30 -19.793 -12.273   3.470
  285   HH22  ARG  30          HH22      ARG  30 -20.237 -13.946   3.270
  286    H    MET  31           H        MET  31 -16.445  -8.737  -0.866
  287    HA   MET  31           HA       MET  31 -18.270  -9.778  -2.807
  288    HB2  MET  31           HB2      MET  31 -18.397  -7.198  -1.239
  289    HB3  MET  31           HB3      MET  31 -19.714  -7.932  -2.139
  290    HG2  MET  31           HG2      MET  31 -19.702  -9.847  -0.679
  291    HG3  MET  31           HG3      MET  31 -18.320  -9.203   0.195
  292    HE1  MET  31           HE1      MET  31 -19.656  -6.208   2.099
  293    HE2  MET  31           HE2      MET  31 -18.303  -7.292   1.747
  294    HE3  MET  31           HE3      MET  31 -18.880  -6.168   0.513
  295    H    ILE  32           H        ILE  32 -16.211  -6.893  -2.587
  296    HA   ILE  32           HA       ILE  32 -17.264  -5.636  -4.866
  297    HB   ILE  32           HB       ILE  32 -15.944  -4.400  -3.237
  298   HG12  ILE  32          HG12      ILE  32 -14.672  -4.397  -5.981
  299   HG13  ILE  32          HG13      ILE  32 -16.158  -3.561  -5.545
  300   HG21  ILE  32          HG21      ILE  32 -14.284  -6.081  -2.677
  301   HG22  ILE  32          HG22      ILE  32 -13.578  -5.941  -4.287
  302   HG23  ILE  32          HG23      ILE  32 -13.505  -4.578  -3.171
  303   HD11  ILE  32          HD11      ILE  32 -14.924  -2.171  -3.981
  304   HD12  ILE  32          HD12      ILE  32 -13.434  -3.016  -4.406
  305   HD13  ILE  32          HD13      ILE  32 -14.272  -2.044  -5.616
  306    H    ARG  33           H        ARG  33 -14.445  -7.783  -4.523
  307    HA   ARG  33           HA       ARG  33 -13.675  -7.806  -7.218
  308    HB2  ARG  33           HB2      ARG  33 -12.463  -9.834  -6.732
  309    HB3  ARG  33           HB3      ARG  33 -12.324  -8.755  -5.352
  310    HG2  ARG  33           HG2      ARG  33 -13.970 -10.028  -4.135
  311    HG3  ARG  33           HG3      ARG  33 -14.254 -11.057  -5.540
  312    HD2  ARG  33           HD2      ARG  33 -12.830 -12.224  -4.004
  313    HD3  ARG  33           HD3      ARG  33 -11.889 -11.783  -5.426
  314    HE   ARG  33           HE       ARG  33 -11.577  -9.776  -3.492
  315   HH11  ARG  33          HH11      ARG  33 -10.754 -13.132  -4.010
  316   HH12  ARG  33          HH12      ARG  33  -9.321 -13.080  -3.032
  317   HH21  ARG  33          HH21      ARG  33  -9.678  -9.692  -2.190
  318   HH22  ARG  33          HH22      ARG  33  -8.714 -11.128  -1.990
  319    H    GLU  34           H        GLU  34 -16.303  -9.283  -5.606
  320    HA   GLU  34           HA       GLU  34 -16.747 -11.394  -7.506
  321    HB2  GLU  34           HB2      GLU  34 -17.451 -11.463  -5.094
  322    HB3  GLU  34           HB3      GLU  34 -18.696 -10.287  -5.484
  323    HG2  GLU  34           HG2      GLU  34 -19.650 -12.485  -5.436
  324    HG3  GLU  34           HG3      GLU  34 -19.661 -11.877  -7.090
  325    H    ARG  35           H        ARG  35 -18.598  -8.456  -6.687
  326    HA   ARG  35           HA       ARG  35 -20.202  -8.766  -9.064
  327    HB2  ARG  35           HB2      ARG  35 -21.324  -6.654  -8.237
  328    HB3  ARG  35           HB3      ARG  35 -21.422  -8.059  -7.184
  329    HG2  ARG  35           HG2      ARG  35 -19.100  -6.545  -6.502
  330    HG3  ARG  35           HG3      ARG  35 -20.501  -5.473  -6.564
  331    HD2  ARG  35           HD2      ARG  35 -20.588  -8.104  -5.122
  332    HD3  ARG  35           HD3      ARG  35 -19.980  -6.647  -4.343
  333    HE   ARG  35           HE       ARG  35 -22.381  -5.854  -5.277
  334   HH11  ARG  35          HH11      ARG  35 -21.446  -8.714  -3.461
  335   HH12  ARG  35          HH12      ARG  35 -22.906  -8.736  -2.519
  336   HH21  ARG  35          HH21      ARG  35 -24.285  -5.899  -4.036
  337   HH22  ARG  35          HH22      ARG  35 -24.513  -7.139  -2.834
  338    H    ILE  36           H        ILE  36 -17.517  -6.707  -8.107
  339    HA   ILE  36           HA       ILE  36 -17.953  -5.066 -10.508
  340    HB   ILE  36           HB       ILE  36 -16.107  -4.514  -8.180
  341   HG12  ILE  36          HG12      ILE  36 -18.815  -3.343  -8.861
  342   HG13  ILE  36          HG13      ILE  36 -18.479  -4.439  -7.526
  343   HG21  ILE  36          HG21      ILE  36 -15.346  -3.475 -10.242
  344   HG22  ILE  36          HG22      ILE  36 -16.948  -2.783 -10.504
  345   HG23  ILE  36          HG23      ILE  36 -15.972  -2.253  -9.134
  346   HD11  ILE  36          HD11      ILE  36 -18.672  -2.147  -6.760
  347   HD12  ILE  36          HD12      ILE  36 -17.036  -2.756  -6.510
  348   HD13  ILE  36          HD13      ILE  36 -17.373  -1.659  -7.850
  349    HA   PRO  37           HA       PRO  37 -14.566  -7.507 -12.223
  350    HB2  PRO  37           HB2      PRO  37 -15.228  -6.152 -14.719
  351    HB3  PRO  37           HB3      PRO  37 -15.354  -7.865 -14.316
  352    HG2  PRO  37           HG2      PRO  37 -17.522  -6.287 -14.691
  353    HG3  PRO  37           HG3      PRO  37 -17.519  -7.669 -13.579
  354    HD2  PRO  37           HD2      PRO  37 -17.226  -4.747 -12.974
  355    HD3  PRO  37           HD3      PRO  37 -18.164  -5.988 -12.113
  356    H    GLU  38           H        GLU  38 -15.028  -4.120 -12.089
  357    HA   GLU  38           HA       GLU  38 -12.584  -3.365 -13.401
  358    HB2  GLU  38           HB2      GLU  38 -14.393  -1.780 -11.564
  359    HB3  GLU  38           HB3      GLU  38 -13.089  -1.113 -12.536
  360    HG2  GLU  38           HG2      GLU  38 -15.495  -2.524 -13.657
  361    HG3  GLU  38           HG3      GLU  38 -15.346  -0.776 -13.491
  362    H    ALA  39           H        ALA  39 -13.397  -4.585 -10.359
  363    HA   ALA  39           HA       ALA  39 -11.542  -3.131  -8.758
  364    HB1  ALA  39           HB1      ALA  39 -12.932  -5.744  -8.190
  365    HB2  ALA  39           HB2      ALA  39 -12.112  -4.723  -7.009
  366    HB3  ALA  39           HB3      ALA  39 -13.563  -4.138  -7.823
  367    H    LEU  40           H        LEU  40 -11.488  -6.331 -10.290
  368    HA   LEU  40           HA       LEU  40  -8.813  -6.728  -9.222
  369    HB2  LEU  40           HB2      LEU  40  -9.134  -9.072 -10.330
  370    HB3  LEU  40           HB3      LEU  40  -9.839  -8.694  -8.777
  371    HG   LEU  40           HG       LEU  40 -11.298 -10.014 -10.324
  372   HD11  LEU  40          HD11      LEU  40 -13.332  -8.765  -9.855
  373   HD12  LEU  40          HD12      LEU  40 -12.248  -8.780  -8.465
  374   HD13  LEU  40          HD13      LEU  40 -12.372  -7.337  -9.470
  375   HD21  LEU  40          HD21      LEU  40 -10.779  -9.009 -12.431
  376   HD22  LEU  40          HD22      LEU  40 -12.494  -8.765 -12.092
  377   HD23  LEU  40          HD23      LEU  40 -11.351  -7.438 -11.871
  378    H    ALA  41           H        ALA  41  -8.301  -4.898 -10.775
  379    HA   ALA  41           HA       ALA  41  -7.923  -5.499 -13.519
  380    HB1  ALA  41           HB1      ALA  41  -6.468  -3.530 -13.542
  381    HB2  ALA  41           HB2      ALA  41  -7.971  -3.204 -12.677
  382    HB3  ALA  41           HB3      ALA  41  -6.481  -3.497 -11.780
  383    H    GLY  42           H        GLY  42  -6.377  -6.480 -10.702
  384    HA2  GLY  42           HA2      GLY  42  -4.380  -7.931 -12.272
  385    HA3  GLY  42           HA3      GLY  42  -3.846  -7.015 -10.865
  386    HA   PRO  43           HA       PRO  43  -4.843 -11.224  -9.226
  387    HB2  PRO  43           HB2      PRO  43  -2.839 -10.387  -7.231
  388    HB3  PRO  43           HB3      PRO  43  -2.917 -11.868  -8.189
  389    HG2  PRO  43           HG2      PRO  43  -1.093  -9.967  -8.688
  390    HG3  PRO  43           HG3      PRO  43  -1.828 -10.924  -9.989
  391    HD2  PRO  43           HD2      PRO  43  -2.430  -8.125  -9.119
  392    HD3  PRO  43           HD3      PRO  43  -2.339  -8.803 -10.759
  393    HA   PRO  44           HA       PRO  44  -7.770  -9.204  -6.536
  394    HB2  PRO  44           HB2      PRO  44  -8.767 -11.500  -5.387
  395    HB3  PRO  44           HB3      PRO  44  -9.278 -10.858  -6.952
  396    HG2  PRO  44           HG2      PRO  44  -7.314 -13.030  -6.341
  397    HG3  PRO  44           HG3      PRO  44  -8.552 -12.960  -7.609
  398    HD2  PRO  44           HD2      PRO  44  -5.968 -12.491  -8.151
  399    HD3  PRO  44           HD3      PRO  44  -7.261 -11.587  -8.967
  400    H    ASN  45           H        ASN  45  -5.337 -11.443  -5.420
  401    HA   ASN  45           HA       ASN  45  -5.778 -11.044  -2.618
  402    HB2  ASN  45           HB2      ASN  45  -3.120 -11.876  -3.753
  403    HB3  ASN  45           HB3      ASN  45  -3.896 -12.395  -2.261
  404   HD21  ASN  45          HD21      ASN  45  -3.525 -12.923  -5.622
  405   HD22  ASN  45          HD22      ASN  45  -4.501 -14.355  -5.738
  406    H    ASP  46           H        ASP  46  -4.395  -9.223  -5.083
  407    HA   ASP  46           HA       ASP  46  -2.405  -7.908  -3.406
  408    HB2  ASP  46           HB2      ASP  46  -3.029  -7.800  -6.355
  409    HB3  ASP  46           HB3      ASP  46  -1.868  -6.720  -5.593
  410    H    PHE  47           H        PHE  47  -5.566  -7.485  -3.566
  411    HA   PHE  47           HA       PHE  47  -5.388  -4.565  -3.898
  412    HB2  PHE  47           HB2      PHE  47  -7.617  -6.450  -4.622
  413    HB3  PHE  47           HB3      PHE  47  -7.875  -4.718  -4.444
  414    HD1  PHE  47           HD1      PHE  47  -6.549  -3.153  -5.915
  415    HD2  PHE  47           HD2      PHE  47  -6.761  -7.344  -6.592
  416    HE1  PHE  47           HE1      PHE  47  -5.819  -2.812  -8.235
  417    HE2  PHE  47           HE2      PHE  47  -6.028  -7.013  -8.914
  418    HZ   PHE  47           HZ       PHE  47  -5.560  -4.712  -9.737
  419    H    GLY  48           H        GLY  48  -6.099  -3.281  -2.346
  420    HA2  GLY  48           HA2      GLY  48  -7.695  -4.456  -0.161
  421    HA3  GLY  48           HA3      GLY  48  -6.256  -3.513   0.197
  422    H    LEU  49           H        LEU  49  -8.091  -2.404   1.455
  423    HA   LEU  49           HA       LEU  49  -9.604  -0.573  -0.262
  424    HB2  LEU  49           HB2      LEU  49  -9.952  -1.182   2.674
  425    HB3  LEU  49           HB3      LEU  49 -10.993  -0.156   1.707
  426    HG   LEU  49           HG       LEU  49 -10.630  -3.135   1.372
  427   HD11  LEU  49          HD11      LEU  49 -12.971  -3.239   2.090
  428   HD12  LEU  49          HD12      LEU  49 -11.924  -2.562   3.339
  429   HD13  LEU  49          HD13      LEU  49 -12.951  -1.498   2.377
  430   HD21  LEU  49          HD21      LEU  49 -11.009  -2.044  -0.773
  431   HD22  LEU  49          HD22      LEU  49 -12.425  -2.970  -0.276
  432   HD23  LEU  49          HD23      LEU  49 -12.417  -1.214  -0.113
  433    H    PHE  50           H        PHE  50  -8.526   1.208  -0.649
  434    HA   PHE  50           HA       PHE  50  -7.049   2.543   1.497
  435    HB2  PHE  50           HB2      PHE  50  -5.967   2.384  -0.712
  436    HB3  PHE  50           HB3      PHE  50  -7.302   3.281  -1.430
  437    HD1  PHE  50           HD1      PHE  50  -4.589   3.549   1.102
  438    HD2  PHE  50           HD2      PHE  50  -7.252   5.606  -1.515
  439    HE1  PHE  50           HE1      PHE  50  -3.442   5.659   1.586
  440    HE2  PHE  50           HE2      PHE  50  -6.091   7.719  -1.034
  441    HZ   PHE  50           HZ       PHE  50  -4.179   7.744   0.519
  442    H    LEU  51           H        LEU  51  -7.775   4.347   2.520
  443    HA   LEU  51           HA       LEU  51 -10.482   5.206   1.816
  444    HB2  LEU  51           HB2      LEU  51  -9.626   4.449   4.200
  445    HB3  LEU  51           HB3      LEU  51  -9.075   6.110   4.293
  446    HG   LEU  51           HG       LEU  51 -11.310   5.677   5.343
  447   HD11  LEU  51          HD11      LEU  51 -12.412   7.652   4.403
  448   HD12  LEU  51          HD12      LEU  51 -10.694   7.934   4.690
  449   HD13  LEU  51          HD13      LEU  51 -11.277   7.636   3.052
  450   HD21  LEU  51          HD21      LEU  51 -12.163   5.291   2.480
  451   HD22  LEU  51          HD22      LEU  51 -12.145   4.056   3.738
  452   HD23  LEU  51          HD23      LEU  51 -13.243   5.430   3.868
  453    H    SER  52           H        SER  52 -10.649   6.923   0.601
  454    HA   SER  52           HA       SER  52  -8.470   8.746   0.214
  455    HB2  SER  52           HB2      SER  52 -11.303   8.894  -0.840
  456    HB3  SER  52           HB3      SER  52  -9.900   9.759  -1.468
  457    HG   SER  52           HG       SER  52  -9.093   7.916  -2.285
  458    H    ASP  53           H        ASP  53  -8.056  10.313   1.618
  459    HA   ASP  53           HA       ASP  53 -10.273  11.522   3.124
  460    HB2  ASP  53           HB2      ASP  53  -8.360  10.593   4.430
  461    HB3  ASP  53           HB3      ASP  53  -7.291  11.735   3.622
  462    H    ASP  54           H        ASP  54  -7.194  12.520   1.667
  463    HA   ASP  54           HA       ASP  54  -8.189  14.546   0.022
  464    HB2  ASP  54           HB2      ASP  54  -8.838  15.703   2.070
  465    HB3  ASP  54           HB3      ASP  54  -7.214  15.513   2.722
  466    H    ASP  55           H        ASP  55  -5.551  13.894   2.289
  467    HA   ASP  55           HA       ASP  55  -3.641  14.218   0.069
  468    HB2  ASP  55           HB2      ASP  55  -3.656  16.140   1.716
  469    HB3  ASP  55           HB3      ASP  55  -3.127  15.004   2.949
  470    HA   PRO  56           HA       PRO  56  -2.244  10.096   0.870
  471    HB2  PRO  56           HB2      PRO  56   0.520  10.639   0.821
  472    HB3  PRO  56           HB3      PRO  56  -0.487  10.141  -0.541
  473    HG2  PRO  56           HG2      PRO  56   0.405  12.865   0.264
  474    HG3  PRO  56           HG3      PRO  56   0.148  12.195  -1.358
  475    HD2  PRO  56           HD2      PRO  56  -1.608  13.893  -0.282
  476    HD3  PRO  56           HD3      PRO  56  -2.159  12.508  -1.253
  477    H    LYS  57           H        LYS  57  -0.845  12.724   2.787
  478    HA   LYS  57           HA       LYS  57   0.274  11.029   4.794
  479    HB2  LYS  57           HB2      LYS  57  -0.542  13.931   5.045
  480    HB3  LYS  57           HB3      LYS  57   0.563  13.059   6.100
  481    HG2  LYS  57           HG2      LYS  57   1.053  13.548   3.172
  482    HG3  LYS  57           HG3      LYS  57   1.675  14.566   4.471
  483    HD2  LYS  57           HD2      LYS  57   2.206  11.645   4.605
  484    HD3  LYS  57           HD3      LYS  57   3.100  12.592   3.416
  485    HE2  LYS  57           HE2      LYS  57   4.395  12.450   5.436
  486    HE3  LYS  57           HE3      LYS  57   3.833  14.106   5.234
  487    HZ1  LYS  57           HZ1      LYS  57   2.125  13.710   6.873
  488    HZ2  LYS  57           HZ2      LYS  57   3.637  13.318   7.524
  489    HZ3  LYS  57           HZ3      LYS  57   2.588  12.085   7.031
  490    H    LYS  58           H        LYS  58  -2.873  12.348   4.206
  491    HA   LYS  58           HA       LYS  58  -3.826  11.630   6.877
  492    HB2  LYS  58           HB2      LYS  58  -5.101  13.096   4.579
  493    HB3  LYS  58           HB3      LYS  58  -6.021  12.562   5.976
  494    HG2  LYS  58           HG2      LYS  58  -5.522  14.780   6.428
  495    HG3  LYS  58           HG3      LYS  58  -4.340  13.879   7.369
  496    HD2  LYS  58           HD2      LYS  58  -2.621  14.328   5.778
  497    HD3  LYS  58           HD3      LYS  58  -3.780  15.001   4.629
  498    HE2  LYS  58           HE2      LYS  58  -2.498  16.746   5.789
  499    HE3  LYS  58           HE3      LYS  58  -4.225  16.855   6.117
  500    HZ1  LYS  58           HZ1      LYS  58  -2.841  17.163   8.108
  501    HZ2  LYS  58           HZ2      LYS  58  -2.243  15.585   7.927
  502    HZ3  LYS  58           HZ3      LYS  58  -3.885  15.834   8.249
  503    H    GLY  59           H        GLY  59  -3.951  10.622   3.553
  504    HA2  GLY  59           HA2      GLY  59  -6.147   8.859   3.676
  505    HA3  GLY  59           HA3      GLY  59  -4.814   8.757   2.532
  506    H    ILE  60           H        ILE  60  -6.189   6.556   3.848
  507    HA   ILE  60           HA       ILE  60  -3.956   5.410   5.346
  508    HB   ILE  60           HB       ILE  60  -5.605   4.425   6.989
  509   HG12  ILE  60          HG12      ILE  60  -7.357   6.684   6.000
  510   HG13  ILE  60          HG13      ILE  60  -7.637   4.980   5.667
  511   HG21  ILE  60          HG21      ILE  60  -5.574   6.382   8.441
  512   HG22  ILE  60          HG22      ILE  60  -4.038   6.176   7.600
  513   HG23  ILE  60          HG23      ILE  60  -5.181   7.405   7.059
  514   HD11  ILE  60          HD11      ILE  60  -9.059   5.786   7.460
  515   HD12  ILE  60          HD12      ILE  60  -7.933   4.561   8.047
  516   HD13  ILE  60          HD13      ILE  60  -7.637   6.265   8.387
  517    H    TRP  61           H        TRP  61  -4.043   3.118   5.539
  518    HA   TRP  61           HA       TRP  61  -5.634   1.865   3.435
  519    HB2  TRP  61           HB2      TRP  61  -3.133   1.076   4.879
  520    HB3  TRP  61           HB3      TRP  61  -4.138  -0.165   4.132
  521    HD1  TRP  61           HD1      TRP  61  -1.634   2.512   3.314
  522    HE1  TRP  61           HE1      TRP  61  -1.165   2.513   0.787
  523    HE3  TRP  61           HE3      TRP  61  -5.358  -0.635   1.827
  524    HZ2  TRP  61           HZ2      TRP  61  -2.247   1.316  -1.540
  525    HZ3  TRP  61           HZ3      TRP  61  -5.581  -1.157  -0.563
  526    HH2  TRP  61           HH2      TRP  61  -4.057  -0.201  -2.211
  527    H    LEU  62           H        LEU  62  -7.130   0.366   3.835
  528    HA   LEU  62           HA       LEU  62  -7.928   0.101   6.626
  529    HB2  LEU  62           HB2      LEU  62  -9.448  -0.684   4.136
  530    HB3  LEU  62           HB3      LEU  62 -10.086  -0.567   5.767
  531    HG   LEU  62           HG       LEU  62  -9.077   1.758   4.120
  532   HD11  LEU  62          HD11      LEU  62 -11.882   0.947   4.854
  533   HD12  LEU  62          HD12      LEU  62 -11.417   2.429   4.016
  534   HD13  LEU  62          HD13      LEU  62 -11.158   0.863   3.248
  535   HD21  LEU  62          HD21      LEU  62 -10.428   1.694   6.812
  536   HD22  LEU  62          HD22      LEU  62  -8.742   2.112   6.501
  537   HD23  LEU  62          HD23      LEU  62 -10.034   3.145   5.887
  538    H    GLU  63           H        GLU  63  -7.056  -1.579   7.630
  539    HA   GLU  63           HA       GLU  63  -6.323  -3.992   6.189
  540    HB2  GLU  63           HB2      GLU  63  -5.378  -4.729   8.329
  541    HB3  GLU  63           HB3      GLU  63  -4.814  -3.112   7.919
  542    HG2  GLU  63           HG2      GLU  63  -7.247  -3.134   9.507
  543    HG3  GLU  63           HG3      GLU  63  -5.882  -3.865  10.324
  544    H    ALA  64           H        ALA  64  -6.959  -6.127   7.033
  545    HA   ALA  64           HA       ALA  64  -9.800  -6.265   7.351
  546    HB1  ALA  64           HB1      ALA  64  -7.739  -8.458   7.493
  547    HB2  ALA  64           HB2      ALA  64  -9.482  -8.681   7.336
  548    HB3  ALA  64           HB3      ALA  64  -8.568  -7.918   6.034
  549    H    GLY  65           H        GLY  65  -7.543  -5.472   9.525
  550    HA2  GLY  65           HA2      GLY  65  -8.580  -7.078  11.734
  551    HA3  GLY  65           HA3      GLY  65  -7.172  -6.030  11.787
  552    H    LYS  66           H        LYS  66  -9.896  -4.573  10.310
  553    HA   LYS  66           HA       LYS  66 -11.137  -3.696  12.732
  554    HB2  LYS  66           HB2      LYS  66 -10.396  -1.549  12.925
  555    HB3  LYS  66           HB3      LYS  66  -8.947  -2.249  12.209
  556    HG2  LYS  66           HG2      LYS  66 -11.093  -0.780  10.685
  557    HG3  LYS  66           HG3      LYS  66  -9.575  -0.077  11.239
  558    HD2  LYS  66           HD2      LYS  66  -8.384  -1.805   9.908
  559    HD3  LYS  66           HD3      LYS  66  -9.938  -2.306   9.249
  560    HE2  LYS  66           HE2      LYS  66  -9.142  -0.857   7.637
  561    HE3  LYS  66           HE3      LYS  66 -10.186   0.186   8.604
  562    HZ1  LYS  66           HZ1      LYS  66  -8.253   1.039   9.752
  563    HZ2  LYS  66           HZ2      LYS  66  -8.012   1.202   8.087
  564    HZ3  LYS  66           HZ3      LYS  66  -7.228  -0.034   8.936
  565    H    ALA  67           H        ALA  67 -13.017  -2.295  12.273
  566    HA   ALA  67           HA       ALA  67 -14.220  -3.229   9.791
  567    HB1  ALA  67           HB1      ALA  67 -16.330  -2.554  10.761
  568    HB2  ALA  67           HB2      ALA  67 -15.411  -3.507  11.929
  569    HB3  ALA  67           HB3      ALA  67 -15.493  -1.751  12.091
  570    H    LEU  68           H        LEU  68 -15.550  -1.730   8.514
  571    HA   LEU  68           HA       LEU  68 -14.036   0.524   7.691
  572    HB2  LEU  68           HB2      LEU  68 -16.899  -0.148   7.019
  573    HB3  LEU  68           HB3      LEU  68 -15.843   0.934   6.142
  574    HG   LEU  68           HG       LEU  68 -15.461  -2.049   6.389
  575   HD11  LEU  68          HD11      LEU  68 -17.379  -1.478   5.001
  576   HD12  LEU  68          HD12      LEU  68 -16.381  -0.367   4.062
  577   HD13  LEU  68          HD13      LEU  68 -16.052  -2.100   4.020
  578   HD21  LEU  68          HD21      LEU  68 -13.355  -0.839   6.198
  579   HD22  LEU  68          HD22      LEU  68 -13.710  -1.729   4.718
  580   HD23  LEU  68          HD23      LEU  68 -13.965   0.014   4.780
  581    H    ASP  69           H        ASP  69 -17.230   0.221   9.158
  582    HA   ASP  69           HA       ASP  69 -17.706   2.973   9.525
  583    HB2  ASP  69           HB2      ASP  69 -19.547   1.418   9.454
  584    HB3  ASP  69           HB3      ASP  69 -18.917   0.524  10.830
  585    H    TYR  70           H        TYR  70 -15.731   0.796  11.274
  586    HA   TYR  70           HA       TYR  70 -15.735   1.945  13.813
  587    HB2  TYR  70           HB2      TYR  70 -14.473   0.029  13.780
  588    HB3  TYR  70           HB3      TYR  70 -13.791   0.365  12.194
  589    HD1  TYR  70           HD1      TYR  70 -13.625   1.528  15.743
  590    HD2  TYR  70           HD2      TYR  70 -11.612   1.081  12.023
  591    HE1  TYR  70           HE1      TYR  70 -11.534   2.288  16.790
  592    HE2  TYR  70           HE2      TYR  70  -9.516   1.839  13.058
  593    HH   TYR  70           HH       TYR  70  -9.111   2.103  16.424
  594    H    TYR  71           H        TYR  71 -14.142   2.906  10.829
  595    HA   TYR  71           HA       TYR  71 -12.925   5.231  12.021
  596    HB2  TYR  71           HB2      TYR  71 -13.136   4.173   9.218
  597    HB3  TYR  71           HB3      TYR  71 -12.562   5.812   9.519
  598    HD1  TYR  71           HD1      TYR  71 -10.534   6.098  11.081
  599    HD2  TYR  71           HD2      TYR  71 -11.702   2.352   9.427
  600    HE1  TYR  71           HE1      TYR  71  -8.295   5.217  11.484
  601    HE2  TYR  71           HE2      TYR  71  -9.450   1.462   9.848
  602    HH   TYR  71           HH       TYR  71  -7.143   2.363  10.138
  603    H    MET  72           H        MET  72 -13.557   6.990   9.758
  604    HA   MET  72           HA       MET  72 -16.041   8.035  10.887
  605    HB2  MET  72           HB2      MET  72 -13.962   9.282   9.081
  606    HB3  MET  72           HB3      MET  72 -15.394  10.114   9.669
  607    HG2  MET  72           HG2      MET  72 -14.631   9.979  11.927
  608    HG3  MET  72           HG3      MET  72 -13.292   8.932  11.463
  609    HE1  MET  72           HE1      MET  72 -14.548  12.035   9.424
  610    HE2  MET  72           HE2      MET  72 -14.836  12.535  11.091
  611    HE3  MET  72           HE3      MET  72 -13.594  13.340  10.131
  612    H    LEU  73           H        LEU  73 -15.964   5.789   8.845
  613    HA   LEU  73           HA       LEU  73 -16.919   7.125   6.431
  614    HB2  LEU  73           HB2      LEU  73 -17.065   4.218   6.408
  615    HB3  LEU  73           HB3      LEU  73 -16.353   5.317   5.253
  616    HG   LEU  73           HG       LEU  73 -15.026   4.290   7.760
  617   HD11  LEU  73          HD11      LEU  73 -13.562   3.132   6.168
  618   HD12  LEU  73          HD12      LEU  73 -15.241   2.607   6.033
  619   HD13  LEU  73          HD13      LEU  73 -14.566   3.716   4.841
  620   HD21  LEU  73          HD21      LEU  73 -13.022   5.393   6.893
  621   HD22  LEU  73          HD22      LEU  73 -13.977   6.094   5.586
  622   HD23  LEU  73          HD23      LEU  73 -14.301   6.552   7.259
  623    H    ARG  74           H        ARG  74 -18.801   6.851   5.503
  624    HA   ARG  74           HA       ARG  74 -20.857   5.130   6.341
  625    HB2  ARG  74           HB2      ARG  74 -22.415   7.052   7.112
  626    HB3  ARG  74           HB3      ARG  74 -21.275   6.368   8.255
  627    HG2  ARG  74           HG2      ARG  74 -21.189   8.683   8.592
  628    HG3  ARG  74           HG3      ARG  74 -19.741   8.303   7.664
  629    HD2  ARG  74           HD2      ARG  74 -21.888   8.882   5.870
  630    HD3  ARG  74           HD3      ARG  74 -21.765  10.173   7.065
  631    HE   ARG  74           HE       ARG  74 -19.296   9.320   5.750
  632   HH11  ARG  74          HH11      ARG  74 -21.879  11.688   6.015
  633   HH12  ARG  74          HH12      ARG  74 -21.012  12.915   5.136
  634   HH21  ARG  74          HH21      ARG  74 -18.153  10.926   4.624
  635   HH22  ARG  74          HH22      ARG  74 -18.899  12.472   4.328
  636    H    ASN  75           H        ASN  75 -23.009   6.979   5.553
  637    HA   ASN  75           HA       ASN  75 -22.865   6.418   2.773
  638    HB2  ASN  75           HB2      ASN  75 -24.825   8.024   4.406
  639    HB3  ASN  75           HB3      ASN  75 -24.962   7.890   2.659
  640   HD21  ASN  75          HD21      ASN  75 -23.897   5.362   4.864
  641   HD22  ASN  75          HD22      ASN  75 -25.235   4.299   4.576
  642    H    GLY  76           H        GLY  76 -21.481   7.451   1.485
  643    HA2  GLY  76           HA2      GLY  76 -21.599   9.536   0.104
  644    HA3  GLY  76           HA3      GLY  76 -21.491  10.405   1.625
  645    H    ASP  77           H        ASP  77 -19.498   8.007   2.316
  646    HA   ASP  77           HA       ASP  77 -17.209   9.633   1.670
  647    HB2  ASP  77           HB2      ASP  77 -17.447   7.027   3.172
  648    HB3  ASP  77           HB3      ASP  77 -15.931   7.893   2.938
  649    H    THR  78           H        THR  78 -15.703   9.317   0.205
  650    HA   THR  78           HA       THR  78 -16.049   7.196  -1.740
  651    HB   THR  78           HB       THR  78 -13.974   9.403  -1.658
  652    HG1  THR  78           HG1      THR  78 -16.060  10.298  -1.746
  653   HG21  THR  78          HG21      THR  78 -13.405   7.535  -3.156
  654   HG22  THR  78          HG22      THR  78 -13.784   9.000  -4.064
  655   HG23  THR  78          HG23      THR  78 -14.973   7.702  -3.951
  656    H    MET  79           H        MET  79 -14.842   5.400  -1.832
  657    HA   MET  79           HA       MET  79 -12.449   5.245  -0.134
  658    HB2  MET  79           HB2      MET  79 -14.470   4.066   0.857
  659    HB3  MET  79           HB3      MET  79 -14.405   2.972  -0.519
  660    HG2  MET  79           HG2      MET  79 -12.150   2.293   0.130
  661    HG3  MET  79           HG3      MET  79 -12.221   3.387   1.508
  662    HE1  MET  79           HE1      MET  79 -14.687  -0.467   1.024
  663    HE2  MET  79           HE2      MET  79 -14.932   0.931  -0.024
  664    HE3  MET  79           HE3      MET  79 -13.398   0.056  -0.066
  665    H    GLU  80           H        GLU  80 -10.760   4.858  -1.359
  666    HA   GLU  80           HA       GLU  80 -11.100   4.063  -4.105
  667    HB2  GLU  80           HB2      GLU  80  -9.400   5.763  -3.140
  668    HB3  GLU  80           HB3      GLU  80  -8.461   4.347  -2.685
  669    HG2  GLU  80           HG2      GLU  80  -8.379   3.637  -5.012
  670    HG3  GLU  80           HG3      GLU  80  -9.335   5.044  -5.477
  671    H    TYR  81           H        TYR  81 -11.033   1.976  -4.838
  672    HA   TYR  81           HA       TYR  81  -9.824  -0.024  -3.095
  673    HB2  TYR  81           HB2      TYR  81 -12.130  -0.412  -4.022
  674    HB3  TYR  81           HB3      TYR  81 -11.427  -0.418  -5.635
  675    HD1  TYR  81           HD1      TYR  81 -11.551  -2.235  -2.414
  676    HD2  TYR  81           HD2      TYR  81 -10.314  -2.343  -6.481
  677    HE1  TYR  81           HE1      TYR  81 -11.087  -4.643  -2.207
  678    HE2  TYR  81           HE2      TYR  81  -9.854  -4.746  -6.287
  679    HH   TYR  81           HH       TYR  81 -10.903  -6.618  -3.660
  680    H    ARG  82           H        ARG  82  -7.725  -0.187  -3.432
  681    HA   ARG  82           HA       ARG  82  -6.776  -0.187  -6.191
  682    HB2  ARG  82           HB2      ARG  82  -4.843   1.232  -5.630
  683    HB3  ARG  82           HB3      ARG  82  -6.370   2.086  -5.492
  684    HG2  ARG  82           HG2      ARG  82  -6.259   2.173  -3.177
  685    HG3  ARG  82           HG3      ARG  82  -5.082   0.858  -3.088
  686    HD2  ARG  82           HD2      ARG  82  -4.537   3.580  -4.275
  687    HD3  ARG  82           HD3      ARG  82  -4.099   3.093  -2.638
  688    HE   ARG  82           HE       ARG  82  -2.928   1.187  -4.144
  689   HH11  ARG  82          HH11      ARG  82  -2.866   4.696  -4.319
  690   HH12  ARG  82          HH12      ARG  82  -1.270   4.750  -5.011
  691   HH21  ARG  82          HH21      ARG  82  -0.829   1.274  -5.060
  692   HH22  ARG  82          HH22      ARG  82  -0.111   2.819  -5.429
  693    H    LYS  83           H        LYS  83  -4.402  -0.797  -6.242
  694    HA   LYS  83           HA       LYS  83  -4.150  -3.358  -5.111
  695    HB2  LYS  83           HB2      LYS  83  -3.076  -2.409  -7.227
  696    HB3  LYS  83           HB3      LYS  83  -1.891  -1.659  -6.170
  697    HG2  LYS  83           HG2      LYS  83  -1.137  -3.810  -5.407
  698    HG3  LYS  83           HG3      LYS  83  -2.421  -4.620  -6.316
  699    HD2  LYS  83           HD2      LYS  83  -1.457  -3.781  -8.406
  700    HD3  LYS  83           HD3      LYS  83  -0.182  -2.971  -7.495
  701    HE2  LYS  83           HE2      LYS  83   0.753  -4.988  -8.303
  702    HE3  LYS  83           HE3      LYS  83   0.448  -5.232  -6.582
  703    HZ1  LYS  83           HZ1      LYS  83  -1.663  -6.331  -7.241
  704    HZ2  LYS  83           HZ2      LYS  83  -0.277  -7.161  -7.733
  705    HZ3  LYS  83           HZ3      LYS  83  -1.167  -6.246  -8.860
  706    H    LYS  84           H        LYS  84  -3.549  -3.946  -3.141
  707    HA   LYS  84           HA       LYS  84  -2.954  -2.335  -0.977
  708    HB2  LYS  84           HB2      LYS  84  -2.404  -5.191  -1.648
  709    HB3  LYS  84           HB3      LYS  84  -1.602  -4.509  -0.245
  710    HG2  LYS  84           HG2      LYS  84  -4.579  -4.525  -0.660
  711    HG3  LYS  84           HG3      LYS  84  -3.677  -5.726   0.267
  712    HD2  LYS  84           HD2      LYS  84  -2.764  -3.702   1.576
  713    HD3  LYS  84           HD3      LYS  84  -4.133  -2.834   0.876
  714    HE2  LYS  84           HE2      LYS  84  -4.694  -3.720   3.080
  715    HE3  LYS  84           HE3      LYS  84  -5.668  -4.482   1.822
  716    HZ1  LYS  84           HZ1      LYS  84  -4.843  -6.106   3.419
  717    HZ2  LYS  84           HZ2      LYS  84  -3.242  -5.663   3.079
  718    HZ3  LYS  84           HZ3      LYS  84  -4.188  -6.398   1.883
  719    H    GLN  85           H        GLN  85  -0.866  -3.745  -3.360
  720    HA   GLN  85           HA       GLN  85   1.522  -2.736  -2.077
  721    HB2  GLN  85           HB2      GLN  85   1.745  -4.112  -4.666
  722    HB3  GLN  85           HB3      GLN  85   2.631  -4.379  -3.171
  723    HG2  GLN  85           HG2      GLN  85   0.402  -5.419  -2.351
  724    HG3  GLN  85           HG3      GLN  85   0.042  -5.543  -4.072
  725   HE21  GLN  85          HE21      GLN  85   1.959  -6.691  -1.448
  726   HE22  GLN  85          HE22      GLN  85   2.694  -8.006  -2.290
  727    H    ARG  86           H        ARG  86   2.831  -1.257  -3.000
  728    HA   ARG  86           HA       ARG  86   1.881   0.000  -5.475
  729    HB2  ARG  86           HB2      ARG  86   3.212   2.044  -4.419
  730    HB3  ARG  86           HB3      ARG  86   1.519   1.753  -4.057
  731    HG2  ARG  86           HG2      ARG  86   2.461   2.205  -1.991
  732    HG3  ARG  86           HG3      ARG  86   2.373   0.445  -2.031
  733    HD2  ARG  86           HD2      ARG  86   4.510   1.269  -1.134
  734    HD3  ARG  86           HD3      ARG  86   4.719   0.302  -2.595
  735    HE   ARG  86           HE       ARG  86   5.611   2.124  -3.617
  736   HH11  ARG  86          HH11      ARG  86   3.772   3.253  -0.826
  737   HH12  ARG  86          HH12      ARG  86   4.241   4.914  -1.061
  738   HH21  ARG  86          HH21      ARG  86   6.246   4.307  -3.857
  739   HH22  ARG  86          HH22      ARG  86   5.638   5.505  -2.759
  740    HA   PRO  87           HA       PRO  87   5.553  -1.100  -7.370
  741    HB2  PRO  87           HB2      PRO  87   6.306   1.119  -8.785
  742    HB3  PRO  87           HB3      PRO  87   4.982   0.048  -9.254
  743    HG2  PRO  87           HG2      PRO  87   4.879   2.675  -7.832
  744    HG3  PRO  87           HG3      PRO  87   3.818   2.047  -9.106
  745    HD2  PRO  87           HD2      PRO  87   3.100   2.049  -6.506
  746    HD3  PRO  87           HD3      PRO  87   2.591   0.770  -7.628
  747    H    LEU  88           H        LEU  88   7.267  -1.516  -6.162
  748    HA   LEU  88           HA       LEU  88   8.885   0.721  -5.166
  749    HB2  LEU  88           HB2      LEU  88   8.654  -2.161  -4.433
  750    HB3  LEU  88           HB3      LEU  88  10.219  -1.399  -4.244
  751    HG   LEU  88           HG       LEU  88   9.017  -1.394  -2.141
  752   HD11  LEU  88          HD11      LEU  88  10.501   0.475  -2.597
  753   HD12  LEU  88          HD12      LEU  88   9.171   1.365  -3.338
  754   HD13  LEU  88          HD13      LEU  88   9.125   0.983  -1.617
  755   HD21  LEU  88          HD21      LEU  88   6.742  -1.454  -2.991
  756   HD22  LEU  88          HD22      LEU  88   6.955  -0.126  -1.850
  757   HD23  LEU  88          HD23      LEU  88   6.907   0.199  -3.582
  758    H    LYS  89           H        LYS  89  10.290   1.425  -6.642
  759    HA   LYS  89           HA       LYS  89  11.632  -0.502  -8.375
  760    HB2  LYS  89           HB2      LYS  89  11.603   2.513  -8.301
  761    HB3  LYS  89           HB3      LYS  89  12.808   1.629  -9.228
  762    HG2  LYS  89           HG2      LYS  89  11.126   2.169 -10.759
  763    HG3  LYS  89           HG3      LYS  89  10.865   0.468 -10.370
  764    HD2  LYS  89           HD2      LYS  89   8.736   1.489 -10.347
  765    HD3  LYS  89           HD3      LYS  89   9.181   1.250  -8.659
  766    HE2  LYS  89           HE2      LYS  89   8.200   3.465  -9.021
  767    HE3  LYS  89           HE3      LYS  89   9.879   3.574  -8.493
  768    HZ1  LYS  89           HZ1      LYS  89   9.399   5.108 -10.308
  769    HZ2  LYS  89           HZ2      LYS  89   8.947   3.815 -11.305
  770    HZ3  LYS  89           HZ3      LYS  89  10.552   3.959 -10.774
  771    H    ILE  90           H        ILE  90  13.522  -1.313  -7.838
  772    HA   ILE  90           HA       ILE  90  14.901  -0.115  -5.526
  773    HB   ILE  90           HB       ILE  90  14.338  -3.059  -5.937
  774   HG12  ILE  90          HG12      ILE  90  12.372  -1.817  -5.157
  775   HG13  ILE  90          HG13      ILE  90  12.985  -2.886  -3.900
  776   HG21  ILE  90          HG21      ILE  90  16.503  -2.802  -4.957
  777   HG22  ILE  90          HG22      ILE  90  15.886  -1.637  -3.780
  778   HG23  ILE  90          HG23      ILE  90  15.381  -3.325  -3.701
  779   HD11  ILE  90          HD11      ILE  90  13.454   0.083  -4.064
  780   HD12  ILE  90          HD12      ILE  90  12.312  -0.733  -2.996
  781   HD13  ILE  90          HD13      ILE  90  14.045  -0.991  -2.796
  782    H    ARG  91           H        ARG  91  17.076   0.051  -5.765
  783    HA   ARG  91           HA       ARG  91  18.266  -1.325  -8.064
  784    HB2  ARG  91           HB2      ARG  91  18.426   1.198  -7.962
  785    HB3  ARG  91           HB3      ARG  91  19.400   1.003  -6.508
  786    HG2  ARG  91           HG2      ARG  91  21.074  -0.245  -7.763
  787    HG3  ARG  91           HG3      ARG  91  20.107  -0.074  -9.228
  788    HD2  ARG  91           HD2      ARG  91  21.248   2.207  -7.624
  789    HD3  ARG  91           HD3      ARG  91  21.954   1.558  -9.102
  790    HE   ARG  91           HE       ARG  91  19.451   2.179  -9.872
  791   HH11  ARG  91          HH11      ARG  91  21.945   4.004  -8.210
  792   HH12  ARG  91          HH12      ARG  91  21.386   5.540  -8.812
  793   HH21  ARG  91          HH21      ARG  91  18.741   4.167 -10.677
  794   HH22  ARG  91          HH22      ARG  91  19.573   5.633 -10.233
  795    H    MET  92           H        MET  92  19.503  -2.994  -7.654
  796    HA   MET  92           HA       MET  92  20.171  -3.726  -4.953
  797    HB2  MET  92           HB2      MET  92  20.094  -4.996  -7.614
  798    HB3  MET  92           HB3      MET  92  21.325  -5.617  -6.526
  799    HG2  MET  92           HG2      MET  92  19.061  -6.771  -6.567
  800    HG3  MET  92           HG3      MET  92  19.761  -6.393  -5.001
  801    HE1  MET  92           HE1      MET  92  17.920  -4.188  -7.642
  802    HE2  MET  92           HE2      MET  92  16.921  -5.639  -7.574
  803    HE3  MET  92           HE3      MET  92  16.292  -4.104  -6.967
  804    H    LEU  93           H        LEU  93  22.412  -4.777  -4.655
  805    HA   LEU  93           HA       LEU  93  24.257  -2.652  -4.568
  806    HB2  LEU  93           HB2      LEU  93  24.816  -5.600  -4.197
  807    HB3  LEU  93           HB3      LEU  93  25.858  -4.287  -3.695
  808    HG   LEU  93           HG       LEU  93  24.875  -4.941  -1.713
  809   HD11  LEU  93          HD11      LEU  93  23.322  -3.208  -1.031
  810   HD12  LEU  93          HD12      LEU  93  24.622  -2.539  -2.018
  811   HD13  LEU  93          HD13      LEU  93  23.023  -2.792  -2.719
  812   HD21  LEU  93          HD21      LEU  93  22.599  -5.614  -1.392
  813   HD22  LEU  93          HD22      LEU  93  22.178  -5.145  -3.037
  814   HD23  LEU  93          HD23      LEU  93  23.265  -6.505  -2.760
  815    H    ASP  94           H        ASP  94  23.820  -5.321  -6.763
  816    HA   ASP  94           HA       ASP  94  26.236  -5.135  -8.195
  817    HB2  ASP  94           HB2      ASP  94  24.729  -7.042  -8.397
  818    HB3  ASP  94           HB3      ASP  94  23.482  -6.014  -9.089
  819    H    GLY  95           H        GLY  95  23.552  -3.048  -8.025
  820    HA2  GLY  95           HA2      GLY  95  23.591  -0.836  -8.901
  821    HA3  GLY  95           HA3      GLY  95  24.680  -1.386 -10.172
  822    H    THR  96           H        THR  96  22.151  -3.488  -9.512
  823    HA   THR  96           HA       THR  96  20.911  -2.786 -12.070
  824    HB   THR  96           HB       THR  96  21.070  -5.393 -10.548
  825    HG1  THR  96           HG1      THR  96  22.814  -5.476 -11.762
  826   HG21  THR  96          HG21      THR  96  19.836  -6.416 -12.409
  827   HG22  THR  96          HG22      THR  96  19.568  -4.818 -13.108
  828   HG23  THR  96          HG23      THR  96  18.850  -5.234 -11.550
  829    H    VAL  97           H        VAL  97  18.727  -2.448 -12.226
  830    HA   VAL  97           HA       VAL  97  17.381  -2.118  -9.631
  831    HB   VAL  97           HB       VAL  97  17.791   0.021 -10.706
  832   HG11  VAL  97          HG11      VAL  97  16.775   0.602 -12.848
  833   HG12  VAL  97          HG12      VAL  97  17.950  -0.702 -13.011
  834   HG13  VAL  97          HG13      VAL  97  16.223  -1.063 -13.036
  835   HG21  VAL  97          HG21      VAL  97  14.879  -0.746 -10.857
  836   HG22  VAL  97          HG22      VAL  97  15.739  -0.190  -9.422
  837   HG23  VAL  97          HG23      VAL  97  15.507   0.900 -10.789
  838    H    LYS  98           H        LYS  98  15.361  -2.814  -9.353
  839    HA   LYS  98           HA       LYS  98  13.902  -3.989 -11.592
  840    HB2  LYS  98           HB2      LYS  98  13.396  -6.061 -10.518
  841    HB3  LYS  98           HB3      LYS  98  15.143  -5.879 -10.511
  842    HG2  LYS  98           HG2      LYS  98  15.211  -5.471  -8.219
  843    HG3  LYS  98           HG3      LYS  98  13.492  -5.078  -8.145
  844    HD2  LYS  98           HD2      LYS  98  14.551  -7.809  -8.847
  845    HD3  LYS  98           HD3      LYS  98  14.111  -7.330  -7.205
  846    HE2  LYS  98           HE2      LYS  98  12.235  -7.268  -9.578
  847    HE3  LYS  98           HE3      LYS  98  12.313  -8.560  -8.371
  848    HZ1  LYS  98           HZ1      LYS  98  11.621  -5.729  -7.888
  849    HZ2  LYS  98           HZ2      LYS  98  11.755  -6.915  -6.692
  850    HZ3  LYS  98           HZ3      LYS  98  10.556  -7.047  -7.884
  851    H    THR  99           H        THR  99  11.610  -4.349 -11.074
  852    HA   THR  99           HA       THR  99  10.722  -2.561  -8.912
  853    HB   THR  99           HB       THR  99   9.371  -3.313 -11.509
  854    HG1  THR  99           HG1      THR  99   9.673  -1.093 -11.979
  855   HG21  THR  99          HG21      THR  99   8.403  -1.494  -9.307
  856   HG22  THR  99          HG22      THR  99   7.767  -3.098  -9.674
  857   HG23  THR  99          HG23      THR  99   7.592  -1.791 -10.847
  858    H    ILE 100           H        ILE 100   9.511  -3.460  -7.282
  859    HA   ILE 100           HA       ILE 100   8.117  -5.969  -7.881
  860    HB   ILE 100           HB       ILE 100  10.198  -6.401  -6.572
  861   HG12  ILE 100          HG12      ILE 100   7.844  -7.627  -6.334
  862   HG13  ILE 100          HG13      ILE 100   9.248  -8.102  -5.391
  863   HG21  ILE 100          HG21      ILE 100  10.364  -4.383  -5.299
  864   HG22  ILE 100          HG22      ILE 100   8.853  -4.739  -4.461
  865   HG23  ILE 100          HG23      ILE 100  10.269  -5.756  -4.197
  866   HD11  ILE 100          HD11      ILE 100   7.241  -8.012  -4.034
  867   HD12  ILE 100          HD12      ILE 100   8.419  -6.810  -3.504
  868   HD13  ILE 100          HD13      ILE 100   7.021  -6.313  -4.456
  869    H    MET 101           H        MET 101   6.065  -6.131  -6.886
  870    HA   MET 101           HA       MET 101   5.034  -3.614  -5.846
  871    HB2  MET 101           HB2      MET 101   3.634  -6.220  -6.466
  872    HB3  MET 101           HB3      MET 101   2.837  -4.716  -6.021
  873    HG2  MET 101           HG2      MET 101   4.503  -5.169  -8.485
  874    HG3  MET 101           HG3      MET 101   2.743  -5.111  -8.419
  875    HE1  MET 101           HE1      MET 101   2.292  -2.814  -6.296
  876    HE2  MET 101           HE2      MET 101   2.159  -1.375  -7.312
  877    HE3  MET 101           HE3      MET 101   1.364  -2.873  -7.795
  878    H    VAL 102           H        VAL 102   5.232  -3.216  -3.802
  879    HA   VAL 102           HA       VAL 102   4.820  -5.410  -1.870
  880    HB   VAL 102           HB       VAL 102   6.315  -3.068  -0.899
  881   HG11  VAL 102          HG11      VAL 102   6.697  -6.048  -0.690
  882   HG12  VAL 102          HG12      VAL 102   7.649  -4.836   0.168
  883   HG13  VAL 102          HG13      VAL 102   5.924  -4.995   0.496
  884   HG21  VAL 102          HG21      VAL 102   7.325  -3.213  -3.089
  885   HG22  VAL 102          HG22      VAL 102   8.450  -3.815  -1.871
  886   HG23  VAL 102          HG23      VAL 102   7.568  -4.952  -2.893
  887    H    ASP 103           H        ASP 103   3.447  -5.093  -0.226
  888    HA   ASP 103           HA       ASP 103   1.342  -3.335  -0.446
  889    HB2  ASP 103           HB2      ASP 103   2.368  -4.654   2.069
  890    HB3  ASP 103           HB3      ASP 103   0.776  -3.938   1.870
  891    H    ASP 104           H        ASP 104   0.908  -1.331   0.135
  892    HA   ASP 104           HA       ASP 104   2.951   0.292   1.413
  893    HB2  ASP 104           HB2      ASP 104   1.572   1.104  -0.524
  894    HB3  ASP 104           HB3      ASP 104   0.158   1.057   0.520
  895    H    SER 105           H        SER 105   0.370  -1.648   2.294
  896    HA   SER 105           HA       SER 105  -0.530  -0.123   4.570
  897    HB2  SER 105           HB2      SER 105  -1.736  -2.449   4.935
  898    HB3  SER 105           HB3      SER 105  -2.260  -1.339   3.668
  899    HG   SER 105           HG       SER 105  -1.283  -3.838   3.423
  900    H    LYS 106           H        LYS 106   2.356  -1.348   4.356
  901    HA   LYS 106           HA       LYS 106   2.403  -2.190   7.129
  902    HB2  LYS 106           HB2      LYS 106   3.890  -4.182   6.477
  903    HB3  LYS 106           HB3      LYS 106   2.152  -4.338   6.281
  904    HG2  LYS 106           HG2      LYS 106   2.888  -5.221   4.315
  905    HG3  LYS 106           HG3      LYS 106   2.658  -3.543   3.845
  906    HD2  LYS 106           HD2      LYS 106   4.993  -3.106   3.977
  907    HD3  LYS 106           HD3      LYS 106   5.298  -4.666   4.756
  908    HE2  LYS 106           HE2      LYS 106   4.336  -4.210   1.933
  909    HE3  LYS 106           HE3      LYS 106   5.928  -4.789   2.426
  910    HZ1  LYS 106           HZ1      LYS 106   3.354  -6.219   2.883
  911    HZ2  LYS 106           HZ2      LYS 106   4.891  -6.775   3.338
  912    HZ3  LYS 106           HZ3      LYS 106   4.502  -6.610   1.696
  913    H    THR 107           H        THR 107   4.895  -2.918   7.567
  914    HA   THR 107           HA       THR 107   6.251  -0.396   7.244
  915    HB   THR 107           HB       THR 107   7.954  -1.453   8.769
  916    HG1  THR 107           HG1      THR 107   7.440  -3.444   9.679
  917   HG21  THR 107          HG21      THR 107   5.077  -1.428   9.685
  918   HG22  THR 107          HG22      THR 107   6.184  -0.053   9.669
  919   HG23  THR 107          HG23      THR 107   6.483  -1.414  10.751
  920    H    VAL 108           H        VAL 108   8.800  -0.723   7.144
  921    HA   VAL 108           HA       VAL 108   9.208  -1.544   4.409
  922    HB   VAL 108           HB       VAL 108  11.356  -0.508   6.215
  923   HG11  VAL 108          HG11      VAL 108  12.053  -1.314   4.040
  924   HG12  VAL 108          HG12      VAL 108  10.893  -0.240   3.257
  925   HG13  VAL 108          HG13      VAL 108  12.253   0.434   4.155
  926   HG21  VAL 108          HG21      VAL 108   9.291   1.134   4.759
  927   HG22  VAL 108          HG22      VAL 108   9.466   0.987   6.508
  928   HG23  VAL 108          HG23      VAL 108  10.727   1.775   5.559
  929    H    THR 109           H        THR 109  10.266  -2.607   7.602
  930    HA   THR 109           HA       THR 109  12.140  -4.500   6.949
  931    HB   THR 109           HB       THR 109   9.956  -4.970   8.980
  932    HG1  THR 109           HG1      THR 109  11.959  -3.884  10.211
  933   HG21  THR 109          HG21      THR 109  11.483  -6.853   8.595
  934   HG22  THR 109          HG22      THR 109  11.729  -6.149  10.194
  935   HG23  THR 109          HG23      THR 109  12.864  -5.796   8.890
  936    H    ASP 110           H        ASP 110   8.603  -4.974   7.029
  937    HA   ASP 110           HA       ASP 110   8.639  -7.639   6.087
  938    HB2  ASP 110           HB2      ASP 110   6.711  -6.504   7.235
  939    HB3  ASP 110           HB3      ASP 110   6.431  -5.587   5.758
  940    H    MET 111           H        MET 111   8.434  -4.514   4.535
  941    HA   MET 111           HA       MET 111   7.977  -5.274   1.895
  942    HB2  MET 111           HB2      MET 111   7.857  -2.963   2.657
  943    HB3  MET 111           HB3      MET 111   9.581  -2.963   2.995
  944    HG2  MET 111           HG2      MET 111   9.890  -3.455   0.512
  945    HG3  MET 111           HG3      MET 111   8.197  -2.995   0.341
  946    HE1  MET 111           HE1      MET 111   7.359  -0.614   1.620
  947    HE2  MET 111           HE2      MET 111   8.440  -0.931   2.975
  948    HE3  MET 111           HE3      MET 111   8.523   0.613   2.133
  949    H    LEU 112           H        LEU 112  11.048  -4.721   3.589
  950    HA   LEU 112           HA       LEU 112  12.698  -5.199   1.355
  951    HB2  LEU 112           HB2      LEU 112  13.126  -4.177   3.795
  952    HB3  LEU 112           HB3      LEU 112  13.744  -5.798   4.062
  953    HG   LEU 112           HG       LEU 112  15.237  -5.480   2.076
  954   HD11  LEU 112          HD11      LEU 112  15.604  -3.167   1.319
  955   HD12  LEU 112          HD12      LEU 112  13.981  -3.749   0.946
  956   HD13  LEU 112          HD13      LEU 112  14.232  -2.648   2.302
  957   HD21  LEU 112          HD21      LEU 112  15.541  -3.516   4.342
  958   HD22  LEU 112          HD22      LEU 112  16.080  -5.196   4.337
  959   HD23  LEU 112          HD23      LEU 112  16.824  -4.028   3.245
  960    H    MET 113           H        MET 113  11.474  -7.284   3.906
  961    HA   MET 113           HA       MET 113  12.849  -9.642   3.352
  962    HB2  MET 113           HB2      MET 113  11.325  -9.327   5.263
  963    HB3  MET 113           HB3      MET 113   9.956  -9.295   4.169
  964    HG2  MET 113           HG2      MET 113  10.452 -11.602   3.496
  965    HG3  MET 113           HG3      MET 113  11.785 -11.635   4.649
  966    HE1  MET 113           HE1      MET 113   8.370  -9.793   5.242
  967    HE2  MET 113           HE2      MET 113   7.896 -11.176   4.253
  968    HE3  MET 113           HE3      MET 113   7.387 -11.081   5.939
  969    H    THR 114           H        THR 114  10.094  -8.166   1.836
  970    HA   THR 114           HA       THR 114   9.533 -10.355   0.074
  971    HB   THR 114           HB       THR 114   8.557  -7.497   0.099
  972    HG1  THR 114           HG1      THR 114   7.928  -8.747   1.926
  973   HG21  THR 114          HG21      THR 114   7.511  -9.882  -1.437
  974   HG22  THR 114          HG22      THR 114   8.308  -8.470  -2.132
  975   HG23  THR 114          HG23      THR 114   6.735  -8.300  -1.350
  976    H    ILE 115           H        ILE 115  11.386  -7.340  -0.104
  977    HA   ILE 115           HA       ILE 115  11.605  -7.379  -2.962
  978    HB   ILE 115           HB       ILE 115  13.163  -5.786  -0.920
  979   HG12  ILE 115          HG12      ILE 115  10.796  -5.001  -2.637
  980   HG13  ILE 115          HG13      ILE 115  10.728  -5.346  -0.911
  981   HG21  ILE 115          HG21      ILE 115  14.361  -5.974  -3.037
  982   HG22  ILE 115          HG22      ILE 115  12.930  -5.422  -3.907
  983   HG23  ILE 115          HG23      ILE 115  13.763  -4.333  -2.798
  984   HD11  ILE 115          HD11      ILE 115  12.200  -3.447  -0.479
  985   HD12  ILE 115          HD12      ILE 115  12.260  -3.103  -2.207
  986   HD13  ILE 115          HD13      ILE 115  10.735  -2.960  -1.332
  987    H    CYS 116           H        CYS 116  13.862  -8.032  -0.273
  988    HA   CYS 116           HA       CYS 116  16.053  -8.608  -1.971
  989    HB2  CYS 116           HB2      CYS 116  15.622  -9.481   0.897
  990    HB3  CYS 116           HB3      CYS 116  17.157  -9.440   0.036
  991    HG   CYS 116           HG       CYS 116  16.366  -6.475  -0.365
  992    H    ALA 117           H        ALA 117  13.410 -10.509  -0.755
  993    HA   ALA 117           HA       ALA 117  14.451 -13.080  -1.292
  994    HB1  ALA 117           HB1      ALA 117  11.577 -12.171  -1.277
  995    HB2  ALA 117           HB2      ALA 117  12.140 -13.840  -1.188
  996    HB3  ALA 117           HB3      ALA 117  12.493 -12.719   0.127
  997    H    ARG 118           H        ARG 118  13.083 -10.609  -3.337
  998    HA   ARG 118           HA       ARG 118  12.428 -12.258  -5.553
  999    HB2  ARG 118           HB2      ARG 118  13.314  -9.361  -5.644
 1000    HB3  ARG 118           HB3      ARG 118  12.441 -10.233  -6.894
 1001    HG2  ARG 118           HG2      ARG 118  11.416  -9.437  -4.183
 1002    HG3  ARG 118           HG3      ARG 118  10.923  -8.804  -5.755
 1003    HD2  ARG 118           HD2      ARG 118  10.533 -11.639  -4.809
 1004    HD3  ARG 118           HD3      ARG 118   9.293 -10.388  -4.834
 1005    HE   ARG 118           HE       ARG 118  10.547 -10.889  -7.391
 1006   HH11  ARG 118          HH11      ARG 118   7.933 -11.759  -5.213
 1007   HH12  ARG 118          HH12      ARG 118   6.927 -12.404  -6.480
 1008   HH21  ARG 118          HH21      ARG 118   9.238 -11.749  -9.041
 1009   HH22  ARG 118          HH22      ARG 118   7.671 -12.402  -8.660
 1010    H    ILE 119           H        ILE 119  15.374 -10.664  -4.479
 1011    HA   ILE 119           HA       ILE 119  16.853 -11.301  -6.856
 1012    HB   ILE 119           HB       ILE 119  18.165 -10.647  -4.244
 1013   HG12  ILE 119          HG12      ILE 119  16.235  -9.122  -4.401
 1014   HG13  ILE 119          HG13      ILE 119  17.761  -8.263  -4.579
 1015   HG21  ILE 119          HG21      ILE 119  19.678  -9.384  -5.712
 1016   HG22  ILE 119          HG22      ILE 119  19.559 -11.081  -6.182
 1017   HG23  ILE 119          HG23      ILE 119  18.694  -9.848  -7.102
 1018   HD11  ILE 119          HD11      ILE 119  15.911  -9.055  -6.816
 1019   HD12  ILE 119          HD12      ILE 119  16.099  -7.437  -6.138
 1020   HD13  ILE 119          HD13      ILE 119  17.441  -8.195  -6.994
 1021    H    GLY 120           H        GLY 120  16.510 -12.559  -3.592
 1022    HA2  GLY 120           HA2      GLY 120  16.695 -15.040  -3.443
 1023    HA3  GLY 120           HA3      GLY 120  18.178 -14.861  -4.368
 1024    H    ILE 121           H        ILE 121  17.564 -12.402  -2.080
 1025    HA   ILE 121           HA       ILE 121  19.827 -13.297  -0.491
 1026    HB   ILE 121           HB       ILE 121  18.167 -10.837   0.029
 1027   HG12  ILE 121          HG12      ILE 121  20.582 -10.992  -1.795
 1028   HG13  ILE 121          HG13      ILE 121  18.923 -10.879  -2.368
 1029   HG21  ILE 121          HG21      ILE 121  20.360 -10.015   0.907
 1030   HG22  ILE 121          HG22      ILE 121  19.675 -11.377   1.793
 1031   HG23  ILE 121          HG23      ILE 121  20.998 -11.637   0.656
 1032   HD11  ILE 121          HD11      ILE 121  20.014  -8.712  -2.442
 1033   HD12  ILE 121          HD12      ILE 121  18.699  -8.699  -1.267
 1034   HD13  ILE 121          HD13      ILE 121  20.371  -8.811  -0.717
 1035    H    THR 122           H        THR 122  19.595 -14.441   1.329
 1036    HA   THR 122           HA       THR 122  16.951 -15.039   2.315
 1037    HB   THR 122           HB       THR 122  19.580 -15.901   3.527
 1038    HG1  THR 122           HG1      THR 122  18.161 -16.832   1.249
 1039   HG21  THR 122          HG21      THR 122  17.593 -16.341   4.888
 1040   HG22  THR 122          HG22      THR 122  18.269 -17.844   4.262
 1041   HG23  THR 122          HG23      THR 122  16.827 -17.152   3.521
 1042    H    ASN 123           H        ASN 123  19.812 -13.343   3.522
 1043    HA   ASN 123           HA       ASN 123  18.307 -12.496   5.880
 1044    HB2  ASN 123           HB2      ASN 123  20.531 -11.634   6.677
 1045    HB3  ASN 123           HB3      ASN 123  20.459 -13.374   6.443
 1046   HD21  ASN 123          HD21      ASN 123  22.803 -11.822   6.580
 1047   HD22  ASN 123          HD22      ASN 123  23.613 -11.949   5.061
 1048    H    HIS 124           H        HIS 124  17.201 -10.709   5.711
 1049    HA   HIS 124           HA       HIS 124  17.952  -8.780   3.620
 1050    HB2  HIS 124           HB2      HIS 124  15.584  -8.085   3.652
 1051    HB3  HIS 124           HB3      HIS 124  15.767  -9.797   3.286
 1052    HD1  HIS 124           HD1      HIS 124  14.283  -7.456   5.755
 1053    HD2  HIS 124           HD2      HIS 124  14.920 -11.543   5.373
 1054    HE1  HIS 124           HE1      HIS 124  12.791  -8.535   7.461
 1055    HE2  HIS 124           HE2      HIS 124  13.361 -10.991   7.364
 1056    H    ASP 125           H        ASP 125  18.022  -9.098   6.953
 1057    HA   ASP 125           HA       ASP 125  17.219  -6.367   7.497
 1058    HB2  ASP 125           HB2      ASP 125  18.177  -8.557   9.350
 1059    HB3  ASP 125           HB3      ASP 125  17.627  -6.966   9.868
 1060    H    GLU 126           H        GLU 126  19.815  -7.685   6.221
 1061    HA   GLU 126           HA       GLU 126  21.871  -6.225   7.647
 1062    HB2  GLU 126           HB2      GLU 126  22.311  -7.459   4.966
 1063    HB3  GLU 126           HB3      GLU 126  23.417  -7.316   6.319
 1064    HG2  GLU 126           HG2      GLU 126  21.092  -9.214   6.103
 1065    HG3  GLU 126           HG3      GLU 126  22.800  -9.620   5.976
 1066    H    TYR 127           H        TYR 127  19.459  -5.448   5.622
 1067    HA   TYR 127           HA       TYR 127  20.990  -3.319   4.287
 1068    HB2  TYR 127           HB2      TYR 127  18.453  -4.634   3.309
 1069    HB3  TYR 127           HB3      TYR 127  19.380  -3.395   2.470
 1070    HD1  TYR 127           HD1      TYR 127  21.837  -3.994   1.924
 1071    HD2  TYR 127           HD2      TYR 127  18.842  -6.859   2.850
 1072    HE1  TYR 127           HE1      TYR 127  23.164  -5.722   0.816
 1073    HE2  TYR 127           HE2      TYR 127  20.156  -8.604   1.746
 1074    HH   TYR 127           HH       TYR 127  21.902  -8.845   0.114
 1075    H    SER 128           H        SER 128  20.126  -1.298   4.201
 1076    HA   SER 128           HA       SER 128  17.649  -0.818   5.719
 1077    HB2  SER 128           HB2      SER 128  19.882   1.133   5.068
 1078    HB3  SER 128           HB3      SER 128  18.473   1.452   6.082
 1079    HG   SER 128           HG       SER 128  19.336  -0.431   7.361
 1080    H    LEU 129           H        LEU 129  16.387   1.112   4.756
 1081    HA   LEU 129           HA       LEU 129  16.478   0.784   1.835
 1082    HB2  LEU 129           HB2      LEU 129  14.371   0.317   3.377
 1083    HB3  LEU 129           HB3      LEU 129  14.169   2.051   3.252
 1084    HG   LEU 129           HG       LEU 129  12.798   0.733   1.638
 1085   HD11  LEU 129          HD11      LEU 129  13.331   3.058   1.172
 1086   HD12  LEU 129          HD12      LEU 129  14.829   2.565   0.382
 1087   HD13  LEU 129          HD13      LEU 129  13.273   2.107  -0.312
 1088   HD21  LEU 129          HD21      LEU 129  14.410  -1.048   1.200
 1089   HD22  LEU 129          HD22      LEU 129  13.871  -0.278  -0.292
 1090   HD23  LEU 129          HD23      LEU 129  15.458   0.103   0.374
 1091    H    VAL 130           H        VAL 130  16.665   2.594   0.522
 1092    HA   VAL 130           HA       VAL 130  16.617   5.210   1.832
 1093    HB   VAL 130           HB       VAL 130  18.947   4.791   1.865
 1094   HG11  VAL 130          HG11      VAL 130  20.214   4.057  -0.088
 1095   HG12  VAL 130          HG12      VAL 130  19.014   2.870   0.423
 1096   HG13  VAL 130          HG13      VAL 130  18.705   3.884  -0.986
 1097   HG21  VAL 130          HG21      VAL 130  19.890   6.408   0.296
 1098   HG22  VAL 130          HG22      VAL 130  18.386   6.395  -0.623
 1099   HG23  VAL 130          HG23      VAL 130  18.405   7.011   1.029
 1100    H    ARG 131           H        ARG 131  15.222   6.414   0.789
 1101    HA   ARG 131           HA       ARG 131  14.521   5.665  -1.963
 1102    HB2  ARG 131           HB2      ARG 131  12.956   7.546  -0.218
 1103    HB3  ARG 131           HB3      ARG 131  12.388   6.569  -1.566
 1104    HG2  ARG 131           HG2      ARG 131  12.784   4.546  -0.167
 1105    HG3  ARG 131           HG3      ARG 131  13.145   5.623   1.185
 1106    HD2  ARG 131           HD2      ARG 131  10.890   5.094   1.464
 1107    HD3  ARG 131           HD3      ARG 131  10.871   6.684   0.701
 1108    HE   ARG 131           HE       ARG 131  10.643   5.203  -1.438
 1109   HH11  ARG 131          HH11      ARG 131   9.068   4.801   1.651
 1110   HH12  ARG 131          HH12      ARG 131   7.740   3.888   1.002
 1111   HH21  ARG 131          HH21      ARG 131   8.888   4.020  -2.311
 1112   HH22  ARG 131          HH22      ARG 131   7.634   3.450  -1.261
 1113    H    GLU 132           H        GLU 132  15.928   6.810  -3.230
 1114    HA   GLU 132           HA       GLU 132  16.285   9.628  -2.799
 1115    HB2  GLU 132           HB2      GLU 132  17.112   7.835  -5.091
 1116    HB3  GLU 132           HB3      GLU 132  17.475   9.553  -5.022
 1117    HG2  GLU 132           HG2      GLU 132  18.642   9.079  -2.826
 1118    HG3  GLU 132           HG3      GLU 132  18.486   7.369  -3.230
 1119    H    LEU 133           H        LEU 133  14.725  11.006  -3.223
 1120    HA   LEU 133           HA       LEU 133  12.796  10.294  -5.314
 1121    HB2  LEU 133           HB2      LEU 133  12.346  12.466  -3.301
 1122    HB3  LEU 133           HB3      LEU 133  11.165  11.559  -4.215
 1123    HG   LEU 133           HG       LEU 133  12.707  10.649  -1.792
 1124   HD11  LEU 133          HD11      LEU 133   9.769  10.902  -2.400
 1125   HD12  LEU 133          HD12      LEU 133  10.461  10.295  -0.893
 1126   HD13  LEU 133          HD13      LEU 133  10.720  11.973  -1.371
 1127   HD21  LEU 133          HD21      LEU 133  11.621   8.478  -2.030
 1128   HD22  LEU 133          HD22      LEU 133  10.949   8.979  -3.582
 1129   HD23  LEU 133          HD23      LEU 133  12.693   8.806  -3.392
 1130    H    MET 134           H        MET 134  11.667  12.466  -6.052
 1131    HA   MET 134           HA       MET 134  13.779  14.300  -6.991
 1132    HB2  MET 134           HB2      MET 134  11.932  14.778  -8.794
 1133    HB3  MET 134           HB3      MET 134  12.961  13.359  -8.948
 1134    HG2  MET 134           HG2      MET 134  11.229  11.990  -8.825
 1135    HG3  MET 134           HG3      MET 134  10.642  12.763  -7.357
 1136    HE1  MET 134           HE1      MET 134   8.148  15.397  -8.588
 1137    HE2  MET 134           HE2      MET 134   8.743  14.442  -7.228
 1138    HE3  MET 134           HE3      MET 134   9.801  15.616  -8.011
 1139    H    GLU 135           H        GLU 135  12.294  14.401  -4.498
 1140    HA   GLU 135           HA       GLU 135   9.981  15.914  -4.571
 1141    HB2  GLU 135           HB2      GLU 135  12.059  15.444  -2.484
 1142    HB3  GLU 135           HB3      GLU 135  10.700  16.517  -2.174
 1143    HG2  GLU 135           HG2      GLU 135   9.210  14.587  -2.820
 1144    HG3  GLU 135           HG3      GLU 135  10.661  13.579  -2.754
 1145    H    GLU 136           H        GLU 136   9.491  17.953  -4.644
 1146    HA   GLU 136           HA       GLU 136  11.516  20.028  -4.749
 1147    HB2  GLU 136           HB2      GLU 136   9.696  21.517  -5.219
 1148    HB3  GLU 136           HB3      GLU 136   9.391  20.038  -6.124
 1149    HG2  GLU 136           HG2      GLU 136   7.724  19.329  -4.585
 1150    HG3  GLU 136           HG3      GLU 136   8.169  20.591  -3.437
 1151    H    LYS 137           H        LYS 137   9.427  18.485  -2.518
 1152    HA   LYS 137           HA       LYS 137   9.293  20.627  -0.610
 1153    HB2  LYS 137           HB2      LYS 137   8.505  17.746  -0.190
 1154    HB3  LYS 137           HB3      LYS 137   7.899  19.165   0.654
 1155    HG2  LYS 137           HG2      LYS 137   6.845  19.935  -1.408
 1156    HG3  LYS 137           HG3      LYS 137   7.441  18.513  -2.248
 1157    HD2  LYS 137           HD2      LYS 137   6.172  17.083  -0.704
 1158    HD3  LYS 137           HD3      LYS 137   5.520  18.530   0.071
 1159    HE2  LYS 137           HE2      LYS 137   5.241  18.067  -2.875
 1160    HE3  LYS 137           HE3      LYS 137   4.102  17.370  -1.732
 1161    HZ1  LYS 137           HZ1      LYS 137   3.237  19.435  -2.509
 1162    HZ2  LYS 137           HZ2      LYS 137   4.678  20.252  -2.145
 1163    HZ3  LYS 137           HZ3      LYS 137   3.709  19.654  -0.891
 1164    H    LYS 138           H        LYS 138  10.095  17.278   0.198
 1165    HA   LYS 138           HA       LYS 138  11.947  18.109   2.204
 1166    HB2  LYS 138           HB2      LYS 138  11.525  15.362   1.010
 1167    HB3  LYS 138           HB3      LYS 138  12.447  15.709   2.464
 1168    HG2  LYS 138           HG2      LYS 138  10.303  16.654   3.423
 1169    HG3  LYS 138           HG3      LYS 138   9.494  15.918   2.035
 1170    HD2  LYS 138           HD2      LYS 138  11.327  14.318   3.774
 1171    HD3  LYS 138           HD3      LYS 138   9.646  14.575   4.242
 1172    HE2  LYS 138           HE2      LYS 138  10.665  13.248   1.733
 1173    HE3  LYS 138           HE3      LYS 138   9.854  12.460   3.090
 1174    HZ1  LYS 138           HZ1      LYS 138   7.901  13.935   2.562
 1175    HZ2  LYS 138           HZ2      LYS 138   8.253  12.746   1.411
 1176    HZ3  LYS 138           HZ3      LYS 138   8.695  14.351   1.117
 1177    H    ASP 169           H        ASP 169  12.321  16.223  -0.746
 1178    HA   ASP 169           HA       ASP 169  14.068  15.634  -1.986
 1179    HB2  ASP 169           HB2      ASP 169  14.178  17.993  -2.598
 1180    HB3  ASP 169           HB3      ASP 169  15.151  18.339  -1.172
 1181    H    GLU 170           H        GLU 170  14.513  13.946  -0.723
 1182    HA   GLU 170           HA       GLU 170  16.863  14.203   0.992
 1183    HB2  GLU 170           HB2      GLU 170  14.169  13.770   1.886
 1184    HB3  GLU 170           HB3      GLU 170  15.131  12.345   2.233
 1185    HG2  GLU 170           HG2      GLU 170  15.680  15.162   3.121
 1186    HG3  GLU 170           HG3      GLU 170  15.176  13.804   4.125
 1187    H    LEU 171           H        LEU 171  17.743  12.100   1.607
 1188    HA   LEU 171           HA       LEU 171  17.754  10.227  -0.593
 1189    HB2  LEU 171           HB2      LEU 171  19.064   9.958   2.115
 1190    HB3  LEU 171           HB3      LEU 171  19.458   9.066   0.657
 1191    HG   LEU 171           HG       LEU 171  19.925  11.997   1.150
 1192   HD11  LEU 171          HD11      LEU 171  22.285  11.391   0.985
 1193   HD12  LEU 171          HD12      LEU 171  21.491  10.540   2.309
 1194   HD13  LEU 171          HD13      LEU 171  21.837   9.695   0.801
 1195   HD21  LEU 171          HD21      LEU 171  21.034  11.968  -1.049
 1196   HD22  LEU 171          HD22      LEU 171  20.465  10.313  -1.291
 1197   HD23  LEU 171          HD23      LEU 171  19.303  11.638  -1.161
 1198    H    ASN 172           H        ASN 172  16.194  10.720   2.377
 1199    HA   ASN 172           HA       ASN 172  14.712   9.556   3.625
 1200    HB2  ASN 172           HB2      ASN 172  14.074   8.548   0.860
 1201    HB3  ASN 172           HB3      ASN 172  13.117   8.108   2.259
 1202   HD21  ASN 172          HD21      ASN 172  13.760  10.431  -0.101
 1203   HD22  ASN 172          HD22      ASN 172  12.634  11.640   0.426
 1204    H    TRP 173           H        TRP 173  16.507   8.395   4.709
 1205    HA   TRP 173           HA       TRP 173  17.008   5.689   3.789
 1206    HB2  TRP 173           HB2      TRP 173  18.114   7.427   5.985
 1207    HB3  TRP 173           HB3      TRP 173  18.394   5.690   5.982
 1208    HD1  TRP 173           HD1      TRP 173  19.054   8.755   3.694
 1209    HE1  TRP 173           HE1      TRP 173  21.247   8.330   2.436
 1210    HE3  TRP 173           HE3      TRP 173  20.035   4.027   5.359
 1211    HZ2  TRP 173           HZ2      TRP 173  23.155   6.266   2.183
 1212    HZ3  TRP 173           HZ3      TRP 173  22.071   2.897   4.564
 1213    HH2  TRP 173           HH2      TRP 173  23.597   3.996   3.008
 1214    H    LEU 174           H        LEU 174  15.357   4.359   4.235
 1215    HA   LEU 174           HA       LEU 174  13.408   5.045   6.183
 1216    HB2  LEU 174           HB2      LEU 174  13.728   2.521   4.581
 1217    HB3  LEU 174           HB3      LEU 174  12.362   2.882   5.616
 1218    HG   LEU 174           HG       LEU 174  13.092   4.080   2.985
 1219   HD11  LEU 174          HD11      LEU 174  10.622   3.729   2.688
 1220   HD12  LEU 174          HD12      LEU 174  11.565   2.258   2.941
 1221   HD13  LEU 174          HD13      LEU 174  10.622   2.939   4.269
 1222   HD21  LEU 174          HD21      LEU 174  12.854   6.007   4.450
 1223   HD22  LEU 174          HD22      LEU 174  11.452   5.874   3.386
 1224   HD23  LEU 174          HD23      LEU 174  11.334   5.366   5.072
 1225    H    ASP 175           H        ASP 175  13.360   4.696   8.146
 1226    HA   ASP 175           HA       ASP 175  15.189   3.220   9.696
 1227    HB2  ASP 175           HB2      ASP 175  13.475   3.725  11.515
 1228    HB3  ASP 175           HB3      ASP 175  14.121   5.121  10.653
 1229    H    HIS 176           H        HIS 176  12.427   2.301   7.981
 1230    HA   HIS 176           HA       HIS 176  11.607   0.243   7.531
 1231    HB2  HIS 176           HB2      HIS 176  13.567  -0.599   9.628
 1232    HB3  HIS 176           HB3      HIS 176  12.350  -1.732   9.051
 1233    HD1  HIS 176           HD1      HIS 176  12.528  -2.503   6.583
 1234    HD2  HIS 176           HD2      HIS 176  15.659  -0.094   7.854
 1235    HE1  HIS 176           HE1      HIS 176  14.260  -2.657   4.782
 1236    HE2  HIS 176           HE2      HIS 176  16.267  -1.478   5.754
 1237    H    GLY 177           H        GLY 177  10.781   2.157   9.867
 1238    HA2  GLY 177           HA2      GLY 177   8.826   0.249  11.020
 1239    HA3  GLY 177           HA3      GLY 177   9.558   1.538  11.964
 1240    H    ARG 178           H        ARG 178   9.431   3.537   9.975
 1241    HA   ARG 178           HA       ARG 178   6.713   4.379  10.330
 1242    HB2  ARG 178           HB2      ARG 178   8.425   6.027  10.528
 1243    HB3  ARG 178           HB3      ARG 178   9.105   5.601   8.966
 1244    HG2  ARG 178           HG2      ARG 178   7.118   6.477   7.855
 1245    HG3  ARG 178           HG3      ARG 178   6.429   6.902   9.427
 1246    HD2  ARG 178           HD2      ARG 178   7.542   8.795   8.216
 1247    HD3  ARG 178           HD3      ARG 178   8.154   8.490   9.842
 1248    HE   ARG 178           HE       ARG 178   9.888   7.084   8.450
 1249   HH11  ARG 178          HH11      ARG 178   8.607  10.277   7.806
 1250   HH12  ARG 178          HH12      ARG 178  10.021  10.810   6.940
 1251   HH21  ARG 178          HH21      ARG 178  11.750   7.777   7.321
 1252   HH22  ARG 178          HH22      ARG 178  11.799   9.378   6.640
 1253    H    THR 179           H        THR 179   5.072   4.281   8.949
 1254    HA   THR 179           HA       THR 179   5.190   2.691   6.632
 1255    HB   THR 179           HB       THR 179   3.127   2.916   7.883
 1256    HG1  THR 179           HG1      THR 179   2.536   2.367   5.890
 1257   HG21  THR 179          HG21      THR 179   3.060   5.771   6.908
 1258   HG22  THR 179          HG22      THR 179   3.350   5.256   8.571
 1259   HG23  THR 179          HG23      THR 179   1.784   4.957   7.814
 1260    H    LEU 180           H        LEU 180   4.265   3.507   4.493
 1261    HA   LEU 180           HA       LEU 180   6.427   5.104   3.500
 1262    HB2  LEU 180           HB2      LEU 180   4.161   4.016   1.866
 1263    HB3  LEU 180           HB3      LEU 180   5.832   4.274   1.393
 1264    HG   LEU 180           HG       LEU 180   4.834   2.151   3.295
 1265   HD11  LEU 180          HD11      LEU 180   4.290   1.668   0.989
 1266   HD12  LEU 180          HD12      LEU 180   5.969   1.942   0.517
 1267   HD13  LEU 180          HD13      LEU 180   5.559   0.590   1.573
 1268   HD21  LEU 180          HD21      LEU 180   7.136   1.336   3.295
 1269   HD22  LEU 180          HD22      LEU 180   7.628   2.727   2.322
 1270   HD23  LEU 180          HD23      LEU 180   7.021   2.968   3.963
 1271    H    ARG 181           H        ARG 181   2.899   5.387   3.545
 1272    HA   ARG 181           HA       ARG 181   2.669   7.796   2.140
 1273    HB2  ARG 181           HB2      ARG 181   1.002   6.427   4.213
 1274    HB3  ARG 181           HB3      ARG 181   0.575   8.048   3.683
 1275    HG2  ARG 181           HG2      ARG 181   0.184   7.335   1.480
 1276    HG3  ARG 181           HG3      ARG 181   0.979   5.783   1.760
 1277    HD2  ARG 181           HD2      ARG 181  -1.495   6.652   3.232
 1278    HD3  ARG 181           HD3      ARG 181  -1.539   5.746   1.718
 1279    HE   ARG 181           HE       ARG 181  -0.340   3.956   2.849
 1280   HH11  ARG 181          HH11      ARG 181  -1.937   6.350   4.878
 1281   HH12  ARG 181          HH12      ARG 181  -2.005   5.303   6.265
 1282   HH21  ARG 181          HH21      ARG 181  -0.456   2.594   4.663
 1283   HH22  ARG 181          HH22      ARG 181  -1.211   3.153   6.127
 1284    H    GLU 182           H        GLU 182   3.508   7.124   5.455
 1285    HA   GLU 182           HA       GLU 182   3.068   9.785   6.407
 1286    HB2  GLU 182           HB2      GLU 182   3.100   7.550   7.729
 1287    HB3  GLU 182           HB3      GLU 182   4.846   7.765   7.747
 1288    HG2  GLU 182           HG2      GLU 182   3.840   8.601   9.781
 1289    HG3  GLU 182           HG3      GLU 182   4.576   9.913   8.857
 1290    H    GLN 183           H        GLN 183   5.606   8.100   4.840
 1291    HA   GLN 183           HA       GLN 183   7.752   9.836   5.545
 1292    HB2  GLN 183           HB2      GLN 183   7.386   7.977   3.193
 1293    HB3  GLN 183           HB3      GLN 183   8.891   8.796   3.599
 1294    HG2  GLN 183           HG2      GLN 183   9.199   7.524   5.525
 1295    HG3  GLN 183           HG3      GLN 183   7.512   7.015   5.571
 1296   HE21  GLN 183          HE21      GLN 183   8.131   4.842   5.708
 1297   HE22  GLN 183          HE22      GLN 183   8.752   3.991   4.336
 1298    H    GLY 184           H        GLY 184   5.172   9.894   3.238
 1299    HA2  GLY 184           HA2      GLY 184   4.464  11.617   1.865
 1300    HA3  GLY 184           HA3      GLY 184   5.834  12.571   2.419
 1301    H    VAL 185           H        VAL 185   6.175   9.366   1.100
 1302    HA   VAL 185           HA       VAL 185   7.764  10.443  -1.092
 1303    HB   VAL 185           HB       VAL 185   8.506   8.159  -1.451
 1304   HG11  VAL 185          HG11      VAL 185   8.469   8.848   1.487
 1305   HG12  VAL 185          HG12      VAL 185   9.591   7.738   0.699
 1306   HG13  VAL 185          HG13      VAL 185   9.622   9.454   0.294
 1307   HG21  VAL 185          HG21      VAL 185   7.706   6.315  -0.053
 1308   HG22  VAL 185          HG22      VAL 185   6.535   7.397   0.704
 1309   HG23  VAL 185          HG23      VAL 185   6.397   7.009  -1.011
 1310    H    GLU 186           H        GLU 186   7.516   9.397  -3.266
 1311    HA   GLU 186           HA       GLU 186   4.686   8.993  -3.908
 1312    HB2  GLU 186           HB2      GLU 186   6.997  10.101  -5.466
 1313    HB3  GLU 186           HB3      GLU 186   5.637   9.383  -6.315
 1314    HG2  GLU 186           HG2      GLU 186   5.305  11.552  -4.282
 1315    HG3  GLU 186           HG3      GLU 186   5.598  11.882  -5.986
 1316    H    GLU 187           H        GLU 187   4.485   7.618  -5.990
 1317    HA   GLU 187           HA       GLU 187   5.687   5.046  -5.323
 1318    HB2  GLU 187           HB2      GLU 187   3.389   5.874  -7.086
 1319    HB3  GLU 187           HB3      GLU 187   3.950   4.212  -6.951
 1320    HG2  GLU 187           HG2      GLU 187   3.265   4.037  -4.729
 1321    HG3  GLU 187           HG3      GLU 187   3.149   5.784  -4.532
 1322    H    HIS 188           H        HIS 188   5.956   7.559  -7.605
 1323    HA   HIS 188           HA       HIS 188   7.083   5.912  -9.699
 1324    HB2  HIS 188           HB2      HIS 188   7.408   8.048 -10.902
 1325    HB3  HIS 188           HB3      HIS 188   5.755   7.847 -10.339
 1326    HD1  HIS 188           HD1      HIS 188   4.812   9.929  -9.360
 1327    HD2  HIS 188           HD2      HIS 188   8.928   9.712  -8.851
 1328    HE1  HIS 188           HE1      HIS 188   5.475  12.051  -8.190
 1329    HE2  HIS 188           HE2      HIS 188   7.921  11.765  -7.687
 1330    H    GLU 189           H        GLU 189   8.277   7.041  -6.842
 1331    HA   GLU 189           HA       GLU 189  10.783   8.158  -7.674
 1332    HB2  GLU 189           HB2      GLU 189   9.967   7.115  -4.961
 1333    HB3  GLU 189           HB3      GLU 189  11.306   8.199  -5.304
 1334    HG2  GLU 189           HG2      GLU 189   8.405   8.852  -5.754
 1335    HG3  GLU 189           HG3      GLU 189   9.345   9.335  -4.345
 1336    H    THR 190           H        THR 190  12.847   7.201  -7.691
 1337    HA   THR 190           HA       THR 190  12.943   4.315  -7.640
 1338    HB   THR 190           HB       THR 190  15.255   6.241  -7.961
 1339    HG1  THR 190           HG1      THR 190  13.959   6.711  -9.656
 1340   HG21  THR 190          HG21      THR 190  16.326   4.352  -9.129
 1341   HG22  THR 190          HG22      THR 190  14.923   3.345  -8.779
 1342   HG23  THR 190          HG23      THR 190  15.934   3.933  -7.461
 1343    H    LEU 191           H        LEU 191  13.677   3.050  -6.048
 1344    HA   LEU 191           HA       LEU 191  14.713   4.382  -3.625
 1345    HB2  LEU 191           HB2      LEU 191  13.157   1.799  -3.597
 1346    HB3  LEU 191           HB3      LEU 191  13.556   2.831  -2.243
 1347    HG   LEU 191           HG       LEU 191  11.300   3.213  -2.493
 1348   HD11  LEU 191          HD11      LEU 191  12.541   5.311  -4.252
 1349   HD12  LEU 191          HD12      LEU 191  10.964   5.421  -3.473
 1350   HD13  LEU 191          HD13      LEU 191  12.430   5.348  -2.493
 1351   HD21  LEU 191          HD21      LEU 191  11.649   3.198  -5.482
 1352   HD22  LEU 191          HD22      LEU 191  10.967   1.903  -4.499
 1353   HD23  LEU 191          HD23      LEU 191  10.130   3.450  -4.625
 1354    H    LEU 192           H        LEU 192  16.388   3.240  -2.484
 1355    HA   LEU 192           HA       LEU 192  17.542   0.989  -4.003
 1356    HB2  LEU 192           HB2      LEU 192  19.348   2.673  -2.386
 1357    HB3  LEU 192           HB3      LEU 192  19.611   1.936  -3.954
 1358    HG   LEU 192           HG       LEU 192  17.825   4.332  -3.699
 1359   HD11  LEU 192          HD11      LEU 192  19.742   5.770  -4.098
 1360   HD12  LEU 192          HD12      LEU 192  19.918   4.906  -2.571
 1361   HD13  LEU 192          HD13      LEU 192  20.825   4.380  -3.991
 1362   HD21  LEU 192          HD21      LEU 192  17.842   3.108  -5.812
 1363   HD22  LEU 192          HD22      LEU 192  18.563   4.708  -5.998
 1364   HD23  LEU 192          HD23      LEU 192  19.596   3.281  -5.905
 1365    H    LEU 193           H        LEU 193  18.524  -0.659  -2.691
 1366    HA   LEU 193           HA       LEU 193  18.112  -0.299   0.183
 1367    HB2  LEU 193           HB2      LEU 193  18.506  -2.681   0.436
 1368    HB3  LEU 193           HB3      LEU 193  17.220  -2.377  -0.710
 1369    HG   LEU 193           HG       LEU 193  19.242  -2.631  -2.439
 1370   HD11  LEU 193          HD11      LEU 193  20.682  -4.494  -1.733
 1371   HD12  LEU 193          HD12      LEU 193  20.956  -3.032  -0.780
 1372   HD13  LEU 193          HD13      LEU 193  20.020  -4.367  -0.103
 1373   HD21  LEU 193          HD21      LEU 193  17.725  -4.876  -1.131
 1374   HD22  LEU 193          HD22      LEU 193  17.169  -3.880  -2.479
 1375   HD23  LEU 193          HD23      LEU 193  18.541  -4.969  -2.693
 1376    H    ARG 194           H        ARG 194  19.779  -0.458   1.626
 1377    HA   ARG 194           HA       ARG 194  22.467  -0.223   0.459
 1378    HB2  ARG 194           HB2      ARG 194  21.122   1.470   2.547
 1379    HB3  ARG 194           HB3      ARG 194  22.873   1.358   2.458
 1380    HG2  ARG 194           HG2      ARG 194  21.127   2.225   0.168
 1381    HG3  ARG 194           HG3      ARG 194  21.885   3.334   1.313
 1382    HD2  ARG 194           HD2      ARG 194  23.238   1.470  -0.626
 1383    HD3  ARG 194           HD3      ARG 194  23.271   3.238  -0.616
 1384    HE   ARG 194           HE       ARG 194  24.307   2.187   1.817
 1385   HH11  ARG 194          HH11      ARG 194  25.141   2.725  -1.539
 1386   HH12  ARG 194          HH12      ARG 194  26.852   2.721  -1.250
 1387   HH21  ARG 194          HH21      ARG 194  26.534   2.216   2.220
 1388   HH22  ARG 194          HH22      ARG 194  27.651   2.441   0.907
 1389    H    ARG 195           H        ARG 195  23.868  -1.595   1.263
 1390    HA   ARG 195           HA       ARG 195  23.139  -3.421   3.318
 1391    HB2  ARG 195           HB2      ARG 195  24.851  -3.564   1.287
 1392    HB3  ARG 195           HB3      ARG 195  25.984  -3.043   2.525
 1393    HG2  ARG 195           HG2      ARG 195  25.277  -4.968   3.912
 1394    HG3  ARG 195           HG3      ARG 195  24.273  -5.514   2.565
 1395    HD2  ARG 195           HD2      ARG 195  26.434  -5.348   1.182
 1396    HD3  ARG 195           HD3      ARG 195  27.253  -5.321   2.741
 1397    HE   ARG 195           HE       ARG 195  25.556  -7.495   2.820
 1398   HH11  ARG 195          HH11      ARG 195  28.284  -6.374   0.930
 1399   HH12  ARG 195          HH12      ARG 195  28.798  -7.967   0.459
 1400   HH21  ARG 195          HH21      ARG 195  26.197  -9.635   2.123
 1401   HH22  ARG 195          HH22      ARG 195  27.606  -9.805   1.123
 1402    H    LYS 196           H        LYS 196  22.830  -2.530   5.304
 1403    HA   LYS 196           HA       LYS 196  24.682  -0.576   6.361
 1404    HB2  LYS 196           HB2      LYS 196  22.224  -0.510   6.857
 1405    HB3  LYS 196           HB3      LYS 196  22.418  -1.988   7.791
 1406    HG2  LYS 196           HG2      LYS 196  23.811  -0.890   9.384
 1407    HG3  LYS 196           HG3      LYS 196  23.908   0.559   8.382
 1408    HD2  LYS 196           HD2      LYS 196  22.361   0.961  10.176
 1409    HD3  LYS 196           HD3      LYS 196  21.458   0.853   8.664
 1410    HE2  LYS 196           HE2      LYS 196  20.883  -1.477   9.198
 1411    HE3  LYS 196           HE3      LYS 196  21.757  -1.332  10.722
 1412    HZ1  LYS 196           HZ1      LYS 196  20.213   0.520  11.292
 1413    HZ2  LYS 196           HZ2      LYS 196  19.467  -0.998  11.166
 1414    HZ3  LYS 196           HZ3      LYS 196  19.303   0.132   9.912
 1415    H    PHE 197           H        PHE 197  23.886  -3.979   6.813
 1416    HA   PHE 197           HA       PHE 197  26.390  -4.258   8.340
 1417    HB2  PHE 197           HB2      PHE 197  24.239  -6.361   8.113
 1418    HB3  PHE 197           HB3      PHE 197  25.602  -6.317   9.225
 1419    HD1  PHE 197           HD1      PHE 197  25.517  -3.803  10.532
 1420    HD2  PHE 197           HD2      PHE 197  22.271  -6.198   9.200
 1421    HE1  PHE 197           HE1      PHE 197  24.056  -2.763  12.219
 1422    HE2  PHE 197           HE2      PHE 197  20.799  -5.171  10.863
 1423    HZ   PHE 197           HZ       PHE 197  21.693  -3.445  12.388
 1424    H    PHE 198           H        PHE 198  27.933  -5.645   7.591
 1425    HA   PHE 198           HA       PHE 198  27.541  -6.508   4.812
 1426    HB2  PHE 198           HB2      PHE 198  30.103  -6.098   6.371
 1427    HB3  PHE 198           HB3      PHE 198  30.012  -6.600   4.686
 1428    HD1  PHE 198           HD1      PHE 198  29.293  -5.023   2.956
 1429    HD2  PHE 198           HD2      PHE 198  29.733  -3.828   7.017
 1430    HE1  PHE 198           HE1      PHE 198  29.274  -2.664   2.259
 1431    HE2  PHE 198           HE2      PHE 198  29.715  -1.467   6.327
 1432    HZ   PHE 198           HZ       PHE 198  29.474  -0.887   3.929
 1433    H    TYR 199           H        TYR 199  27.642  -7.539   7.898
 1434    HA   TYR 199           HA       TYR 199  28.075  -9.380   9.107
 1435    HB2  TYR 199           HB2      TYR 199  26.914 -11.440   8.221
 1436    HB3  TYR 199           HB3      TYR 199  25.942  -9.989   8.407
 1437    HD1  TYR 199           HD1      TYR 199  25.161  -8.765   6.452
 1438    HD2  TYR 199           HD2      TYR 199  27.311 -12.411   6.053
 1439    HE1  TYR 199           HE1      TYR 199  24.379  -8.961   4.130
 1440    HE2  TYR 199           HE2      TYR 199  26.535 -12.619   3.724
 1441    HH   TYR 199           HH       TYR 199  24.607 -11.780   2.326
 1442    H    SER 200           H        SER 200  29.884  -9.157   6.346
 1443    HA   SER 200           HA       SER 200  31.772 -10.157   5.599
 1444    HB2  SER 200           HB2      SER 200  31.905 -11.002   8.496
 1445    HB3  SER 200           HB3      SER 200  33.244 -11.125   7.355
 1446    HG   SER 200           HG       SER 200  33.013  -8.823   7.049
 1447    H    ASP 201           H        ASP 201  29.344 -11.637   5.298
 1448    HA   ASP 201           HA       ASP 201  28.527 -13.661   4.684
 1449    HB2  ASP 201           HB2      ASP 201  30.494 -13.497   3.162
 1450    HB3  ASP 201           HB3      ASP 201  31.443 -14.383   4.344
 1451    H    GLN 202           H        GLN 202  29.344 -13.152   7.520
 1452    HA   GLN 202           HA       GLN 202  29.903 -15.831   8.505
 1453    HB2  GLN 202           HB2      GLN 202  31.024 -13.929   9.580
 1454    HB3  GLN 202           HB3      GLN 202  29.464 -13.226   9.983
 1455    HG2  GLN 202           HG2      GLN 202  30.428 -14.292  11.919
 1456    HG3  GLN 202           HG3      GLN 202  28.973 -15.150  11.414
 1457   HE21  GLN 202          HE21      GLN 202  29.166 -17.191  10.484
 1458   HE22  GLN 202          HE22      GLN 202  30.612 -18.135  10.624
  Start of MODEL   17
    1    H1   GLY  -5           H1       GLY  -5 -33.298 -15.723  -2.293
    2    H2   GLY  -5           H2       GLY  -5 -34.556 -15.174  -3.288
    3    H3   GLY  -5           H3       GLY  -5 -34.894 -16.221  -1.995
    4    HA2  GLY  -5           HA2      GLY  -5 -35.539 -13.983  -1.427
    5    HA3  GLY  -5           HA3      GLY  -5 -34.209 -14.531  -0.415
    6    H    ILE  -4           H        ILE  -4 -34.150 -12.082  -0.191
    7    HA   ILE  -4           HA       ILE  -4 -32.010 -11.123  -1.896
    8    HB   ILE  -4           HB       ILE  -4 -33.907 -10.302  -3.142
    9   HG12  ILE  -4          HG12      ILE  -4 -32.682  -8.090  -1.478
   10   HG13  ILE  -4          HG13      ILE  -4 -31.981  -8.797  -2.929
   11   HG21  ILE  -4          HG21      ILE  -4 -34.875  -9.092  -0.557
   12   HG22  ILE  -4          HG22      ILE  -4 -35.593  -8.822  -2.145
   13   HG23  ILE  -4          HG23      ILE  -4 -35.615 -10.434  -1.430
   14   HD11  ILE  -4          HD11      ILE  -4 -33.009  -6.649  -3.395
   15   HD12  ILE  -4          HD12      ILE  -4 -33.846  -7.947  -4.247
   16   HD13  ILE  -4          HD13      ILE  -4 -34.555  -7.245  -2.793
   17    H    ASP  -3           H        ASP  -3 -30.555 -10.066  -0.702
   18    HA   ASP  -3           HA       ASP  -3 -31.296  -9.307   2.019
   19    HB2  ASP  -3           HB2      ASP  -3 -28.862  -9.085   2.408
   20    HB3  ASP  -3           HB3      ASP  -3 -29.303 -10.684   1.825
   21    HA   PRO  -2           HA       PRO  -2 -31.544  -5.178   0.383
   22    HB2  PRO  -2           HB2      PRO  -2 -33.046  -4.148   2.335
   23    HB3  PRO  -2           HB3      PRO  -2 -33.712  -5.314   1.186
   24    HG2  PRO  -2           HG2      PRO  -2 -32.838  -5.719   4.007
   25    HG3  PRO  -2           HG3      PRO  -2 -34.202  -6.444   3.139
   26    HD2  PRO  -2           HD2      PRO  -2 -31.720  -7.648   3.585
   27    HD3  PRO  -2           HD3      PRO  -2 -32.925  -8.169   2.390
   28    H    PHE  -1           H        PHE  -1 -31.018  -3.007   1.119
   29    HA   PHE  -1           HA       PHE  -1 -29.036  -2.955   3.277
   30    HB2  PHE  -1           HB2      PHE  -1 -29.081  -1.506   0.631
   31    HB3  PHE  -1           HB3      PHE  -1 -28.087  -0.970   1.977
   32    HD1  PHE  -1           HD1      PHE  -1 -26.745  -3.075   3.085
   33    HD2  PHE  -1           HD2      PHE  -1 -27.996  -2.707  -0.963
   34    HE1  PHE  -1           HE1      PHE  -1 -24.985  -4.654   2.402
   35    HE2  PHE  -1           HE2      PHE  -1 -26.241  -4.287  -1.655
   36    HZ   PHE  -1           HZ       PHE  -1 -24.723  -5.267   0.061
   37    H    THR   0           H        THR   0 -30.532  -2.453   4.770
   38    HA   THR   0           HA       THR   0 -32.333  -0.270   4.580
   39    HB   THR   0           HB       THR   0 -32.535  -0.559   7.071
   40    HG1  THR   0           HG1      THR   0 -30.764  -2.764   6.648
   41   HG21  THR   0          HG21      THR   0 -32.777  -3.061   5.395
   42   HG22  THR   0          HG22      THR   0 -33.987  -1.786   5.536
   43   HG23  THR   0          HG23      THR   0 -33.582  -2.777   6.938
   44    H    MET   1           H        MET   1 -31.777   0.962   7.195
   45    HA   MET   1           HA       MET   1 -30.000   2.964   6.136
   46    HB2  MET   1           HB2      MET   1 -32.189   3.418   7.379
   47    HB3  MET   1           HB3      MET   1 -31.297   3.045   8.845
   48    HG2  MET   1           HG2      MET   1 -31.308   5.391   8.634
   49    HG3  MET   1           HG3      MET   1 -29.684   4.857   8.215
   50    HE1  MET   1           HE1      MET   1 -29.222   5.798   4.574
   51    HE2  MET   1           HE2      MET   1 -28.498   5.338   6.113
   52    HE3  MET   1           HE3      MET   1 -29.447   4.167   5.196
   53    H    VAL   2           H        VAL   2 -28.786   0.601   6.639
   54    HA   VAL   2           HA       VAL   2 -26.644   1.475   8.386
   55    HB   VAL   2           HB       VAL   2 -26.312  -0.884   9.200
   56   HG11  VAL   2          HG11      VAL   2 -28.885   0.451  10.031
   57   HG12  VAL   2          HG12      VAL   2 -28.030  -0.785  10.953
   58   HG13  VAL   2          HG13      VAL   2 -27.276   0.785  10.672
   59   HG21  VAL   2          HG21      VAL   2 -27.645  -2.035   7.509
   60   HG22  VAL   2          HG22      VAL   2 -28.202  -2.433   9.136
   61   HG23  VAL   2          HG23      VAL   2 -29.111  -1.290   8.147
   62    H    ALA   3           H        ALA   3 -26.588   1.892   5.835
   63    HA   ALA   3           HA       ALA   3 -24.575   0.042   4.874
   64    HB1  ALA   3           HB1      ALA   3 -27.083   0.547   3.292
   65    HB2  ALA   3           HB2      ALA   3 -25.632  -0.243   2.679
   66    HB3  ALA   3           HB3      ALA   3 -26.559  -0.991   3.979
   67    H    LEU   4           H        LEU   4 -23.366   1.963   5.298
   68    HA   LEU   4           HA       LEU   4 -23.252   4.306   4.125
   69    HB2  LEU   4           HB2      LEU   4 -20.958   2.365   3.951
   70    HB3  LEU   4           HB3      LEU   4 -20.861   4.114   4.022
   71    HG   LEU   4           HG       LEU   4 -21.789   2.298   6.248
   72   HD11  LEU   4          HD11      LEU   4 -19.396   2.207   5.880
   73   HD12  LEU   4          HD12      LEU   4 -19.305   3.967   5.947
   74   HD13  LEU   4          HD13      LEU   4 -19.769   3.052   7.381
   75   HD21  LEU   4          HD21      LEU   4 -21.748   4.399   7.591
   76   HD22  LEU   4          HD22      LEU   4 -21.577   5.295   6.082
   77   HD23  LEU   4          HD23      LEU   4 -23.025   4.334   6.377
   78    H    SER   5           H        SER   5 -23.279   5.180   2.248
   79    HA   SER   5           HA       SER   5 -23.154   3.529  -0.170
   80    HB2  SER   5           HB2      SER   5 -23.987   6.430   0.142
   81    HB3  SER   5           HB3      SER   5 -24.095   5.477  -1.332
   82    HG   SER   5           HG       SER   5 -25.424   4.864   1.100
   83    H    LEU   6           H        LEU   6 -21.138   3.288  -0.946
   84    HA   LEU   6           HA       LEU   6 -19.239   5.480  -0.422
   85    HB2  LEU   6           HB2      LEU   6 -18.613   2.530  -0.576
   86    HB3  LEU   6           HB3      LEU   6 -17.502   3.821  -0.144
   87    HG   LEU   6           HG       LEU   6 -19.873   2.890   1.479
   88   HD11  LEU   6          HD11      LEU   6 -16.911   2.675   1.993
   89   HD12  LEU   6          HD12      LEU   6 -18.197   2.153   3.083
   90   HD13  LEU   6          HD13      LEU   6 -17.978   1.351   1.528
   91   HD21  LEU   6          HD21      LEU   6 -17.850   5.046   2.060
   92   HD22  LEU   6          HD22      LEU   6 -19.563   5.287   1.700
   93   HD23  LEU   6          HD23      LEU   6 -19.081   4.455   3.178
   94    H    LYS   7           H        LYS   7 -17.954   6.148  -2.040
   95    HA   LYS   7           HA       LYS   7 -18.383   5.028  -4.690
   96    HB2  LYS   7           HB2      LYS   7 -17.064   7.493  -3.630
   97    HB3  LYS   7           HB3      LYS   7 -16.614   6.901  -5.221
   98    HG2  LYS   7           HG2      LYS   7 -19.007   6.996  -5.866
   99    HG3  LYS   7           HG3      LYS   7 -19.346   7.751  -4.305
  100    HD2  LYS   7           HD2      LYS   7 -17.997   9.634  -4.831
  101    HD3  LYS   7           HD3      LYS   7 -17.335   8.841  -6.260
  102    HE2  LYS   7           HE2      LYS   7 -19.000  10.502  -6.876
  103    HE3  LYS   7           HE3      LYS   7 -19.526   8.873  -7.307
  104    HZ1  LYS   7           HZ1      LYS   7 -20.353  10.075  -4.739
  105    HZ2  LYS   7           HZ2      LYS   7 -21.113   8.853  -5.643
  106    HZ3  LYS   7           HZ3      LYS   7 -21.179  10.463  -6.169
  107    H    ILE   8           H        ILE   8 -17.237   3.262  -5.145
  108    HA   ILE   8           HA       ILE   8 -14.544   3.011  -4.050
  109    HB   ILE   8           HB       ILE   8 -16.422   1.039  -5.320
  110   HG12  ILE   8          HG12      ILE   8 -15.795  -0.304  -3.321
  111   HG13  ILE   8          HG13      ILE   8 -14.757   1.012  -2.788
  112   HG21  ILE   8          HG21      ILE   8 -14.635  -0.609  -5.437
  113   HG22  ILE   8          HG22      ILE   8 -14.297   0.761  -6.490
  114   HG23  ILE   8          HG23      ILE   8 -13.462   0.610  -4.944
  115   HD11  ILE   8          HD11      ILE   8 -17.745   1.135  -3.106
  116   HD12  ILE   8          HD12      ILE   8 -16.856   0.997  -1.588
  117   HD13  ILE   8          HD13      ILE   8 -16.705   2.456  -2.568
  118    H    SER   9           H        SER   9 -13.057   3.996  -5.201
  119    HA   SER   9           HA       SER   9 -13.288   3.971  -8.121
  120    HB2  SER   9           HB2      SER   9 -11.508   5.647  -6.337
  121    HB3  SER   9           HB3      SER   9 -11.563   5.747  -8.091
  122    HG   SER   9           HG       SER   9 -13.046   7.188  -7.696
  123    H    ILE  10           H        ILE  10 -11.826   2.891  -9.327
  124    HA   ILE  10           HA       ILE  10  -9.771   1.376  -7.850
  125    HB   ILE  10           HB       ILE  10 -11.307   0.369 -10.253
  126   HG12  ILE  10          HG12      ILE  10 -11.643  -0.394  -7.341
  127   HG13  ILE  10          HG13      ILE  10 -12.749   0.640  -8.236
  128   HG21  ILE  10          HG21      ILE  10  -9.426  -1.015  -8.339
  129   HG22  ILE  10          HG22      ILE  10 -10.310  -1.793  -9.653
  130   HG23  ILE  10          HG23      ILE  10  -9.077  -0.584 -10.014
  131   HD11  ILE  10          HD11      ILE  10 -12.150  -2.247  -8.835
  132   HD12  ILE  10          HD12      ILE  10 -13.605  -1.620  -8.056
  133   HD13  ILE  10          HD13      ILE  10 -13.259  -1.214  -9.737
  134    H    GLY  11           H        GLY  11  -8.196   2.890  -8.359
  135    HA2  GLY  11           HA2      GLY  11  -6.387   3.575  -9.629
  136    HA3  GLY  11           HA3      GLY  11  -6.975   2.565 -10.942
  137    H    ASN  12           H        ASN  12  -9.170   3.472 -11.840
  138    HA   ASN  12           HA       ASN  12  -9.044   6.390 -12.089
  139    HB2  ASN  12           HB2      ASN  12  -7.750   5.631 -13.970
  140    HB3  ASN  12           HB3      ASN  12  -8.958   4.420 -14.385
  141   HD21  ASN  12          HD21      ASN  12 -10.703   4.990 -15.589
  142   HD22  ASN  12          HD22      ASN  12 -10.927   6.567 -16.278
  143    H    VAL  13           H        VAL  13 -10.800   3.414 -12.900
  144    HA   VAL  13           HA       VAL  13 -13.291   4.696 -13.387
  145    HB   VAL  13           HB       VAL  13 -12.655   2.404 -14.205
  146   HG11  VAL  13          HG11      VAL  13 -12.981   0.491 -12.718
  147   HG12  VAL  13          HG12      VAL  13 -11.672   1.532 -12.160
  148   HG13  VAL  13          HG13      VAL  13 -13.245   1.588 -11.363
  149   HG21  VAL  13          HG21      VAL  13 -15.242   2.615 -12.668
  150   HG22  VAL  13          HG22      VAL  13 -14.959   3.137 -14.329
  151   HG23  VAL  13          HG23      VAL  13 -14.894   1.422 -13.920
  152    H    VAL  14           H        VAL  14 -15.210   4.577 -12.029
  153    HA   VAL  14           HA       VAL  14 -14.730   4.037  -9.201
  154    HB   VAL  14           HB       VAL  14 -14.369   6.359  -9.149
  155   HG11  VAL  14          HG11      VAL  14 -15.827   8.015 -10.169
  156   HG12  VAL  14          HG12      VAL  14 -15.144   6.922 -11.371
  157   HG13  VAL  14          HG13      VAL  14 -16.819   6.726 -10.854
  158   HG21  VAL  14          HG21      VAL  14 -15.816   5.716  -7.365
  159   HG22  VAL  14          HG22      VAL  14 -16.376   7.278  -7.966
  160   HG23  VAL  14          HG23      VAL  14 -17.237   5.802  -8.409
  161    H    LYS  15           H        LYS  15 -16.265   2.927  -8.312
  162    HA   LYS  15           HA       LYS  15 -18.863   2.679  -9.687
  163    HB2  LYS  15           HB2      LYS  15 -17.310   0.593  -8.137
  164    HB3  LYS  15           HB3      LYS  15 -18.923   0.362  -8.792
  165    HG2  LYS  15           HG2      LYS  15 -16.533   1.009 -10.495
  166    HG3  LYS  15           HG3      LYS  15 -17.041  -0.637 -10.116
  167    HD2  LYS  15           HD2      LYS  15 -19.271  -0.104 -11.095
  168    HD3  LYS  15           HD3      LYS  15 -18.625   1.463 -11.594
  169    HE2  LYS  15           HE2      LYS  15 -16.944   0.358 -12.958
  170    HE3  LYS  15           HE3      LYS  15 -17.517  -1.220 -12.420
  171    HZ1  LYS  15           HZ1      LYS  15 -18.379  -0.672 -14.603
  172    HZ2  LYS  15           HZ2      LYS  15 -19.080   0.752 -14.003
  173    HZ3  LYS  15           HZ3      LYS  15 -19.645  -0.757 -13.480
  174    H    THR  16           H        THR  16 -20.695   2.556  -8.360
  175    HA   THR  16           HA       THR  16 -20.247   3.610  -5.650
  176    HB   THR  16           HB       THR  16 -22.826   3.538  -7.232
  177    HG1  THR  16           HG1      THR  16 -21.930   5.157  -8.268
  178   HG21  THR  16          HG21      THR  16 -23.586   5.189  -5.582
  179   HG22  THR  16          HG22      THR  16 -22.050   5.040  -4.726
  180   HG23  THR  16          HG23      THR  16 -23.152   3.664  -4.808
  181    H    MET  17           H        MET  17 -20.436   2.235  -3.966
  182    HA   MET  17           HA       MET  17 -22.282  -0.016  -4.203
  183    HB2  MET  17           HB2      MET  17 -19.353  -0.192  -3.613
  184    HB3  MET  17           HB3      MET  17 -20.457  -1.311  -2.827
  185    HG2  MET  17           HG2      MET  17 -21.306  -1.837  -5.176
  186    HG3  MET  17           HG3      MET  17 -19.853  -1.013  -5.742
  187    HE1  MET  17           HE1      MET  17 -19.710  -4.687  -2.952
  188    HE2  MET  17           HE2      MET  17 -20.198  -3.066  -2.447
  189    HE3  MET  17           HE3      MET  17 -21.222  -3.994  -3.545
  190    H    GLN  18           H        GLN  18 -23.128  -0.730  -2.237
  191    HA   GLN  18           HA       GLN  18 -22.563   1.038   0.043
  192    HB2  GLN  18           HB2      GLN  18 -25.049  -0.458  -0.756
  193    HB3  GLN  18           HB3      GLN  18 -24.827   0.198   0.863
  194    HG2  GLN  18           HG2      GLN  18 -24.983   2.350   0.178
  195    HG3  GLN  18           HG3      GLN  18 -24.366   1.999  -1.438
  196   HE21  GLN  18          HE21      GLN  18 -25.972   3.029  -2.516
  197   HE22  GLN  18          HE22      GLN  18 -27.598   2.455  -2.572
  198    H    PHE  19           H        PHE  19 -22.251   0.142   2.106
  199    HA   PHE  19           HA       PHE  19 -22.028  -2.760   2.288
  200    HB2  PHE  19           HB2      PHE  19 -19.858  -0.845   3.202
  201    HB3  PHE  19           HB3      PHE  19 -19.857  -2.588   3.411
  202    HD1  PHE  19           HD1      PHE  19 -19.536  -4.057   1.466
  203    HD2  PHE  19           HD2      PHE  19 -19.156   0.166   1.180
  204    HE1  PHE  19           HE1      PHE  19 -18.354  -4.319  -0.671
  205    HE2  PHE  19           HE2      PHE  19 -17.972  -0.083  -0.963
  206    HZ   PHE  19           HZ       PHE  19 -17.478  -2.299  -1.844
  207    H    GLU  20           H        GLU  20 -22.079  -3.434   4.556
  208    HA   GLU  20           HA       GLU  20 -23.681  -1.651   6.163
  209    HB2  GLU  20           HB2      GLU  20 -22.513  -4.363   6.829
  210    HB3  GLU  20           HB3      GLU  20 -23.662  -3.481   7.823
  211    HG2  GLU  20           HG2      GLU  20 -25.321  -3.637   6.040
  212    HG3  GLU  20           HG3      GLU  20 -24.167  -4.533   5.051
  213    HA   PRO  21           HA       PRO  21 -20.511   0.304   8.582
  214    HB2  PRO  21           HB2      PRO  21 -21.707  -0.054  11.088
  215    HB3  PRO  21           HB3      PRO  21 -21.999   1.300   9.994
  216    HG2  PRO  21           HG2      PRO  21 -23.605  -1.181  10.402
  217    HG3  PRO  21           HG3      PRO  21 -24.162   0.477  10.089
  218    HD2  PRO  21           HD2      PRO  21 -24.176  -1.358   8.168
  219    HD3  PRO  21           HD3      PRO  21 -23.731   0.327   7.823
  220    H    SER  22           H        SER  22 -21.827  -2.813   9.517
  221    HA   SER  22           HA       SER  22 -19.405  -3.463  11.012
  222    HB2  SER  22           HB2      SER  22 -20.805  -5.492  11.682
  223    HB3  SER  22           HB3      SER  22 -21.380  -3.920  12.245
  224    HG   SER  22           HG       SER  22 -22.383  -5.532  10.138
  225    H    THR  23           H        THR  23 -20.207  -3.630   7.873
  226    HA   THR  23           HA       THR  23 -19.967  -6.271   7.064
  227    HB   THR  23           HB       THR  23 -19.168  -3.702   5.714
  228    HG1  THR  23           HG1      THR  23 -21.219  -5.622   5.175
  229   HG21  THR  23          HG21      THR  23 -17.675  -5.411   4.832
  230   HG22  THR  23          HG22      THR  23 -18.879  -4.954   3.628
  231   HG23  THR  23          HG23      THR  23 -19.052  -6.467   4.516
  232    H    MET  24           H        MET  24 -17.382  -3.886   7.531
  233    HA   MET  24           HA       MET  24 -15.203  -4.118   8.140
  234    HB2  MET  24           HB2      MET  24 -16.269  -6.198   9.392
  235    HB3  MET  24           HB3      MET  24 -15.338  -7.099   8.211
  236    HG2  MET  24           HG2      MET  24 -13.313  -6.280   9.050
  237    HG3  MET  24           HG3      MET  24 -14.119  -4.999   9.962
  238    HE1  MET  24           HE1      MET  24 -12.930  -6.975  13.002
  239    HE2  MET  24           HE2      MET  24 -12.068  -6.438  11.558
  240    HE3  MET  24           HE3      MET  24 -13.257  -5.379  12.318
  241    H    VAL  25           H        VAL  25 -13.283  -4.435   7.129
  242    HA   VAL  25           HA       VAL  25 -13.154  -4.199   4.457
  243    HB   VAL  25           HB       VAL  25 -11.037  -5.370   6.242
  244   HG11  VAL  25          HG11      VAL  25 -10.753  -4.341   3.417
  245   HG12  VAL  25          HG12      VAL  25  -9.428  -4.799   4.487
  246   HG13  VAL  25          HG13      VAL  25 -10.570  -6.019   3.926
  247   HG21  VAL  25          HG21      VAL  25 -11.514  -2.615   5.122
  248   HG22  VAL  25          HG22      VAL  25 -11.771  -3.124   6.791
  249   HG23  VAL  25          HG23      VAL  25 -10.140  -3.093   6.120
  250    H    TYR  26           H        TYR  26 -12.599  -7.356   6.069
  251    HA   TYR  26           HA       TYR  26 -12.016  -8.721   3.702
  252    HB2  TYR  26           HB2      TYR  26 -12.536 -10.824   4.963
  253    HB3  TYR  26           HB3      TYR  26 -11.364  -9.761   5.722
  254    HD1  TYR  26           HD1      TYR  26 -14.939 -10.752   5.819
  255    HD2  TYR  26           HD2      TYR  26 -11.661  -9.079   7.953
  256    HE1  TYR  26           HE1      TYR  26 -16.274 -10.782   7.879
  257    HE2  TYR  26           HE2      TYR  26 -12.988  -9.113  10.023
  258    HH   TYR  26           HH       TYR  26 -15.978 -10.783  10.264
  259    H    ASP  27           H        ASP  27 -15.151  -8.093   5.181
  260    HA   ASP  27           HA       ASP  27 -16.520  -9.817   3.322
  261    HB2  ASP  27           HB2      ASP  27 -17.412  -7.955   5.475
  262    HB3  ASP  27           HB3      ASP  27 -18.565  -8.403   4.220
  263    H    ALA  28           H        ALA  28 -15.902  -6.345   3.617
  264    HA   ALA  28           HA       ALA  28 -17.367  -5.482   1.420
  265    HB1  ALA  28           HB1      ALA  28 -15.832  -3.587   1.325
  266    HB2  ALA  28           HB2      ALA  28 -16.263  -3.963   2.994
  267    HB3  ALA  28           HB3      ALA  28 -14.690  -4.447   2.359
  268    H    CYS  29           H        CYS  29 -14.018  -6.619   1.568
  269    HA   CYS  29           HA       CYS  29 -13.366  -6.386  -1.120
  270    HB2  CYS  29           HB2      CYS  29 -11.762  -6.820   0.720
  271    HB3  CYS  29           HB3      CYS  29 -12.359  -8.471   0.820
  272    HG   CYS  29           HG       CYS  29 -11.081  -7.315  -2.119
  273    H    ARG  30           H        ARG  30 -15.010  -9.074   0.544
  274    HA   ARG  30           HA       ARG  30 -14.715 -10.868  -1.647
  275    HB2  ARG  30           HB2      ARG  30 -16.349 -12.295  -0.499
  276    HB3  ARG  30           HB3      ARG  30 -15.081 -11.753   0.588
  277    HG2  ARG  30           HG2      ARG  30 -16.521 -10.243   1.673
  278    HG3  ARG  30           HG3      ARG  30 -17.766 -10.396   0.435
  279    HD2  ARG  30           HD2      ARG  30 -18.564 -11.705   2.185
  280    HD3  ARG  30           HD3      ARG  30 -17.813 -12.884   1.110
  281    HE   ARG  30           HE       ARG  30 -16.498 -11.823   3.534
  282   HH11  ARG  30          HH11      ARG  30 -17.279 -14.474   1.369
  283   HH12  ARG  30          HH12      ARG  30 -16.404 -15.651   2.309
  284   HH21  ARG  30          HH21      ARG  30 -15.357 -13.365   4.759
  285   HH22  ARG  30          HH22      ARG  30 -15.329 -15.023   4.250
  286    H    MET  31           H        MET  31 -17.210  -8.614  -0.654
  287    HA   MET  31           HA       MET  31 -19.082  -9.496  -2.619
  288    HB2  MET  31           HB2      MET  31 -19.029  -6.996  -0.934
  289    HB3  MET  31           HB3      MET  31 -20.392  -7.559  -1.888
  290    HG2  MET  31           HG2      MET  31 -20.511  -9.583  -0.550
  291    HG3  MET  31           HG3      MET  31 -19.135  -9.041   0.400
  292    HE1  MET  31           HE1      MET  31 -19.717  -5.921   0.624
  293    HE2  MET  31           HE2      MET  31 -20.454  -5.936   2.230
  294    HE3  MET  31           HE3      MET  31 -19.086  -6.999   1.872
  295    H    ILE  32           H        ILE  32 -16.823  -6.763  -2.365
  296    HA   ILE  32           HA       ILE  32 -17.788  -5.404  -4.636
  297    HB   ILE  32           HB       ILE  32 -16.381  -4.286  -2.997
  298   HG12  ILE  32          HG12      ILE  32 -15.186  -4.392  -5.775
  299   HG13  ILE  32          HG13      ILE  32 -16.490  -3.340  -5.234
  300   HG21  ILE  32          HG21      ILE  32 -13.957  -4.662  -2.931
  301   HG22  ILE  32          HG22      ILE  32 -14.862  -6.092  -2.433
  302   HG23  ILE  32          HG23      ILE  32 -14.144  -6.018  -4.042
  303   HD11  ILE  32          HD11      ILE  32 -13.677  -3.271  -4.183
  304   HD12  ILE  32          HD12      ILE  32 -14.331  -2.195  -5.417
  305   HD13  ILE  32          HD13      ILE  32 -14.986  -2.158  -3.780
  306    H    ARG  33           H        ARG  33 -15.162  -7.758  -4.274
  307    HA   ARG  33           HA       ARG  33 -14.350  -7.840  -6.956
  308    HB2  ARG  33           HB2      ARG  33 -14.288 -10.016  -4.858
  309    HB3  ARG  33           HB3      ARG  33 -13.458 -10.105  -6.404
  310    HG2  ARG  33           HG2      ARG  33 -12.177  -8.076  -5.773
  311    HG3  ARG  33           HG3      ARG  33 -12.943  -8.137  -4.184
  312    HD2  ARG  33           HD2      ARG  33 -11.150 -10.227  -5.415
  313    HD3  ARG  33           HD3      ARG  33 -10.756  -9.158  -4.072
  314    HE   ARG  33           HE       ARG  33 -13.033 -10.942  -3.711
  315   HH11  ARG  33          HH11      ARG  33  -9.649 -10.281  -3.058
  316   HH12  ARG  33          HH12      ARG  33  -9.542 -11.430  -1.762
  317   HH21  ARG  33          HH21      ARG  33 -12.886 -12.459  -2.028
  318   HH22  ARG  33          HH22      ARG  33 -11.383 -12.681  -1.182
  319    H    GLU  34           H        GLU  34 -17.108  -9.124  -5.384
  320    HA   GLU  34           HA       GLU  34 -17.661 -11.286  -7.144
  321    HB2  GLU  34           HB2      GLU  34 -18.574 -11.000  -4.814
  322    HB3  GLU  34           HB3      GLU  34 -19.644  -9.760  -5.453
  323    HG2  GLU  34           HG2      GLU  34 -20.868 -11.789  -5.288
  324    HG3  GLU  34           HG3      GLU  34 -20.590 -11.455  -6.998
  325    H    ARG  35           H        ARG  35 -19.323  -8.123  -6.822
  326    HA   ARG  35           HA       ARG  35 -20.577  -8.535  -9.384
  327    HB2  ARG  35           HB2      ARG  35 -21.631  -6.302  -8.999
  328    HB3  ARG  35           HB3      ARG  35 -21.973  -7.507  -7.770
  329    HG2  ARG  35           HG2      ARG  35 -19.672  -5.758  -7.229
  330    HG3  ARG  35           HG3      ARG  35 -21.255  -4.973  -7.244
  331    HD2  ARG  35           HD2      ARG  35 -20.516  -7.408  -5.626
  332    HD3  ARG  35           HD3      ARG  35 -20.625  -5.764  -5.003
  333    HE   ARG  35           HE       ARG  35 -23.073  -6.184  -6.103
  334   HH11  ARG  35          HH11      ARG  35 -21.149  -7.976  -3.786
  335   HH12  ARG  35          HH12      ARG  35 -22.532  -8.590  -2.925
  336   HH21  ARG  35          HH21      ARG  35 -24.876  -6.973  -4.972
  337   HH22  ARG  35          HH22      ARG  35 -24.648  -8.010  -3.593
  338    H    ILE  36           H        ILE  36 -17.886  -6.601  -8.194
  339    HA   ILE  36           HA       ILE  36 -17.817  -5.191 -10.770
  340    HB   ILE  36           HB       ILE  36 -16.163  -4.547  -8.326
  341   HG12  ILE  36          HG12      ILE  36 -18.792  -3.326  -9.207
  342   HG13  ILE  36          HG13      ILE  36 -18.563  -4.356  -7.797
  343   HG21  ILE  36          HG21      ILE  36 -16.850  -2.949 -10.794
  344   HG22  ILE  36          HG22      ILE  36 -15.918  -2.356  -9.419
  345   HG23  ILE  36          HG23      ILE  36 -15.282  -3.666 -10.418
  346   HD11  ILE  36          HD11      ILE  36 -18.688  -2.022  -7.163
  347   HD12  ILE  36          HD12      ILE  36 -17.088  -2.677  -6.814
  348   HD13  ILE  36          HD13      ILE  36 -17.330  -1.645  -8.222
  349    HA   PRO  37           HA       PRO  37 -14.465  -8.102 -11.631
  350    HB2  PRO  37           HB2      PRO  37 -14.514  -7.795 -14.308
  351    HB3  PRO  37           HB3      PRO  37 -15.704  -8.780 -13.451
  352    HG2  PRO  37           HG2      PRO  37 -15.957  -5.998 -14.512
  353    HG3  PRO  37           HG3      PRO  37 -17.133  -7.324 -14.546
  354    HD2  PRO  37           HD2      PRO  37 -17.196  -5.265 -12.738
  355    HD3  PRO  37           HD3      PRO  37 -17.877  -6.875 -12.431
  356    H    GLU  38           H        GLU  38 -14.697  -4.770 -11.926
  357    HA   GLU  38           HA       GLU  38 -12.138  -4.314 -13.166
  358    HB2  GLU  38           HB2      GLU  38 -14.197  -2.554 -11.870
  359    HB3  GLU  38           HB3      GLU  38 -12.595  -1.927 -12.229
  360    HG2  GLU  38           HG2      GLU  38 -14.263  -1.411 -13.965
  361    HG3  GLU  38           HG3      GLU  38 -12.891  -2.336 -14.570
  362    H    ALA  39           H        ALA  39 -13.227  -5.170 -10.098
  363    HA   ALA  39           HA       ALA  39 -11.312  -3.788  -8.502
  364    HB1  ALA  39           HB1      ALA  39 -12.926  -6.254  -7.854
  365    HB2  ALA  39           HB2      ALA  39 -12.075  -5.232  -6.696
  366    HB3  ALA  39           HB3      ALA  39 -13.445  -4.587  -7.599
  367    H    LEU  40           H        LEU  40 -11.483  -7.057  -9.864
  368    HA   LEU  40           HA       LEU  40  -8.871  -7.614  -8.718
  369    HB2  LEU  40           HB2      LEU  40  -9.363  -9.987  -9.657
  370    HB3  LEU  40           HB3      LEU  40 -10.099  -9.444  -8.171
  371    HG   LEU  40           HG       LEU  40 -11.600 -10.755  -9.675
  372   HD11  LEU  40          HD11      LEU  40 -13.547  -9.345  -9.397
  373   HD12  LEU  40          HD12      LEU  40 -12.511  -9.271  -7.971
  374   HD13  LEU  40          HD13      LEU  40 -12.511  -7.942  -9.129
  375   HD21  LEU  40          HD21      LEU  40 -11.365  -8.329 -11.431
  376   HD22  LEU  40          HD22      LEU  40 -10.898  -9.981 -11.827
  377   HD23  LEU  40          HD23      LEU  40 -12.603  -9.578 -11.605
  378    H    ALA  41           H        ALA  41  -8.077  -5.981 -10.297
  379    HA   ALA  41           HA       ALA  41  -7.834  -6.716 -13.036
  380    HB1  ALA  41           HB1      ALA  41  -7.701  -4.387 -12.281
  381    HB2  ALA  41           HB2      ALA  41  -6.193  -4.751 -11.441
  382    HB3  ALA  41           HB3      ALA  41  -6.270  -4.858 -13.199
  383    H    GLY  42           H        GLY  42  -6.469  -7.949 -10.305
  384    HA2  GLY  42           HA2      GLY  42  -4.604  -9.533 -11.852
  385    HA3  GLY  42           HA3      GLY  42  -3.880  -8.550 -10.579
  386    HA   PRO  43           HA       PRO  43  -5.021 -12.474  -8.409
  387    HB2  PRO  43           HB2      PRO  43  -2.909 -11.444  -6.614
  388    HB3  PRO  43           HB3      PRO  43  -3.108 -13.058  -7.302
  389    HG2  PRO  43           HG2      PRO  43  -1.202 -11.394  -8.182
  390    HG3  PRO  43           HG3      PRO  43  -2.055 -12.496  -9.278
  391    HD2  PRO  43           HD2      PRO  43  -2.425  -9.555  -8.878
  392    HD3  PRO  43           HD3      PRO  43  -2.488 -10.507 -10.376
  393    HA   PRO  44           HA       PRO  44  -7.722  -9.703  -6.133
  394    HB2  PRO  44           HB2      PRO  44  -9.267 -11.686  -5.035
  395    HB3  PRO  44           HB3      PRO  44  -9.481 -11.052  -6.670
  396    HG2  PRO  44           HG2      PRO  44  -8.052 -13.522  -5.768
  397    HG3  PRO  44           HG3      PRO  44  -9.139 -13.298  -7.152
  398    HD2  PRO  44           HD2      PRO  44  -6.476 -13.360  -7.464
  399    HD3  PRO  44           HD3      PRO  44  -7.496 -12.280  -8.437
  400    H    ASN  45           H        ASN  45  -5.672 -12.116  -4.860
  401    HA   ASN  45           HA       ASN  45  -6.307 -11.872  -2.090
  402    HB2  ASN  45           HB2      ASN  45  -3.693 -12.745  -3.343
  403    HB3  ASN  45           HB3      ASN  45  -4.253 -13.106  -1.715
  404   HD21  ASN  45          HD21      ASN  45  -3.488 -14.758  -4.086
  405   HD22  ASN  45          HD22      ASN  45  -4.803 -15.870  -4.273
  406    H    ASP  46           H        ASP  46  -4.307 -10.169  -4.337
  407    HA   ASP  46           HA       ASP  46  -2.764  -8.850  -2.247
  408    HB2  ASP  46           HB2      ASP  46  -2.591  -8.698  -5.265
  409    HB3  ASP  46           HB3      ASP  46  -1.495  -7.882  -4.154
  410    H    PHE  47           H        PHE  47  -5.728  -8.318  -3.022
  411    HA   PHE  47           HA       PHE  47  -5.428  -5.423  -3.489
  412    HB2  PHE  47           HB2      PHE  47  -7.577  -7.344  -4.349
  413    HB3  PHE  47           HB3      PHE  47  -7.894  -5.618  -4.238
  414    HD1  PHE  47           HD1      PHE  47  -6.669  -4.046  -5.689
  415    HD2  PHE  47           HD2      PHE  47  -6.333  -8.260  -6.155
  416    HE1  PHE  47           HE1      PHE  47  -5.768  -3.719  -7.954
  417    HE2  PHE  47           HE2      PHE  47  -5.424  -7.941  -8.415
  418    HZ   PHE  47           HZ       PHE  47  -5.140  -5.669  -9.320
  419    H    GLY  48           H        GLY  48  -6.333  -4.014  -2.075
  420    HA2  GLY  48           HA2      GLY  48  -8.181  -5.070  -0.050
  421    HA3  GLY  48           HA3      GLY  48  -6.703  -4.288   0.488
  422    H    LEU  49           H        LEU  49  -8.390  -2.930   1.587
  423    HA   LEU  49           HA       LEU  49  -9.685  -1.023  -0.223
  424    HB2  LEU  49           HB2      LEU  49 -10.156  -1.452   2.726
  425    HB3  LEU  49           HB3      LEU  49 -11.110  -0.447   1.651
  426    HG   LEU  49           HG       LEU  49 -10.897  -3.457   1.544
  427   HD11  LEU  49          HD11      LEU  49 -13.166  -1.640   2.338
  428   HD12  LEU  49          HD12      LEU  49 -13.249  -3.397   2.204
  429   HD13  LEU  49          HD13      LEU  49 -12.212  -2.653   3.422
  430   HD21  LEU  49          HD21      LEU  49 -12.544  -1.569  -0.136
  431   HD22  LEU  49          HD22      LEU  49 -11.149  -2.497  -0.688
  432   HD23  LEU  49          HD23      LEU  49 -12.618  -3.331  -0.180
  433    H    PHE  50           H        PHE  50  -8.462   0.683  -0.619
  434    HA   PHE  50           HA       PHE  50  -7.014   1.962   1.591
  435    HB2  PHE  50           HB2      PHE  50  -5.781   1.608  -0.522
  436    HB3  PHE  50           HB3      PHE  50  -6.959   2.601  -1.369
  437    HD1  PHE  50           HD1      PHE  50  -4.187   2.613   1.031
  438    HD2  PHE  50           HD2      PHE  50  -6.917   5.002  -1.198
  439    HE1  PHE  50           HE1      PHE  50  -2.847   4.612   1.537
  440    HE2  PHE  50           HE2      PHE  50  -5.578   7.003  -0.698
  441    HZ   PHE  50           HZ       PHE  50  -3.553   6.820   0.666
  442    H    LEU  51           H        LEU  51  -7.828   3.689   2.597
  443    HA   LEU  51           HA       LEU  51 -10.264   4.887   1.504
  444    HB2  LEU  51           HB2      LEU  51  -9.855   4.089   3.977
  445    HB3  LEU  51           HB3      LEU  51  -9.041   5.630   4.140
  446    HG   LEU  51           HG       LEU  51 -11.331   5.749   4.967
  447   HD11  LEU  51          HD11      LEU  51 -10.386   7.770   4.019
  448   HD12  LEU  51          HD12      LEU  51 -10.972   7.310   2.419
  449   HD13  LEU  51          HD13      LEU  51 -12.119   7.683   3.705
  450   HD21  LEU  51          HD21      LEU  51 -12.184   3.970   3.377
  451   HD22  LEU  51          HD22      LEU  51 -13.253   5.346   3.669
  452   HD23  LEU  51          HD23      LEU  51 -12.316   5.251   2.173
  453    H    SER  52           H        SER  52  -9.941   6.512   0.164
  454    HA   SER  52           HA       SER  52  -7.511   8.089   0.315
  455    HB2  SER  52           HB2      SER  52  -8.327   7.264  -1.869
  456    HB3  SER  52           HB3      SER  52  -9.792   8.225  -1.676
  457    HG   SER  52           HG       SER  52  -7.145   9.041  -2.178
  458    H    ASP  53           H        ASP  53  -7.406   9.906   1.386
  459    HA   ASP  53           HA       ASP  53  -9.928  11.153   2.255
  460    HB2  ASP  53           HB2      ASP  53  -8.441  10.254   4.044
  461    HB3  ASP  53           HB3      ASP  53  -7.189  11.375   3.523
  462    H    ASP  54           H        ASP  54  -6.579  11.992   1.381
  463    HA   ASP  54           HA       ASP  54  -7.161  14.099  -0.343
  464    HB2  ASP  54           HB2      ASP  54  -8.172  15.304   1.476
  465    HB3  ASP  54           HB3      ASP  54  -6.818  14.948   2.541
  466    H    ASP  55           H        ASP  55  -5.040  13.611   2.433
  467    HA   ASP  55           HA       ASP  55  -2.704  14.168   0.740
  468    HB2  ASP  55           HB2      ASP  55  -2.893  15.756   2.529
  469    HB3  ASP  55           HB3      ASP  55  -3.213  14.489   3.705
  470    HA   PRO  56           HA       PRO  56  -1.253   9.989   0.949
  471    HB2  PRO  56           HB2      PRO  56   1.401  10.536   1.711
  472    HB3  PRO  56           HB3      PRO  56   0.782  10.363   0.067
  473    HG2  PRO  56           HG2      PRO  56   1.299  12.829   1.648
  474    HG3  PRO  56           HG3      PRO  56   1.472  12.549  -0.094
  475    HD2  PRO  56           HD2      PRO  56  -0.584  13.951   0.880
  476    HD3  PRO  56           HD3      PRO  56  -0.801  12.840  -0.491
  477    H    LYS  57           H        LYS  57  -0.710  12.094   3.745
  478    HA   LYS  57           HA       LYS  57  -0.203   9.788   5.463
  479    HB2  LYS  57           HB2      LYS  57  -0.655  12.648   6.329
  480    HB3  LYS  57           HB3      LYS  57   0.055  11.341   7.267
  481    HG2  LYS  57           HG2      LYS  57   1.312  12.417   4.778
  482    HG3  LYS  57           HG3      LYS  57   1.640  13.054   6.393
  483    HD2  LYS  57           HD2      LYS  57   2.122  10.607   7.017
  484    HD3  LYS  57           HD3      LYS  57   2.243  10.348   5.273
  485    HE2  LYS  57           HE2      LYS  57   4.423  10.789   6.022
  486    HE3  LYS  57           HE3      LYS  57   3.861  12.257   5.227
  487    HZ1  LYS  57           HZ1      LYS  57   3.880  11.809   8.162
  488    HZ2  LYS  57           HZ2      LYS  57   3.410  13.233   7.373
  489    HZ3  LYS  57           HZ3      LYS  57   5.022  12.722   7.306
  490    H    LYS  58           H        LYS  58  -2.792  11.975   4.611
  491    HA   LYS  58           HA       LYS  58  -4.570  11.196   6.709
  492    HB2  LYS  58           HB2      LYS  58  -5.183  12.454   4.029
  493    HB3  LYS  58           HB3      LYS  58  -6.287  12.356   5.391
  494    HG2  LYS  58           HG2      LYS  58  -4.935  13.855   6.678
  495    HG3  LYS  58           HG3      LYS  58  -3.665  13.833   5.451
  496    HD2  LYS  58           HD2      LYS  58  -5.271  14.799   3.838
  497    HD3  LYS  58           HD3      LYS  58  -6.460  14.917   5.132
  498    HE2  LYS  58           HE2      LYS  58  -5.040  16.448   6.343
  499    HE3  LYS  58           HE3      LYS  58  -3.760  16.256   5.144
  500    HZ1  LYS  58           HZ1      LYS  58  -4.908  18.274   4.689
  501    HZ2  LYS  58           HZ2      LYS  58  -6.419  17.509   4.735
  502    HZ3  LYS  58           HZ3      LYS  58  -5.340  17.168   3.472
  503    H    GLY  59           H        GLY  59  -3.966  10.187   3.400
  504    HA2  GLY  59           HA2      GLY  59  -6.092   8.320   3.188
  505    HA3  GLY  59           HA3      GLY  59  -4.614   8.317   2.232
  506    H    ILE  60           H        ILE  60  -6.131   6.102   3.568
  507    HA   ILE  60           HA       ILE  60  -3.917   5.008   5.126
  508    HB   ILE  60           HB       ILE  60  -5.620   4.163   6.830
  509   HG12  ILE  60          HG12      ILE  60  -7.173   6.555   5.821
  510   HG13  ILE  60          HG13      ILE  60  -7.602   4.883   5.478
  511   HG21  ILE  60          HG21      ILE  60  -4.922   7.090   6.776
  512   HG22  ILE  60          HG22      ILE  60  -5.365   6.156   8.205
  513   HG23  ILE  60          HG23      ILE  60  -3.878   5.780   7.331
  514   HD11  ILE  60          HD11      ILE  60  -7.460   6.115   8.217
  515   HD12  ILE  60          HD12      ILE  60  -8.931   5.831   7.287
  516   HD13  ILE  60          HD13      ILE  60  -7.958   4.466   7.832
  517    H    TRP  61           H        TRP  61  -4.052   2.765   5.517
  518    HA   TRP  61           HA       TRP  61  -5.587   1.326   3.506
  519    HB2  TRP  61           HB2      TRP  61  -3.375   0.510   5.387
  520    HB3  TRP  61           HB3      TRP  61  -4.256  -0.644   4.390
  521    HD1  TRP  61           HD1      TRP  61  -1.412   1.780   4.269
  522    HE1  TRP  61           HE1      TRP  61  -0.416   1.833   1.890
  523    HE3  TRP  61           HE3      TRP  61  -5.074  -0.809   1.827
  524    HZ2  TRP  61           HZ2      TRP  61  -1.119   0.898  -0.679
  525    HZ3  TRP  61           HZ3      TRP  61  -4.839  -1.187  -0.591
  526    HH2  TRP  61           HH2      TRP  61  -2.902  -0.348  -1.814
  527    H    LEU  62           H        LEU  62  -7.298   0.121   3.951
  528    HA   LEU  62           HA       LEU  62  -8.187  -0.030   6.729
  529    HB2  LEU  62           HB2      LEU  62  -9.663  -0.865   4.228
  530    HB3  LEU  62           HB3      LEU  62 -10.342  -0.627   5.826
  531    HG   LEU  62           HG       LEU  62  -9.200   1.559   4.081
  532   HD11  LEU  62          HD11      LEU  62 -11.274   0.671   3.178
  533   HD12  LEU  62          HD12      LEU  62 -12.054   0.862   4.749
  534   HD13  LEU  62          HD13      LEU  62 -11.523   2.283   3.849
  535   HD21  LEU  62          HD21      LEU  62 -10.187   3.070   5.725
  536   HD22  LEU  62          HD22      LEU  62 -10.659   1.682   6.711
  537   HD23  LEU  62          HD23      LEU  62  -8.951   2.040   6.451
  538    H    GLU  63           H        GLU  63  -7.328  -1.761   7.763
  539    HA   GLU  63           HA       GLU  63  -6.719  -4.181   6.298
  540    HB2  GLU  63           HB2      GLU  63  -5.746  -4.945   8.428
  541    HB3  GLU  63           HB3      GLU  63  -5.111  -3.380   7.942
  542    HG2  GLU  63           HG2      GLU  63  -6.534  -2.262   9.539
  543    HG3  GLU  63           HG3      GLU  63  -7.292  -3.792   9.975
  544    H    ALA  64           H        ALA  64  -7.442  -6.293   7.107
  545    HA   ALA  64           HA       ALA  64 -10.286  -6.304   7.426
  546    HB1  ALA  64           HB1      ALA  64  -8.331  -8.595   7.532
  547    HB2  ALA  64           HB2      ALA  64 -10.080  -8.728   7.353
  548    HB3  ALA  64           HB3      ALA  64  -9.119  -7.978   6.079
  549    H    GLY  65           H        GLY  65  -8.030  -5.651   9.629
  550    HA2  GLY  65           HA2      GLY  65  -9.118  -7.260  11.804
  551    HA3  GLY  65           HA3      GLY  65  -7.722  -6.200  11.894
  552    H    LYS  66           H        LYS  66 -10.357  -4.695  10.356
  553    HA   LYS  66           HA       LYS  66 -11.662  -3.799  12.753
  554    HB2  LYS  66           HB2      LYS  66 -10.824  -1.705  12.982
  555    HB3  LYS  66           HB3      LYS  66  -9.421  -2.384  12.173
  556    HG2  LYS  66           HG2      LYS  66 -11.652  -0.996  10.714
  557    HG3  LYS  66           HG3      LYS  66 -10.223  -0.164  11.324
  558    HD2  LYS  66           HD2      LYS  66  -8.929  -0.927   9.660
  559    HD3  LYS  66           HD3      LYS  66  -9.642  -2.542   9.716
  560    HE2  LYS  66           HE2      LYS  66 -10.058  -1.308   7.586
  561    HE3  LYS  66           HE3      LYS  66 -11.519  -1.840   8.416
  562    HZ1  LYS  66           HZ1      LYS  66 -11.889   0.349   9.219
  563    HZ2  LYS  66           HZ2      LYS  66 -11.630   0.451   7.548
  564    HZ3  LYS  66           HZ3      LYS  66 -10.401   0.894   8.621
  565    H    ALA  67           H        ALA  67 -13.465  -2.254  12.194
  566    HA   ALA  67           HA       ALA  67 -14.624  -3.158   9.678
  567    HB1  ALA  67           HB1      ALA  67 -15.945  -3.285  11.732
  568    HB2  ALA  67           HB2      ALA  67 -15.857  -1.531  11.895
  569    HB3  ALA  67           HB3      ALA  67 -16.708  -2.246  10.525
  570    H    LEU  68           H        LEU  68 -16.012  -1.440   8.526
  571    HA   LEU  68           HA       LEU  68 -14.215   0.525   7.495
  572    HB2  LEU  68           HB2      LEU  68 -17.159   0.084   7.033
  573    HB3  LEU  68           HB3      LEU  68 -16.155   1.171   6.095
  574    HG   LEU  68           HG       LEU  68 -15.826  -1.827   6.255
  575   HD11  LEU  68          HD11      LEU  68 -17.820  -1.179   5.023
  576   HD12  LEU  68          HD12      LEU  68 -16.863  -0.074   4.035
  577   HD13  LEU  68          HD13      LEU  68 -16.585  -1.813   3.935
  578   HD21  LEU  68          HD21      LEU  68 -14.195  -1.526   4.459
  579   HD22  LEU  68          HD22      LEU  68 -14.385   0.223   4.579
  580   HD23  LEU  68          HD23      LEU  68 -13.700  -0.685   5.927
  581    H    ASP  69           H        ASP  69 -17.175   0.661   9.437
  582    HA   ASP  69           HA       ASP  69 -17.299   3.503   9.487
  583    HB2  ASP  69           HB2      ASP  69 -19.265   3.225  10.698
  584    HB3  ASP  69           HB3      ASP  69 -19.197   1.736   9.772
  585    H    TYR  70           H        TYR  70 -15.420   1.273  11.117
  586    HA   TYR  70           HA       TYR  70 -15.056   2.344  13.641
  587    HB2  TYR  70           HB2      TYR  70 -13.988   0.296  13.185
  588    HB3  TYR  70           HB3      TYR  70 -13.274   0.902  11.698
  589    HD1  TYR  70           HD1      TYR  70 -13.150   1.644  15.367
  590    HD2  TYR  70           HD2      TYR  70 -11.055   1.296  11.694
  591    HE1  TYR  70           HE1      TYR  70 -11.033   2.102  16.537
  592    HE2  TYR  70           HE2      TYR  70  -8.939   1.752  12.838
  593    HH   TYR  70           HH       TYR  70  -8.044   2.630  14.779
  594    H    TYR  71           H        TYR  71 -13.534   3.208  10.562
  595    HA   TYR  71           HA       TYR  71 -12.211   5.505  11.702
  596    HB2  TYR  71           HB2      TYR  71 -12.455   4.448   8.890
  597    HB3  TYR  71           HB3      TYR  71 -11.676   5.985   9.254
  598    HD1  TYR  71           HD1      TYR  71  -9.680   5.973  10.825
  599    HD2  TYR  71           HD2      TYR  71 -11.287   2.430   9.109
  600    HE1  TYR  71           HE1      TYR  71  -7.572   4.789  11.302
  601    HE2  TYR  71           HE2      TYR  71  -9.190   1.236   9.581
  602    HH   TYR  71           HH       TYR  71  -6.766   1.841   9.927
  603    H    MET  72           H        MET  72 -12.678   7.251   9.435
  604    HA   MET  72           HA       MET  72 -15.178   8.387  10.413
  605    HB2  MET  72           HB2      MET  72 -13.004   9.542   8.678
  606    HB3  MET  72           HB3      MET  72 -14.414  10.427   9.251
  607    HG2  MET  72           HG2      MET  72 -12.229   9.235  10.943
  608    HG3  MET  72           HG3      MET  72 -12.496  10.941  10.607
  609    HE1  MET  72           HE1      MET  72 -14.460  12.381  11.624
  610    HE2  MET  72           HE2      MET  72 -15.599  11.295  10.826
  611    HE3  MET  72           HE3      MET  72 -15.804  11.689  12.534
  612    H    LEU  73           H        LEU  73 -15.426   6.120   8.655
  613    HA   LEU  73           HA       LEU  73 -16.042   7.258   6.036
  614    HB2  LEU  73           HB2      LEU  73 -16.628   4.404   6.611
  615    HB3  LEU  73           HB3      LEU  73 -16.065   5.151   5.144
  616    HG   LEU  73           HG       LEU  73 -14.461   4.359   7.553
  617   HD11  LEU  73          HD11      LEU  73 -14.340   3.633   4.634
  618   HD12  LEU  73          HD12      LEU  73 -13.212   3.080   5.874
  619   HD13  LEU  73          HD13      LEU  73 -14.911   2.608   5.951
  620   HD21  LEU  73          HD21      LEU  73 -13.648   6.075   5.226
  621   HD22  LEU  73          HD22      LEU  73 -13.683   6.528   6.931
  622   HD23  LEU  73          HD23      LEU  73 -12.529   5.319   6.367
  623    H    ARG  74           H        ARG  74 -17.970   7.280   5.102
  624    HA   ARG  74           HA       ARG  74 -20.340   6.442   6.395
  625    HB2  ARG  74           HB2      ARG  74 -21.127   8.988   6.481
  626    HB3  ARG  74           HB3      ARG  74 -20.403   8.174   7.858
  627    HG2  ARG  74           HG2      ARG  74 -19.433  10.356   7.629
  628    HG3  ARG  74           HG3      ARG  74 -18.216   9.150   7.233
  629    HD2  ARG  74           HD2      ARG  74 -19.379   9.685   4.800
  630    HD3  ARG  74           HD3      ARG  74 -19.358  11.255   5.602
  631    HE   ARG  74           HE       ARG  74 -16.953   9.585   5.223
  632   HH11  ARG  74          HH11      ARG  74 -18.503  12.725   5.409
  633   HH12  ARG  74          HH12      ARG  74 -17.059  13.594   4.977
  634   HH21  ARG  74          HH21      ARG  74 -15.087  10.687   4.665
  635   HH22  ARG  74          HH22      ARG  74 -15.102  12.427   4.543
  636    H    ASN  75           H        ASN  75 -22.218   7.817   5.331
  637    HA   ASN  75           HA       ASN  75 -22.262   7.014   2.644
  638    HB2  ASN  75           HB2      ASN  75 -24.070   8.583   4.414
  639    HB3  ASN  75           HB3      ASN  75 -24.341   8.677   2.675
  640   HD21  ASN  75          HD21      ASN  75 -24.188   6.508   5.431
  641   HD22  ASN  75          HD22      ASN  75 -25.100   5.231   4.692
  642    H    GLY  76           H        GLY  76 -21.138   7.855   1.052
  643    HA2  GLY  76           HA2      GLY  76 -21.081   9.722  -0.518
  644    HA3  GLY  76           HA3      GLY  76 -20.998  10.797   0.867
  645    H    ASP  77           H        ASP  77 -19.074   8.417   1.868
  646    HA   ASP  77           HA       ASP  77 -16.704   9.895   1.182
  647    HB2  ASP  77           HB2      ASP  77 -17.360   8.520   3.381
  648    HB3  ASP  77           HB3      ASP  77 -16.520   7.238   2.514
  649    H    THR  78           H        THR  78 -14.899   9.081   0.059
  650    HA   THR  78           HA       THR  78 -15.595   7.058  -1.941
  651    HB   THR  78           HB       THR  78 -13.363   9.105  -1.949
  652    HG1  THR  78           HG1      THR  78 -15.339  10.125  -2.255
  653   HG21  THR  78          HG21      THR  78 -14.306   7.232  -4.126
  654   HG22  THR  78          HG22      THR  78 -12.780   7.114  -3.249
  655   HG23  THR  78          HG23      THR  78 -13.084   8.491  -4.308
  656    H    MET  79           H        MET  79 -14.531   5.159  -2.068
  657    HA   MET  79           HA       MET  79 -12.224   4.767  -0.288
  658    HB2  MET  79           HB2      MET  79 -14.473   3.786   0.529
  659    HB3  MET  79           HB3      MET  79 -14.285   2.625  -0.779
  660    HG2  MET  79           HG2      MET  79 -12.141   1.919   0.165
  661    HG3  MET  79           HG3      MET  79 -12.354   3.072   1.481
  662    HE1  MET  79           HE1      MET  79 -14.994   0.662  -0.257
  663    HE2  MET  79           HE2      MET  79 -13.484  -0.250  -0.148
  664    HE3  MET  79           HE3      MET  79 -14.876  -0.722   0.831
  665    H    GLU  80           H        GLU  80 -10.550   4.308  -1.492
  666    HA   GLU  80           HA       GLU  80 -10.851   3.542  -4.265
  667    HB2  GLU  80           HB2      GLU  80  -9.101   5.127  -2.983
  668    HB3  GLU  80           HB3      GLU  80  -8.192   3.625  -2.935
  669    HG2  GLU  80           HG2      GLU  80  -9.313   4.529  -5.537
  670    HG3  GLU  80           HG3      GLU  80  -7.915   5.348  -4.872
  671    H    TYR  81           H        TYR  81 -10.789   1.441  -4.990
  672    HA   TYR  81           HA       TYR  81  -9.765  -0.550  -3.126
  673    HB2  TYR  81           HB2      TYR  81 -12.037  -0.867  -4.186
  674    HB3  TYR  81           HB3      TYR  81 -11.219  -1.020  -5.737
  675    HD1  TYR  81           HD1      TYR  81 -11.814  -2.622  -2.483
  676    HD2  TYR  81           HD2      TYR  81  -9.970  -3.013  -6.297
  677    HE1  TYR  81           HE1      TYR  81 -11.485  -5.024  -2.075
  678    HE2  TYR  81           HE2      TYR  81  -9.641  -5.413  -5.898
  679    HH   TYR  81           HH       TYR  81 -11.189  -7.095  -3.442
  680    H    ARG  82           H        ARG  82  -7.696  -0.759  -3.318
  681    HA   ARG  82           HA       ARG  82  -6.520  -0.913  -5.992
  682    HB2  ARG  82           HB2      ARG  82  -4.508   0.299  -5.193
  683    HB3  ARG  82           HB3      ARG  82  -5.950   1.302  -5.254
  684    HG2  ARG  82           HG2      ARG  82  -6.205   1.204  -2.886
  685    HG3  ARG  82           HG3      ARG  82  -4.918   0.002  -2.748
  686    HD2  ARG  82           HD2      ARG  82  -4.474   2.747  -3.892
  687    HD3  ARG  82           HD3      ARG  82  -4.303   2.393  -2.174
  688    HE   ARG  82           HE       ARG  82  -2.724   0.539  -3.413
  689   HH11  ARG  82          HH11      ARG  82  -2.918   4.040  -3.547
  690   HH12  ARG  82          HH12      ARG  82  -1.194   4.246  -3.724
  691   HH21  ARG  82          HH21      ARG  82  -0.459   0.824  -3.642
  692   HH22  ARG  82          HH22      ARG  82   0.184   2.435  -3.786
  693    H    LYS  83           H        LYS  83  -4.302  -1.824  -5.920
  694    HA   LYS  83           HA       LYS  83  -4.265  -4.297  -4.557
  695    HB2  LYS  83           HB2      LYS  83  -3.086  -3.550  -6.737
  696    HB3  LYS  83           HB3      LYS  83  -1.852  -2.883  -5.684
  697    HG2  LYS  83           HG2      LYS  83  -1.286  -5.040  -4.855
  698    HG3  LYS  83           HG3      LYS  83  -2.676  -5.775  -5.663
  699    HD2  LYS  83           HD2      LYS  83  -1.731  -5.164  -7.836
  700    HD3  LYS  83           HD3      LYS  83  -0.348  -4.426  -7.031
  701    HE2  LYS  83           HE2      LYS  83   0.359  -6.555  -7.772
  702    HE3  LYS  83           HE3      LYS  83   0.132  -6.684  -6.031
  703    HZ1  LYS  83           HZ1      LYS  83  -1.920  -7.499  -8.010
  704    HZ2  LYS  83           HZ2      LYS  83  -1.899  -7.833  -6.349
  705    HZ3  LYS  83           HZ3      LYS  83  -0.766  -8.566  -7.374
  706    H    LYS  84           H        LYS  84  -3.445  -4.829  -2.588
  707    HA   LYS  84           HA       LYS  84  -3.019  -2.900  -0.607
  708    HB2  LYS  84           HB2      LYS  84  -2.483  -5.838  -0.796
  709    HB3  LYS  84           HB3      LYS  84  -1.839  -4.943   0.571
  710    HG2  LYS  84           HG2      LYS  84  -4.744  -5.066  -0.213
  711    HG3  LYS  84           HG3      LYS  84  -3.977  -6.012   1.067
  712    HD2  LYS  84           HD2      LYS  84  -3.337  -3.252   1.420
  713    HD3  LYS  84           HD3      LYS  84  -5.083  -3.425   1.243
  714    HE2  LYS  84           HE2      LYS  84  -4.400  -3.576   3.587
  715    HE3  LYS  84           HE3      LYS  84  -5.114  -5.085   3.025
  716    HZ1  LYS  84           HZ1      LYS  84  -3.111  -5.412   4.379
  717    HZ2  LYS  84           HZ2      LYS  84  -2.192  -4.573   3.226
  718    HZ3  LYS  84           HZ3      LYS  84  -2.937  -6.043   2.815
  719    H    GLN  85           H        GLN  85  -0.921  -4.199  -2.941
  720    HA   GLN  85           HA       GLN  85   1.509  -3.471  -1.585
  721    HB2  GLN  85           HB2      GLN  85   1.459  -4.219  -4.466
  722    HB3  GLN  85           HB3      GLN  85   2.605  -4.674  -3.212
  723    HG2  GLN  85           HG2      GLN  85   0.593  -6.027  -2.267
  724    HG3  GLN  85           HG3      GLN  85  -0.016  -5.878  -3.913
  725   HE21  GLN  85          HE21      GLN  85   2.395  -7.266  -1.867
  726   HE22  GLN  85          HE22      GLN  85   3.012  -8.395  -3.024
  727    H    ARG  86           H        ARG  86   2.830  -2.737  -4.028
  728    HA   ARG  86           HA       ARG  86   1.869  -0.445  -5.187
  729    HB2  ARG  86           HB2      ARG  86   3.342   1.228  -3.867
  730    HB3  ARG  86           HB3      ARG  86   1.763   0.803  -3.236
  731    HG2  ARG  86           HG2      ARG  86   3.112   0.772  -1.365
  732    HG3  ARG  86           HG3      ARG  86   3.027  -0.928  -1.817
  733    HD2  ARG  86           HD2      ARG  86   5.299  -0.008  -1.161
  734    HD3  ARG  86           HD3      ARG  86   5.211  -0.922  -2.666
  735    HE   ARG  86           HE       ARG  86   6.002   0.925  -3.698
  736   HH11  ARG  86          HH11      ARG  86   4.194   2.072  -0.884
  737   HH12  ARG  86          HH12      ARG  86   4.521   3.742  -1.236
  738   HH21  ARG  86          HH21      ARG  86   6.463   3.103  -4.084
  739   HH22  ARG  86          HH22      ARG  86   5.818   4.332  -3.036
  740    HA   PRO  87           HA       PRO  87   5.470  -1.406  -7.493
  741    HB2  PRO  87           HB2      PRO  87   5.422   1.372  -8.481
  742    HB3  PRO  87           HB3      PRO  87   5.247  -0.139  -9.377
  743    HG2  PRO  87           HG2      PRO  87   3.163   1.503  -8.968
  744    HG3  PRO  87           HG3      PRO  87   2.975  -0.260  -8.994
  745    HD2  PRO  87           HD2      PRO  87   3.089   1.599  -6.652
  746    HD3  PRO  87           HD3      PRO  87   2.057   0.176  -6.914
  747    H    LEU  88           H        LEU  88   7.286  -1.584  -6.340
  748    HA   LEU  88           HA       LEU  88   8.450   0.834  -5.180
  749    HB2  LEU  88           HB2      LEU  88   8.867  -2.093  -4.695
  750    HB3  LEU  88           HB3      LEU  88  10.083  -0.926  -4.202
  751    HG   LEU  88           HG       LEU  88   7.204  -0.753  -3.321
  752   HD11  LEU  88          HD11      LEU  88   9.539  -2.033  -1.917
  753   HD12  LEU  88          HD12      LEU  88   7.946  -1.744  -1.215
  754   HD13  LEU  88          HD13      LEU  88   8.126  -2.865  -2.565
  755   HD21  LEU  88          HD21      LEU  88   8.149   0.668  -1.560
  756   HD22  LEU  88          HD22      LEU  88   9.751   0.484  -2.275
  757   HD23  LEU  88          HD23      LEU  88   8.478   1.319  -3.166
  758    H    LYS  89           H        LYS  89   9.746   1.897  -6.412
  759    HA   LYS  89           HA       LYS  89  11.286   0.665  -8.530
  760    HB2  LYS  89           HB2      LYS  89  11.358   3.503  -7.494
  761    HB3  LYS  89           HB3      LYS  89  11.962   2.942  -9.043
  762    HG2  LYS  89           HG2      LYS  89   9.065   2.791  -8.252
  763    HG3  LYS  89           HG3      LYS  89   9.771   4.185  -9.073
  764    HD2  LYS  89           HD2      LYS  89   9.970   1.385 -10.155
  765    HD3  LYS  89           HD3      LYS  89   8.629   2.467 -10.541
  766    HE2  LYS  89           HE2      LYS  89  10.164   4.085 -11.478
  767    HE3  LYS  89           HE3      LYS  89  11.541   3.087 -11.012
  768    HZ1  LYS  89           HZ1      LYS  89  11.028   1.503 -12.620
  769    HZ2  LYS  89           HZ2      LYS  89  10.697   2.966 -13.416
  770    HZ3  LYS  89           HZ3      LYS  89   9.427   2.037 -12.790
  771    H    ILE  90           H        ILE  90  13.099  -0.439  -7.872
  772    HA   ILE  90           HA       ILE  90  14.490   0.594  -5.483
  773    HB   ILE  90           HB       ILE  90  14.017  -2.314  -6.175
  774   HG12  ILE  90          HG12      ILE  90  11.999  -1.188  -5.313
  775   HG13  ILE  90          HG13      ILE  90  12.613  -2.389  -4.182
  776   HG21  ILE  90          HG21      ILE  90  16.163  -2.040  -5.124
  777   HG22  ILE  90          HG22      ILE  90  15.452  -1.053  -3.845
  778   HG23  ILE  90          HG23      ILE  90  15.040  -2.764  -3.971
  779   HD11  ILE  90          HD11      ILE  90  13.002   0.590  -3.988
  780   HD12  ILE  90          HD12      ILE  90  11.890  -0.386  -3.027
  781   HD13  ILE  90          HD13      ILE  90  13.632  -0.609  -2.855
  782    H    ARG  91           H        ARG  91  16.679   0.842  -5.697
  783    HA   ARG  91           HA       ARG  91  17.926  -0.402  -8.053
  784    HB2  ARG  91           HB2      ARG  91  17.992   2.156  -7.777
  785    HB3  ARG  91           HB3      ARG  91  19.077   1.854  -6.423
  786    HG2  ARG  91           HG2      ARG  91  20.638   0.705  -7.901
  787    HG3  ARG  91           HG3      ARG  91  19.569   1.017  -9.268
  788    HD2  ARG  91           HD2      ARG  91  20.942   3.093  -7.564
  789    HD3  ARG  91           HD3      ARG  91  21.395   2.625  -9.203
  790    HE   ARG  91           HE       ARG  91  18.990   4.131  -8.427
  791   HH11  ARG  91          HH11      ARG  91  21.187   2.973 -10.909
  792   HH12  ARG  91          HH12      ARG  91  20.473   3.952 -12.159
  793   HH21  ARG  91          HH21      ARG  91  18.089   5.429 -10.058
  794   HH22  ARG  91          HH22      ARG  91  18.723   5.350 -11.673
  795    H    MET  92           H        MET  92  19.258  -2.034  -7.678
  796    HA   MET  92           HA       MET  92  19.887  -2.814  -4.982
  797    HB2  MET  92           HB2      MET  92  19.942  -4.021  -7.667
  798    HB3  MET  92           HB3      MET  92  21.198  -4.591  -6.578
  799    HG2  MET  92           HG2      MET  92  19.003  -5.872  -6.675
  800    HG3  MET  92           HG3      MET  92  19.669  -5.501  -5.091
  801    HE1  MET  92           HE1      MET  92  16.022  -3.466  -7.021
  802    HE2  MET  92           HE2      MET  92  17.644  -3.376  -7.711
  803    HE3  MET  92           HE3      MET  92  16.800  -4.923  -7.641
  804    H    LEU  93           H        LEU  93  22.207  -3.842  -4.765
  805    HA   LEU  93           HA       LEU  93  23.813  -1.663  -4.172
  806    HB2  LEU  93           HB2      LEU  93  24.709  -4.526  -4.511
  807    HB3  LEU  93           HB3      LEU  93  25.598  -3.273  -3.676
  808    HG   LEU  93           HG       LEU  93  24.690  -4.471  -1.938
  809   HD11  LEU  93          HD11      LEU  93  22.633  -2.352  -2.505
  810   HD12  LEU  93          HD12      LEU  93  22.872  -3.158  -0.955
  811   HD13  LEU  93          HD13      LEU  93  24.150  -2.144  -1.627
  812   HD21  LEU  93          HD21      LEU  93  23.290  -5.922  -3.389
  813   HD22  LEU  93          HD22      LEU  93  22.532  -5.487  -1.856
  814   HD23  LEU  93          HD23      LEU  93  22.037  -4.683  -3.343
  815    H    ASP  94           H        ASP  94  23.926  -3.811  -6.961
  816    HA   ASP  94           HA       ASP  94  26.402  -2.652  -7.905
  817    HB2  ASP  94           HB2      ASP  94  26.318  -4.253  -9.669
  818    HB3  ASP  94           HB3      ASP  94  25.785  -5.080  -8.211
  819    H    GLY  95           H        GLY  95  23.216  -1.744  -7.982
  820    HA2  GLY  95           HA2      GLY  95  22.689   0.402  -8.934
  821    HA3  GLY  95           HA3      GLY  95  23.765   0.027 -10.273
  822    H    THR  96           H        THR  96  21.920  -2.665  -9.435
  823    HA   THR  96           HA       THR  96  20.500  -2.496 -11.921
  824    HB   THR  96           HB       THR  96  20.341  -4.574  -9.723
  825    HG1  THR  96           HG1      THR  96  22.349  -4.749 -10.567
  826   HG21  THR  96          HG21      THR  96  18.343  -4.595 -11.141
  827   HG22  THR  96          HG22      THR  96  19.339  -6.021 -11.431
  828   HG23  THR  96          HG23      THR  96  19.360  -4.684 -12.580
  829    H    VAL  97           H        VAL  97  18.505  -1.717 -12.221
  830    HA   VAL  97           HA       VAL  97  16.935  -1.092  -9.822
  831    HB   VAL  97           HB       VAL  97  16.459  -0.109 -12.637
  832   HG11  VAL  97          HG11      VAL  97  15.031   1.560 -11.552
  833   HG12  VAL  97          HG12      VAL  97  14.469  -0.078 -11.216
  834   HG13  VAL  97          HG13      VAL  97  15.355   0.822  -9.984
  835   HG21  VAL  97          HG21      VAL  97  17.428   1.989 -11.890
  836   HG22  VAL  97          HG22      VAL  97  17.819   1.251 -10.338
  837   HG23  VAL  97          HG23      VAL  97  18.592   0.667 -11.808
  838    H    LYS  98           H        LYS  98  15.095  -2.075  -9.414
  839    HA   LYS  98           HA       LYS  98  13.685  -3.212 -11.667
  840    HB2  LYS  98           HB2      LYS  98  13.200  -5.330 -10.693
  841    HB3  LYS  98           HB3      LYS  98  14.935  -5.104 -10.547
  842    HG2  LYS  98           HG2      LYS  98  14.794  -4.699  -8.234
  843    HG3  LYS  98           HG3      LYS  98  13.047  -4.464  -8.303
  844    HD2  LYS  98           HD2      LYS  98  14.410  -7.079  -8.936
  845    HD3  LYS  98           HD3      LYS  98  13.780  -6.673  -7.337
  846    HE2  LYS  98           HE2      LYS  98  12.030  -7.859  -8.258
  847    HE3  LYS  98           HE3      LYS  98  11.572  -6.191  -8.610
  848    HZ1  LYS  98           HZ1      LYS  98  11.242  -7.621 -10.528
  849    HZ2  LYS  98           HZ2      LYS  98  12.879  -8.071 -10.515
  850    HZ3  LYS  98           HZ3      LYS  98  12.443  -6.470 -10.855
  851    H    THR  99           H        THR  99  11.372  -3.593 -11.216
  852    HA   THR  99           HA       THR  99  10.437  -2.075  -8.878
  853    HB   THR  99           HB       THR  99   9.024  -2.335 -11.543
  854    HG1  THR  99           HG1      THR  99  11.088  -0.889 -11.096
  855   HG21  THR  99          HG21      THR  99   8.451  -0.607  -9.130
  856   HG22  THR  99          HG22      THR  99   7.536  -2.035  -9.617
  857   HG23  THR  99          HG23      THR  99   7.547  -0.601 -10.646
  858    H    ILE 100           H        ILE 100   9.306  -3.259  -7.471
  859    HA   ILE 100           HA       ILE 100   7.846  -5.606  -8.434
  860    HB   ILE 100           HB       ILE 100  10.075  -6.321  -7.552
  861   HG12  ILE 100          HG12      ILE 100   7.771  -7.609  -7.322
  862   HG13  ILE 100          HG13      ILE 100   9.250  -8.252  -6.627
  863   HG21  ILE 100          HG21      ILE 100  10.418  -4.634  -5.867
  864   HG22  ILE 100          HG22      ILE 100   9.046  -5.237  -4.938
  865   HG23  ILE 100          HG23      ILE 100  10.486  -6.235  -5.133
  866   HD11  ILE 100          HD11      ILE 100   7.108  -6.742  -5.151
  867   HD12  ILE 100          HD12      ILE 100   7.392  -8.481  -5.096
  868   HD13  ILE 100          HD13      ILE 100   8.595  -7.371  -4.442
  869    H    MET 101           H        MET 101   6.000  -6.114  -7.184
  870    HA   MET 101           HA       MET 101   5.060  -3.787  -5.702
  871    HB2  MET 101           HB2      MET 101   3.579  -6.212  -6.710
  872    HB3  MET 101           HB3      MET 101   2.834  -4.839  -5.900
  873    HG2  MET 101           HG2      MET 101   4.063  -3.502  -7.797
  874    HG3  MET 101           HG3      MET 101   3.963  -5.049  -8.635
  875    HE1  MET 101           HE1      MET 101   1.550  -3.427  -6.028
  876    HE2  MET 101           HE2      MET 101   2.058  -2.073  -7.037
  877    HE3  MET 101           HE3      MET 101   0.382  -2.623  -7.079
  878    H    VAL 102           H        VAL 102   5.358  -3.711  -3.703
  879    HA   VAL 102           HA       VAL 102   5.047  -6.131  -2.036
  880    HB   VAL 102           HB       VAL 102   6.624  -3.667  -1.291
  881   HG11  VAL 102          HG11      VAL 102   7.615  -5.124   0.405
  882   HG12  VAL 102          HG12      VAL 102   5.866  -4.995   0.595
  883   HG13  VAL 102          HG13      VAL 102   6.571  -6.444  -0.122
  884   HG21  VAL 102          HG21      VAL 102   8.643  -4.990  -1.801
  885   HG22  VAL 102          HG22      VAL 102   7.616  -6.240  -2.505
  886   HG23  VAL 102          HG23      VAL 102   7.670  -4.632  -3.230
  887    H    ASP 103           H        ASP 103   3.726  -6.036  -0.268
  888    HA   ASP 103           HA       ASP 103   1.515  -4.418  -0.175
  889    HB2  ASP 103           HB2      ASP 103   1.913  -6.513   1.153
  890    HB3  ASP 103           HB3      ASP 103   2.887  -5.560   2.265
  891    H    ASP 104           H        ASP 104   0.985  -2.442   0.687
  892    HA   ASP 104           HA       ASP 104   3.258  -0.738   1.391
  893    HB2  ASP 104           HB2      ASP 104   1.611  -0.077  -0.390
  894    HB3  ASP 104           HB3      ASP 104   0.392   0.064   0.870
  895    H    SER 105           H        SER 105   0.412  -2.159   2.743
  896    HA   SER 105           HA       SER 105   0.289  -0.400   5.031
  897    HB2  SER 105           HB2      SER 105  -1.418  -2.201   5.781
  898    HB3  SER 105           HB3      SER 105  -1.803  -1.212   4.373
  899    HG   SER 105           HG       SER 105  -0.382  -3.517   3.803
  900    H    LYS 106           H        LYS 106   2.847  -1.482   4.926
  901    HA   LYS 106           HA       LYS 106   2.927  -3.006   7.407
  902    HB2  LYS 106           HB2      LYS 106   4.715  -4.466   6.190
  903    HB3  LYS 106           HB3      LYS 106   3.004  -4.828   5.981
  904    HG2  LYS 106           HG2      LYS 106   3.516  -4.818   3.804
  905    HG3  LYS 106           HG3      LYS 106   3.381  -3.071   3.971
  906    HD2  LYS 106           HD2      LYS 106   5.404  -3.445   2.846
  907    HD3  LYS 106           HD3      LYS 106   5.863  -3.102   4.518
  908    HE2  LYS 106           HE2      LYS 106   7.068  -5.024   3.547
  909    HE3  LYS 106           HE3      LYS 106   6.126  -5.434   4.978
  910    HZ1  LYS 106           HZ1      LYS 106   5.854  -7.109   3.293
  911    HZ2  LYS 106           HZ2      LYS 106   5.339  -5.956   2.164
  912    HZ3  LYS 106           HZ3      LYS 106   4.383  -6.299   3.519
  913    H    THR 107           H        THR 107   5.572  -3.512   7.615
  914    HA   THR 107           HA       THR 107   6.657  -0.806   7.777
  915    HB   THR 107           HB       THR 107   8.366  -1.899   9.287
  916    HG1  THR 107           HG1      THR 107   6.601  -4.053   9.607
  917   HG21  THR 107          HG21      THR 107   6.816  -2.079  11.187
  918   HG22  THR 107          HG22      THR 107   5.455  -2.108  10.066
  919   HG23  THR 107          HG23      THR 107   6.466  -0.668  10.189
  920    H    VAL 108           H        VAL 108   9.221  -0.928   7.783
  921    HA   VAL 108           HA       VAL 108   9.947  -1.207   5.079
  922    HB   VAL 108           HB       VAL 108  11.758  -0.930   7.461
  923   HG11  VAL 108          HG11      VAL 108  12.948  -1.562   5.446
  924   HG12  VAL 108          HG12      VAL 108  12.191  -0.234   4.567
  925   HG13  VAL 108          HG13      VAL 108  13.314   0.108   5.883
  926   HG21  VAL 108          HG21      VAL 108  11.639   1.488   7.041
  927   HG22  VAL 108          HG22      VAL 108  10.404   1.194   5.817
  928   HG23  VAL 108          HG23      VAL 108  10.080   0.806   7.507
  929    H    THR 109           H        THR 109  11.137  -2.940   7.923
  930    HA   THR 109           HA       THR 109  12.846  -4.738   6.845
  931    HB   THR 109           HB       THR 109  10.879  -5.358   9.049
  932    HG1  THR 109           HG1      THR 109  12.667  -4.527  10.355
  933   HG21  THR 109          HG21      THR 109  12.644  -6.850   9.874
  934   HG22  THR 109          HG22      THR 109  13.637  -6.455   8.471
  935   HG23  THR 109          HG23      THR 109  12.120  -7.326   8.259
  936    H    ASP 110           H        ASP 110   9.303  -5.213   7.067
  937    HA   ASP 110           HA       ASP 110   9.384  -7.864   6.050
  938    HB2  ASP 110           HB2      ASP 110   7.486  -6.814   7.377
  939    HB3  ASP 110           HB3      ASP 110   7.023  -5.959   5.902
  940    H    MET 111           H        MET 111   9.076  -4.691   4.644
  941    HA   MET 111           HA       MET 111   8.396  -5.508   2.012
  942    HB2  MET 111           HB2      MET 111   7.863  -3.291   2.559
  943    HB3  MET 111           HB3      MET 111   9.449  -2.981   3.247
  944    HG2  MET 111           HG2      MET 111  10.417  -3.059   0.989
  945    HG3  MET 111           HG3      MET 111   8.801  -3.301   0.325
  946    HE1  MET 111           HE1      MET 111   8.937  -1.090   3.468
  947    HE2  MET 111           HE2      MET 111  10.624  -1.059   2.939
  948    HE3  MET 111           HE3      MET 111   9.648   0.412   2.880
  949    H    LEU 112           H        LEU 112  11.440  -4.669   3.611
  950    HA   LEU 112           HA       LEU 112  13.119  -4.943   1.375
  951    HB2  LEU 112           HB2      LEU 112  13.593  -4.069   3.800
  952    HB3  LEU 112           HB3      LEU 112  14.015  -5.741   4.120
  953    HG   LEU 112           HG       LEU 112  15.661  -5.584   2.201
  954   HD11  LEU 112          HD11      LEU 112  14.684  -3.659   1.086
  955   HD12  LEU 112          HD12      LEU 112  15.015  -2.654   2.497
  956   HD13  LEU 112          HD13      LEU 112  16.351  -3.318   1.554
  957   HD21  LEU 112          HD21      LEU 112  16.392  -5.495   4.506
  958   HD22  LEU 112          HD22      LEU 112  17.323  -4.359   3.529
  959   HD23  LEU 112          HD23      LEU 112  16.035  -3.769   4.579
  960    H    MET 113           H        MET 113  11.852  -7.230   3.700
  961    HA   MET 113           HA       MET 113  13.234  -9.546   3.011
  962    HB2  MET 113           HB2      MET 113  11.572  -9.229   4.889
  963    HB3  MET 113           HB3      MET 113  10.295  -9.369   3.695
  964    HG2  MET 113           HG2      MET 113  11.101 -11.628   3.136
  965    HG3  MET 113           HG3      MET 113  12.306 -11.485   4.417
  966    HE1  MET 113           HE1      MET 113  10.478  -9.754   6.528
  967    HE2  MET 113           HE2      MET 113   9.902 -11.058   7.565
  968    HE3  MET 113           HE3      MET 113  11.581 -11.035   7.026
  969    H    THR 114           H        THR 114  10.217  -8.248   1.725
  970    HA   THR 114           HA       THR 114   9.780 -10.243  -0.212
  971    HB   THR 114           HB       THR 114   8.805  -7.382  -0.198
  972    HG1  THR 114           HG1      THR 114   7.694  -9.773   0.910
  973   HG21  THR 114          HG21      THR 114   7.713  -9.839  -1.583
  974   HG22  THR 114          HG22      THR 114   8.485  -8.461  -2.370
  975   HG23  THR 114          HG23      THR 114   6.939  -8.254  -1.548
  976    H    ILE 115           H        ILE 115  11.550  -7.159  -0.346
  977    HA   ILE 115           HA       ILE 115  11.788  -7.172  -3.200
  978    HB   ILE 115           HB       ILE 115  13.346  -5.590  -1.149
  979   HG12  ILE 115          HG12      ILE 115  10.971  -4.766  -2.836
  980   HG13  ILE 115          HG13      ILE 115  10.888  -5.186  -1.128
  981   HG21  ILE 115          HG21      ILE 115  13.084  -5.223  -4.133
  982   HG22  ILE 115          HG22      ILE 115  13.884  -4.098  -3.034
  983   HG23  ILE 115          HG23      ILE 115  14.534  -5.722  -3.262
  984   HD11  ILE 115          HD11      ILE 115  12.358  -3.312  -0.598
  985   HD12  ILE 115          HD12      ILE 115  12.435  -2.891  -2.308
  986   HD13  ILE 115          HD13      ILE 115  10.903  -2.782  -1.443
  987    H    CYS 116           H        CYS 116  14.014  -7.869  -0.509
  988    HA   CYS 116           HA       CYS 116  16.261  -8.422  -2.127
  989    HB2  CYS 116           HB2      CYS 116  15.593  -9.375   0.661
  990    HB3  CYS 116           HB3      CYS 116  17.173  -9.519  -0.096
  991    HG   CYS 116           HG       CYS 116  16.541  -6.420  -0.409
  992    H    ALA 117           H        ALA 117  13.540 -10.335  -1.103
  993    HA   ALA 117           HA       ALA 117  14.578 -12.889  -1.734
  994    HB1  ALA 117           HB1      ALA 117  12.258 -13.629  -1.669
  995    HB2  ALA 117           HB2      ALA 117  12.612 -12.559  -0.312
  996    HB3  ALA 117           HB3      ALA 117  11.709 -11.953  -1.703
  997    H    ARG 118           H        ARG 118  13.153 -10.331  -3.636
  998    HA   ARG 118           HA       ARG 118  12.576 -11.892  -5.945
  999    HB2  ARG 118           HB2      ARG 118  13.222  -8.929  -5.902
 1000    HB3  ARG 118           HB3      ARG 118  12.325  -9.812  -7.130
 1001    HG2  ARG 118           HG2      ARG 118  11.440  -9.267  -4.309
 1002    HG3  ARG 118           HG3      ARG 118  10.809  -8.535  -5.783
 1003    HD2  ARG 118           HD2      ARG 118  10.633 -11.451  -5.040
 1004    HD3  ARG 118           HD3      ARG 118   9.325 -10.276  -4.936
 1005    HE   ARG 118           HE       ARG 118  10.554 -10.696  -7.557
 1006   HH11  ARG 118          HH11      ARG 118   7.861 -11.295  -5.392
 1007   HH12  ARG 118          HH12      ARG 118   6.788 -11.791  -6.659
 1008   HH21  ARG 118          HH21      ARG 118   9.136 -11.332  -9.226
 1009   HH22  ARG 118          HH22      ARG 118   7.507 -11.814  -8.837
 1010    H    ILE 119           H        ILE 119  15.393 -10.117  -4.798
 1011    HA   ILE 119           HA       ILE 119  16.885 -10.403  -7.212
 1012    HB   ILE 119           HB       ILE 119  18.278 -10.059  -4.599
 1013   HG12  ILE 119          HG12      ILE 119  16.240  -8.719  -4.295
 1014   HG13  ILE 119          HG13      ILE 119  17.660  -7.695  -4.453
 1015   HG21  ILE 119          HG21      ILE 119  18.492  -8.675  -7.267
 1016   HG22  ILE 119          HG22      ILE 119  19.556  -8.414  -5.885
 1017   HG23  ILE 119          HG23      ILE 119  19.521  -9.985  -6.685
 1018   HD11  ILE 119          HD11      ILE 119  17.064  -7.227  -6.772
 1019   HD12  ILE 119          HD12      ILE 119  15.642  -8.257  -6.610
 1020   HD13  ILE 119          HD13      ILE 119  15.771  -6.778  -5.660
 1021    H    GLY 120           H        GLY 120  16.460 -12.236  -4.276
 1022    HA2  GLY 120           HA2      GLY 120  16.854 -14.633  -4.343
 1023    HA3  GLY 120           HA3      GLY 120  18.250 -14.310  -5.365
 1024    H    ILE 121           H        ILE 121  17.725 -12.175  -2.741
 1025    HA   ILE 121           HA       ILE 121  20.143 -13.154  -1.443
 1026    HB   ILE 121           HB       ILE 121  18.454 -10.744  -0.763
 1027   HG12  ILE 121          HG12      ILE 121  21.022 -10.847  -2.357
 1028   HG13  ILE 121          HG13      ILE 121  19.421 -10.647  -3.061
 1029   HG21  ILE 121          HG21      ILE 121  19.808 -11.478   1.097
 1030   HG22  ILE 121          HG22      ILE 121  21.240 -11.523   0.070
 1031   HG23  ILE 121          HG23      ILE 121  20.466  -9.984   0.433
 1032   HD11  ILE 121          HD11      ILE 121  20.590  -8.520  -2.884
 1033   HD12  ILE 121          HD12      ILE 121  19.155  -8.537  -1.861
 1034   HD13  ILE 121          HD13      ILE 121  20.753  -8.741  -1.143
 1035    H    THR 122           H        THR 122  20.129 -14.327   0.390
 1036    HA   THR 122           HA       THR 122  17.559 -15.119   1.481
 1037    HB   THR 122           HB       THR 122  20.344 -16.030   2.233
 1038    HG1  THR 122           HG1      THR 122  18.647 -16.626   0.141
 1039   HG21  THR 122          HG21      THR 122  17.636 -17.236   2.836
 1040   HG22  THR 122          HG22      THR 122  18.700 -16.449   4.003
 1041   HG23  THR 122          HG23      THR 122  19.196 -17.957   3.234
 1042    H    ASN 123           H        ASN 123  20.600 -13.831   2.834
 1043    HA   ASN 123           HA       ASN 123  19.211 -13.014   5.242
 1044    HB2  ASN 123           HB2      ASN 123  21.475 -12.166   5.941
 1045    HB3  ASN 123           HB3      ASN 123  21.406 -13.890   5.614
 1046   HD21  ASN 123          HD21      ASN 123  23.692 -12.135   5.661
 1047   HD22  ASN 123          HD22      ASN 123  24.419 -12.233   4.097
 1048    H    HIS 124           H        HIS 124  17.939 -11.325   5.022
 1049    HA   HIS 124           HA       HIS 124  18.698  -9.233   3.096
 1050    HB2  HIS 124           HB2      HIS 124  16.328  -8.711   2.930
 1051    HB3  HIS 124           HB3      HIS 124  16.578 -10.431   2.655
 1052    HD1  HIS 124           HD1      HIS 124  15.067  -8.018   5.082
 1053    HD2  HIS 124           HD2      HIS 124  15.499 -12.121   4.619
 1054    HE1  HIS 124           HE1      HIS 124  13.512  -9.054   6.764
 1055    HE2  HIS 124           HE2      HIS 124  13.810 -11.547   6.487
 1056    H    ASP 125           H        ASP 125  18.715  -9.741   6.370
 1057    HA   ASP 125           HA       ASP 125  17.667  -7.149   7.129
 1058    HB2  ASP 125           HB2      ASP 125  18.932  -9.360   8.761
 1059    HB3  ASP 125           HB3      ASP 125  18.287  -7.868   9.439
 1060    H    GLU 126           H        GLU 126  20.464  -8.358   5.904
 1061    HA   GLU 126           HA       GLU 126  22.403  -6.845   7.342
 1062    HB2  GLU 126           HB2      GLU 126  22.654  -7.931   4.540
 1063    HB3  GLU 126           HB3      GLU 126  23.955  -7.524   5.647
 1064    HG2  GLU 126           HG2      GLU 126  21.985  -9.777   5.943
 1065    HG3  GLU 126           HG3      GLU 126  23.688  -9.912   5.514
 1066    H    TYR 127           H        TYR 127  19.940  -5.832   5.480
 1067    HA   TYR 127           HA       TYR 127  21.453  -3.601   4.295
 1068    HB2  TYR 127           HB2      TYR 127  18.927  -4.877   3.238
 1069    HB3  TYR 127           HB3      TYR 127  19.806  -3.545   2.496
 1070    HD1  TYR 127           HD1      TYR 127  22.194  -3.993   1.731
 1071    HD2  TYR 127           HD2      TYR 127  19.446  -7.078   2.714
 1072    HE1  TYR 127           HE1      TYR 127  23.545  -5.587   0.456
 1073    HE2  TYR 127           HE2      TYR 127  20.784  -8.687   1.444
 1074    HH   TYR 127           HH       TYR 127  22.423  -8.699  -0.372
 1075    H    SER 128           H        SER 128  20.509  -1.562   4.310
 1076    HA   SER 128           HA       SER 128  17.992  -1.295   5.803
 1077    HB2  SER 128           HB2      SER 128  18.768   1.110   6.114
 1078    HB3  SER 128           HB3      SER 128  19.689  -0.108   6.996
 1079    HG   SER 128           HG       SER 128  20.991   1.467   5.878
 1080    H    LEU 129           H        LEU 129  17.026   1.067   4.959
 1081    HA   LEU 129           HA       LEU 129  17.101   0.868   2.027
 1082    HB2  LEU 129           HB2      LEU 129  15.025  -0.098   3.412
 1083    HB3  LEU 129           HB3      LEU 129  14.530   1.581   3.345
 1084    HG   LEU 129           HG       LEU 129  15.252   0.076   0.841
 1085   HD11  LEU 129          HD11      LEU 129  12.545   0.211   2.164
 1086   HD12  LEU 129          HD12      LEU 129  12.880  -0.437   0.557
 1087   HD13  LEU 129          HD13      LEU 129  13.543  -1.231   1.984
 1088   HD21  LEU 129          HD21      LEU 129  15.079   2.505   0.674
 1089   HD22  LEU 129          HD22      LEU 129  13.766   1.716  -0.199
 1090   HD23  LEU 129          HD23      LEU 129  13.463   2.446   1.378
 1091    H    VAL 130           H        VAL 130  16.829   2.803   0.912
 1092    HA   VAL 130           HA       VAL 130  16.432   5.239   2.477
 1093    HB   VAL 130           HB       VAL 130  18.812   5.180   2.419
 1094   HG11  VAL 130          HG11      VAL 130  20.090   4.875   0.364
 1095   HG12  VAL 130          HG12      VAL 130  19.100   3.467   0.751
 1096   HG13  VAL 130          HG13      VAL 130  18.589   4.583  -0.514
 1097   HG21  VAL 130          HG21      VAL 130  17.878   6.938   0.155
 1098   HG22  VAL 130          HG22      VAL 130  17.894   7.360   1.868
 1099   HG23  VAL 130          HG23      VAL 130  19.412   7.091   1.013
 1100    H    ARG 131           H        ARG 131  14.990   6.496   1.504
 1101    HA   ARG 131           HA       ARG 131  14.290   5.823  -1.274
 1102    HB2  ARG 131           HB2      ARG 131  12.610   7.333   0.721
 1103    HB3  ARG 131           HB3      ARG 131  12.088   6.608  -0.791
 1104    HG2  ARG 131           HG2      ARG 131  12.513   4.384   0.143
 1105    HG3  ARG 131           HG3      ARG 131  12.994   5.133   1.669
 1106    HD2  ARG 131           HD2      ARG 131  10.726   4.464   1.911
 1107    HD3  ARG 131           HD3      ARG 131  10.739   6.222   1.732
 1108    HE   ARG 131           HE       ARG 131  10.006   5.908  -0.559
 1109   HH11  ARG 131          HH11      ARG 131   9.740   3.133   1.555
 1110   HH12  ARG 131          HH12      ARG 131   8.502   2.365   0.619
 1111   HH21  ARG 131          HH21      ARG 131   8.361   4.899  -1.809
 1112   HH22  ARG 131          HH22      ARG 131   7.712   3.374  -1.296
 1113    H    GLU 132           H        GLU 132  15.551   7.198  -2.477
 1114    HA   GLU 132           HA       GLU 132  15.614  10.008  -1.904
 1115    HB2  GLU 132           HB2      GLU 132  16.420   8.449  -4.372
 1116    HB3  GLU 132           HB3      GLU 132  16.577  10.192  -4.238
 1117    HG2  GLU 132           HG2      GLU 132  18.041   9.776  -2.221
 1118    HG3  GLU 132           HG3      GLU 132  18.042   8.074  -2.701
 1119    H    LEU 133           H        LEU 133  13.741  11.079  -2.019
 1120    HA   LEU 133           HA       LEU 133  11.870  10.296  -4.131
 1121    HB2  LEU 133           HB2      LEU 133  11.140  12.195  -1.947
 1122    HB3  LEU 133           HB3      LEU 133  10.112  11.157  -2.897
 1123    HG   LEU 133           HG       LEU 133  11.896  10.320  -0.619
 1124   HD11  LEU 133          HD11      LEU 133   8.920  10.275  -1.057
 1125   HD12  LEU 133          HD12      LEU 133   9.752   9.591   0.344
 1126   HD13  LEU 133          HD13      LEU 133   9.806  11.330   0.044
 1127   HD21  LEU 133          HD21      LEU 133  11.999   8.631  -2.377
 1128   HD22  LEU 133          HD22      LEU 133  11.064   8.055  -0.997
 1129   HD23  LEU 133          HD23      LEU 133  10.237   8.599  -2.457
 1130    H    MET 134           H        MET 134  10.404  12.178  -4.704
 1131    HA   MET 134           HA       MET 134  12.000  14.583  -5.339
 1132    HB2  MET 134           HB2      MET 134  10.382  14.623  -7.390
 1133    HB3  MET 134           HB3      MET 134  11.770  13.539  -7.419
 1134    HG2  MET 134           HG2      MET 134  10.462  11.754  -7.581
 1135    HG3  MET 134           HG3      MET 134   9.526  12.254  -6.185
 1136    HE1  MET 134           HE1      MET 134   6.621  14.258  -7.575
 1137    HE2  MET 134           HE2      MET 134   7.390  13.493  -6.180
 1138    HE3  MET 134           HE3      MET 134   8.130  14.909  -6.931
 1139    H    GLU 135           H        GLU 135   9.739  13.429  -3.456
 1140    HA   GLU 135           HA       GLU 135   7.348  14.727  -3.839
 1141    HB2  GLU 135           HB2      GLU 135   8.780  13.779  -1.391
 1142    HB3  GLU 135           HB3      GLU 135   7.181  14.502  -1.283
 1143    HG2  GLU 135           HG2      GLU 135   6.505  12.743  -3.028
 1144    HG3  GLU 135           HG3      GLU 135   8.020  11.947  -2.590
 1145    H    GLU 136           H        GLU 136   6.672  16.719  -3.708
 1146    HA   GLU 136           HA       GLU 136   8.247  18.945  -3.068
 1147    HB2  GLU 136           HB2      GLU 136   6.092  20.170  -3.099
 1148    HB3  GLU 136           HB3      GLU 136   6.280  19.097  -4.481
 1149    HG2  GLU 136           HG2      GLU 136   4.911  17.406  -3.279
 1150    HG3  GLU 136           HG3      GLU 136   4.619  18.605  -2.021
 1151    H    LYS 137           H        LYS 137   6.474  16.773  -1.102
 1152    HA   LYS 137           HA       LYS 137   6.086  18.566   1.113
 1153    HB2  LYS 137           HB2      LYS 137   5.785  15.564   0.944
 1154    HB3  LYS 137           HB3      LYS 137   5.230  16.574   2.272
 1155    HG2  LYS 137           HG2      LYS 137   3.664  17.697   0.805
 1156    HG3  LYS 137           HG3      LYS 137   4.257  16.766  -0.571
 1157    HD2  LYS 137           HD2      LYS 137   3.518  14.701   0.519
 1158    HD3  LYS 137           HD3      LYS 137   2.915  15.642   1.885
 1159    HE2  LYS 137           HE2      LYS 137   1.963  15.902  -0.964
 1160    HE3  LYS 137           HE3      LYS 137   1.136  14.997   0.301
 1161    HZ1  LYS 137           HZ1      LYS 137   0.973  17.105   1.564
 1162    HZ2  LYS 137           HZ2      LYS 137   0.120  17.126   0.101
 1163    HZ3  LYS 137           HZ3      LYS 137   1.608  17.930   0.221
 1164    H    LYS 138           H        LYS 138   7.980  15.574   0.705
 1165    HA   LYS 138           HA       LYS 138   9.621  16.333   2.994
 1166    HB2  LYS 138           HB2      LYS 138   9.351  13.798   1.410
 1167    HB3  LYS 138           HB3      LYS 138  10.695  14.048   2.512
 1168    HG2  LYS 138           HG2      LYS 138   9.358  13.064   3.964
 1169    HG3  LYS 138           HG3      LYS 138   8.633  14.662   4.123
 1170    HD2  LYS 138           HD2      LYS 138   6.824  13.180   3.824
 1171    HD3  LYS 138           HD3      LYS 138   7.061  13.951   2.252
 1172    HE2  LYS 138           HE2      LYS 138   8.338  12.003   1.498
 1173    HE3  LYS 138           HE3      LYS 138   8.091  11.236   3.066
 1174    HZ1  LYS 138           HZ1      LYS 138   6.532  10.439   1.389
 1175    HZ2  LYS 138           HZ2      LYS 138   5.936  12.002   1.168
 1176    HZ3  LYS 138           HZ3      LYS 138   5.722  11.214   2.657
 1177    H    ASP 169           H        ASP 169  10.329  14.870  -0.140
 1178    HA   ASP 169           HA       ASP 169  12.254  14.686  -1.283
 1179    HB2  ASP 169           HB2      ASP 169  11.490  17.055  -1.842
 1180    HB3  ASP 169           HB3      ASP 169  12.672  17.610  -0.663
 1181    H    GLU 170           H        GLU 170  12.928  13.380   0.485
 1182    HA   GLU 170           HA       GLU 170  15.352  14.434   1.749
 1183    HB2  GLU 170           HB2      GLU 170  13.383  12.551   3.072
 1184    HB3  GLU 170           HB3      GLU 170  14.850  13.201   3.785
 1185    HG2  GLU 170           HG2      GLU 170  13.886  15.446   3.717
 1186    HG3  GLU 170           HG3      GLU 170  12.410  14.783   3.015
 1187    H    LEU 171           H        LEU 171  16.728  12.538   2.517
 1188    HA   LEU 171           HA       LEU 171  17.020  10.592   0.460
 1189    HB2  LEU 171           HB2      LEU 171  18.187  10.567   3.244
 1190    HB3  LEU 171           HB3      LEU 171  18.746   9.627   1.872
 1191    HG   LEU 171           HG       LEU 171  18.932  12.598   2.253
 1192   HD11  LEU 171          HD11      LEU 171  21.331  12.192   2.028
 1193   HD12  LEU 171          HD12      LEU 171  20.647  11.285   3.378
 1194   HD13  LEU 171          HD13      LEU 171  21.022  10.464   1.862
 1195   HD21  LEU 171          HD21      LEU 171  19.971  12.652   0.023
 1196   HD22  LEU 171          HD22      LEU 171  19.551  10.951  -0.192
 1197   HD23  LEU 171          HD23      LEU 171  18.274  12.163  -0.038
 1198    H    ASN 172           H        ASN 172  15.290  10.798   3.412
 1199    HA   ASN 172           HA       ASN 172  13.971   9.353   4.578
 1200    HB2  ASN 172           HB2      ASN 172  13.406   8.672   1.708
 1201    HB3  ASN 172           HB3      ASN 172  12.569   7.843   3.003
 1202   HD21  ASN 172          HD21      ASN 172  12.689  10.566   1.041
 1203   HD22  ASN 172          HD22      ASN 172  11.445  11.492   1.812
 1204    H    TRP 173           H        TRP 173  15.981   8.305   5.470
 1205    HA   TRP 173           HA       TRP 173  16.733   5.784   4.262
 1206    HB2  TRP 173           HB2      TRP 173  17.740   7.491   6.507
 1207    HB3  TRP 173           HB3      TRP 173  18.128   5.772   6.517
 1208    HD1  TRP 173           HD1      TRP 173  18.862   9.012   4.614
 1209    HE1  TRP 173           HE1      TRP 173  20.927   8.643   3.140
 1210    HE3  TRP 173           HE3      TRP 173  19.434   3.976   5.278
 1211    HZ2  TRP 173           HZ2      TRP 173  22.592   6.497   2.359
 1212    HZ3  TRP 173           HZ3      TRP 173  21.290   2.842   4.130
 1213    HH2  TRP 173           HH2      TRP 173  22.834   4.078   2.701
 1214    H    LEU 174           H        LEU 174  15.132   4.313   4.527
 1215    HA   LEU 174           HA       LEU 174  13.263   4.329   6.606
 1216    HB2  LEU 174           HB2      LEU 174  14.097   2.067   4.803
 1217    HB3  LEU 174           HB3      LEU 174  12.695   2.046   5.852
 1218    HG   LEU 174           HG       LEU 174  13.128   3.584   3.324
 1219   HD11  LEU 174          HD11      LEU 174  10.959   1.810   4.432
 1220   HD12  LEU 174          HD12      LEU 174  10.847   2.682   2.896
 1221   HD13  LEU 174          HD13      LEU 174  12.083   1.445   3.122
 1222   HD21  LEU 174          HD21      LEU 174  10.928   4.746   3.926
 1223   HD22  LEU 174          HD22      LEU 174  11.301   4.303   5.592
 1224   HD23  LEU 174          HD23      LEU 174  12.401   5.346   4.694
 1225    H    ASP 175           H        ASP 175  13.212   3.525   8.551
 1226    HA   ASP 175           HA       ASP 175  15.780   2.863   9.713
 1227    HB2  ASP 175           HB2      ASP 175  14.820   3.498  11.766
 1228    HB3  ASP 175           HB3      ASP 175  14.067   4.568  10.585
 1229    H    HIS 176           H        HIS 176  13.129   1.081   8.646
 1230    HA   HIS 176           HA       HIS 176  12.615  -1.139   8.769
 1231    HB2  HIS 176           HB2      HIS 176  15.017  -1.226  10.569
 1232    HB3  HIS 176           HB3      HIS 176  13.961  -2.624  10.388
 1233    HD1  HIS 176           HD1      HIS 176  13.780  -3.616   7.947
 1234    HD2  HIS 176           HD2      HIS 176  16.844  -0.902   8.568
 1235    HE1  HIS 176           HE1      HIS 176  15.284  -3.839   5.949
 1236    HE2  HIS 176           HE2      HIS 176  17.314  -2.481   6.567
 1237    H    GLY 177           H        GLY 177  11.426   0.961  10.390
 1238    HA2  GLY 177           HA2      GLY 177  10.111  -0.841  12.293
 1239    HA3  GLY 177           HA3      GLY 177  10.820   0.632  12.934
 1240    H    ARG 178           H        ARG 178  10.200   2.399  10.883
 1241    HA   ARG 178           HA       ARG 178   7.432   2.886  11.511
 1242    HB2  ARG 178           HB2      ARG 178   8.978   4.732  11.523
 1243    HB3  ARG 178           HB3      ARG 178   9.461   4.402   9.868
 1244    HG2  ARG 178           HG2      ARG 178   7.357   5.129   9.027
 1245    HG3  ARG 178           HG3      ARG 178   6.677   5.224  10.655
 1246    HD2  ARG 178           HD2      ARG 178   7.383   7.418   9.608
 1247    HD3  ARG 178           HD3      ARG 178   8.020   7.080  11.216
 1248    HE   ARG 178           HE       ARG 178   9.889   6.146   9.390
 1249   HH11  ARG 178          HH11      ARG 178   8.462   9.227  10.270
 1250   HH12  ARG 178          HH12      ARG 178   9.901  10.133   9.881
 1251   HH21  ARG 178          HH21      ARG 178  11.779   7.331   8.911
 1252   HH22  ARG 178          HH22      ARG 178  11.777   9.056   9.133
 1253    H    THR 179           H        THR 179   5.681   2.816  10.166
 1254    HA   THR 179           HA       THR 179   5.868   1.105   7.878
 1255    HB   THR 179           HB       THR 179   3.901   1.027   9.334
 1256    HG1  THR 179           HG1      THR 179   3.562   0.371   7.198
 1257   HG21  THR 179          HG21      THR 179   3.295   3.784   8.274
 1258   HG22  THR 179          HG22      THR 179   3.750   3.389   9.931
 1259   HG23  THR 179          HG23      THR 179   2.220   2.808   9.273
 1260    H    LEU 180           H        LEU 180   4.412   1.901   5.905
 1261    HA   LEU 180           HA       LEU 180   6.098   3.984   4.777
 1262    HB2  LEU 180           HB2      LEU 180   4.165   2.111   3.420
 1263    HB3  LEU 180           HB3      LEU 180   5.386   3.103   2.638
 1264    HG   LEU 180           HG       LEU 180   6.003   0.893   4.595
 1265   HD11  LEU 180          HD11      LEU 180   6.042   0.887   1.588
 1266   HD12  LEU 180          HD12      LEU 180   6.777  -0.353   2.609
 1267   HD13  LEU 180          HD13      LEU 180   5.031  -0.096   2.649
 1268   HD21  LEU 180          HD21      LEU 180   7.695   2.638   4.494
 1269   HD22  LEU 180          HD22      LEU 180   8.283   1.142   3.767
 1270   HD23  LEU 180          HD23      LEU 180   7.767   2.479   2.738
 1271    H    ARG 181           H        ARG 181   2.690   3.321   5.373
 1272    HA   ARG 181           HA       ARG 181   1.769   5.557   3.841
 1273    HB2  ARG 181           HB2      ARG 181   0.443   3.471   4.311
 1274    HB3  ARG 181           HB3      ARG 181   0.261   4.030   5.967
 1275    HG2  ARG 181           HG2      ARG 181  -1.685   4.473   4.457
 1276    HG3  ARG 181           HG3      ARG 181  -1.047   5.884   5.297
 1277    HD2  ARG 181           HD2      ARG 181  -1.615   6.215   2.859
 1278    HD3  ARG 181           HD3      ARG 181   0.011   6.691   3.342
 1279    HE   ARG 181           HE       ARG 181  -0.040   4.013   2.382
 1280   HH11  ARG 181          HH11      ARG 181  -0.161   7.336   1.287
 1281   HH12  ARG 181          HH12      ARG 181   0.626   7.004  -0.229
 1282   HH21  ARG 181          HH21      ARG 181   1.033   3.576   0.415
 1283   HH22  ARG 181          HH22      ARG 181   1.298   4.865  -0.728
 1284    H    GLU 182           H        GLU 182   3.043   5.170   6.968
 1285    HA   GLU 182           HA       GLU 182   1.925   7.629   8.040
 1286    HB2  GLU 182           HB2      GLU 182   2.404   5.762   9.552
 1287    HB3  GLU 182           HB3      GLU 182   4.086   5.757   9.057
 1288    HG2  GLU 182           HG2      GLU 182   3.837   6.764  11.232
 1289    HG3  GLU 182           HG3      GLU 182   4.392   7.959  10.062
 1290    H    GLN 183           H        GLN 183   4.631   6.556   6.205
 1291    HA   GLN 183           HA       GLN 183   6.073   9.052   6.538
 1292    HB2  GLN 183           HB2      GLN 183   6.563   6.642   4.785
 1293    HB3  GLN 183           HB3      GLN 183   7.610   8.055   4.826
 1294    HG2  GLN 183           HG2      GLN 183   8.069   7.658   7.183
 1295    HG3  GLN 183           HG3      GLN 183   7.005   6.251   7.156
 1296   HE21  GLN 183          HE21      GLN 183   7.681   4.377   6.186
 1297   HE22  GLN 183          HE22      GLN 183   9.309   4.126   5.658
 1298    H    GLY 184           H        GLY 184   3.641   7.683   4.594
 1299    HA2  GLY 184           HA2      GLY 184   2.354   8.547   2.911
 1300    HA3  GLY 184           HA3      GLY 184   3.021  10.118   3.332
 1301    H    VAL 185           H        VAL 185   4.927   7.371   2.295
 1302    HA   VAL 185           HA       VAL 185   6.142   8.922   0.220
 1303    HB   VAL 185           HB       VAL 185   7.404   6.819  -0.261
 1304   HG11  VAL 185          HG11      VAL 185   8.223   8.445   1.373
 1305   HG12  VAL 185          HG12      VAL 185   7.297   7.641   2.643
 1306   HG13  VAL 185          HG13      VAL 185   8.633   6.799   1.855
 1307   HG21  VAL 185          HG21      VAL 185   7.139   4.916   1.265
 1308   HG22  VAL 185          HG22      VAL 185   5.765   5.719   2.026
 1309   HG23  VAL 185          HG23      VAL 185   5.665   5.208   0.341
 1310    H    GLU 186           H        GLU 186   5.774   8.882  -1.938
 1311    HA   GLU 186           HA       GLU 186   3.359   7.654  -2.864
 1312    HB2  GLU 186           HB2      GLU 186   5.443   9.265  -4.355
 1313    HB3  GLU 186           HB3      GLU 186   3.909   8.738  -5.021
 1314    HG2  GLU 186           HG2      GLU 186   4.118  10.474  -2.593
 1315    HG3  GLU 186           HG3      GLU 186   4.021  11.114  -4.228
 1316    H    GLU 187           H        GLU 187   3.527   6.682  -5.176
 1317    HA   GLU 187           HA       GLU 187   5.170   4.309  -4.791
 1318    HB2  GLU 187           HB2      GLU 187   2.714   4.965  -6.342
 1319    HB3  GLU 187           HB3      GLU 187   3.659   3.551  -6.784
 1320    HG2  GLU 187           HG2      GLU 187   2.012   2.732  -5.358
 1321    HG3  GLU 187           HG3      GLU 187   3.444   2.857  -4.343
 1322    H    HIS 188           H        HIS 188   5.391   7.146  -6.522
 1323    HA   HIS 188           HA       HIS 188   6.742   5.875  -8.800
 1324    HB2  HIS 188           HB2      HIS 188   6.604   8.170  -9.837
 1325    HB3  HIS 188           HB3      HIS 188   5.052   7.395  -9.533
 1326    HD1  HIS 188           HD1      HIS 188   3.389   8.724  -8.258
 1327    HD2  HIS 188           HD2      HIS 188   7.261  10.160  -7.755
 1328    HE1  HIS 188           HE1      HIS 188   3.176  10.804  -6.858
 1329    HE2  HIS 188           HE2      HIS 188   5.537  11.531  -6.416
 1330    H    GLU 189           H        GLU 189   7.642   6.808  -5.889
 1331    HA   GLU 189           HA       GLU 189   9.928   8.468  -6.566
 1332    HB2  GLU 189           HB2      GLU 189   9.398   7.152  -3.910
 1333    HB3  GLU 189           HB3      GLU 189  10.299   8.621  -4.241
 1334    HG2  GLU 189           HG2      GLU 189   7.338   8.388  -4.667
 1335    HG3  GLU 189           HG3      GLU 189   8.062   8.924  -3.154
 1336    H    THR 190           H        THR 190  12.075   7.729  -6.736
 1337    HA   THR 190           HA       THR 190  12.480   4.888  -6.895
 1338    HB   THR 190           HB       THR 190  14.592   7.037  -7.079
 1339    HG1  THR 190           HG1      THR 190  12.606   7.051  -8.583
 1340   HG21  THR 190          HG21      THR 190  15.773   5.365  -8.451
 1341   HG22  THR 190          HG22      THR 190  14.465   4.216  -8.178
 1342   HG23  THR 190          HG23      THR 190  15.463   4.751  -6.828
 1343    H    LEU 191           H        LEU 191  13.335   3.553  -5.431
 1344    HA   LEU 191           HA       LEU 191  14.423   4.728  -2.947
 1345    HB2  LEU 191           HB2      LEU 191  13.157   2.002  -3.060
 1346    HB3  LEU 191           HB3      LEU 191  13.472   2.997  -1.658
 1347    HG   LEU 191           HG       LEU 191  11.184   3.104  -1.805
 1348   HD11  LEU 191          HD11      LEU 191  12.052   5.422  -3.508
 1349   HD12  LEU 191          HD12      LEU 191  10.511   5.282  -2.663
 1350   HD13  LEU 191          HD13      LEU 191  12.014   5.369  -1.745
 1351   HD21  LEU 191          HD21      LEU 191  10.938   1.844  -3.853
 1352   HD22  LEU 191          HD22      LEU 191   9.896   3.268  -3.872
 1353   HD23  LEU 191          HD23      LEU 191  11.396   3.259  -4.801
 1354    H    LEU 192           H        LEU 192  16.289   3.667  -2.054
 1355    HA   LEU 192           HA       LEU 192  17.595   1.856  -3.979
 1356    HB2  LEU 192           HB2      LEU 192  19.102   3.528  -2.018
 1357    HB3  LEU 192           HB3      LEU 192  19.616   2.916  -3.577
 1358    HG   LEU 192           HG       LEU 192  17.519   5.057  -3.330
 1359   HD11  LEU 192          HD11      LEU 192  19.528   5.826  -2.188
 1360   HD12  LEU 192          HD12      LEU 192  20.494   5.418  -3.607
 1361   HD13  LEU 192          HD13      LEU 192  19.277   6.692  -3.704
 1362   HD21  LEU 192          HD21      LEU 192  17.673   3.874  -5.467
 1363   HD22  LEU 192          HD22      LEU 192  18.181   5.558  -5.615
 1364   HD23  LEU 192          HD23      LEU 192  19.389   4.272  -5.561
 1365    H    LEU 193           H        LEU 193  18.318  -0.066  -3.234
 1366    HA   LEU 193           HA       LEU 193  18.067  -0.714  -0.428
 1367    HB2  LEU 193           HB2      LEU 193  17.434  -2.281  -2.255
 1368    HB3  LEU 193           HB3      LEU 193  19.111  -2.346  -2.751
 1369    HG   LEU 193           HG       LEU 193  18.455  -3.124   0.053
 1370   HD11  LEU 193          HD11      LEU 193  17.957  -5.401  -0.680
 1371   HD12  LEU 193          HD12      LEU 193  16.752  -4.262  -1.283
 1372   HD13  LEU 193          HD13      LEU 193  18.005  -4.873  -2.362
 1373   HD21  LEU 193          HD21      LEU 193  20.400  -4.102  -2.035
 1374   HD22  LEU 193          HD22      LEU 193  20.771  -3.086  -0.642
 1375   HD23  LEU 193          HD23      LEU 193  20.254  -4.757  -0.404
 1376    H    ARG 194           H        ARG 194  19.691  -0.629   1.028
 1377    HA   ARG 194           HA       ARG 194  22.418  -0.162   0.008
 1378    HB2  ARG 194           HB2      ARG 194  21.029   1.126   2.362
 1379    HB3  ARG 194           HB3      ARG 194  22.743   1.293   2.013
 1380    HG2  ARG 194           HG2      ARG 194  20.525   2.162   0.180
 1381    HG3  ARG 194           HG3      ARG 194  21.399   3.221   1.286
 1382    HD2  ARG 194           HD2      ARG 194  22.473   1.742  -1.103
 1383    HD3  ARG 194           HD3      ARG 194  22.378   3.488  -0.857
 1384    HE   ARG 194           HE       ARG 194  23.947   2.501   1.193
 1385   HH11  ARG 194          HH11      ARG 194  24.060   2.718  -2.288
 1386   HH12  ARG 194          HH12      ARG 194  25.789   2.596  -2.377
 1387   HH21  ARG 194          HH21      ARG 194  26.220   2.337   1.110
 1388   HH22  ARG 194          HH22      ARG 194  27.026   2.377  -0.438
 1389    H    ARG 195           H        ARG 195  24.093  -1.146   1.085
 1390    HA   ARG 195           HA       ARG 195  23.367  -3.320   2.847
 1391    HB2  ARG 195           HB2      ARG 195  25.169  -3.335   0.981
 1392    HB3  ARG 195           HB3      ARG 195  26.183  -2.520   2.166
 1393    HG2  ARG 195           HG2      ARG 195  25.908  -4.393   3.699
 1394    HG3  ARG 195           HG3      ARG 195  24.876  -5.208   2.523
 1395    HD2  ARG 195           HD2      ARG 195  26.926  -4.870   0.937
 1396    HD3  ARG 195           HD3      ARG 195  27.818  -4.713   2.450
 1397    HE   ARG 195           HE       ARG 195  26.272  -6.994   2.680
 1398   HH11  ARG 195          HH11      ARG 195  28.965  -5.841   0.766
 1399   HH12  ARG 195          HH12      ARG 195  29.491  -7.434   0.303
 1400   HH21  ARG 195          HH21      ARG 195  26.940  -9.100   2.044
 1401   HH22  ARG 195          HH22      ARG 195  28.339  -9.283   1.023
 1402    H    LYS 196           H        LYS 196  23.109  -2.987   4.946
 1403    HA   LYS 196           HA       LYS 196  24.358  -0.701   6.238
 1404    HB2  LYS 196           HB2      LYS 196  22.019  -1.120   6.756
 1405    HB3  LYS 196           HB3      LYS 196  22.394  -2.762   7.268
 1406    HG2  LYS 196           HG2      LYS 196  23.711  -1.893   9.126
 1407    HG3  LYS 196           HG3      LYS 196  23.368  -0.243   8.605
 1408    HD2  LYS 196           HD2      LYS 196  20.999  -0.578   9.019
 1409    HD3  LYS 196           HD3      LYS 196  21.293  -2.262   9.460
 1410    HE2  LYS 196           HE2      LYS 196  22.651  -1.554  11.347
 1411    HE3  LYS 196           HE3      LYS 196  22.440   0.133  10.890
 1412    HZ1  LYS 196           HZ1      LYS 196  20.262  -1.708  11.731
 1413    HZ2  LYS 196           HZ2      LYS 196  20.075  -0.074  11.317
 1414    HZ3  LYS 196           HZ3      LYS 196  20.968  -0.500  12.691
 1415    H    PHE 197           H        PHE 197  24.285  -4.226   6.551
 1416    HA   PHE 197           HA       PHE 197  26.515  -4.114   8.440
 1417    HB2  PHE 197           HB2      PHE 197  24.875  -6.469   7.488
 1418    HB3  PHE 197           HB3      PHE 197  26.129  -6.522   8.722
 1419    HD1  PHE 197           HD1      PHE 197  22.725  -5.389   7.939
 1420    HD2  PHE 197           HD2      PHE 197  25.707  -5.766  10.944
 1421    HE1  PHE 197           HE1      PHE 197  21.052  -4.854   9.666
 1422    HE2  PHE 197           HE2      PHE 197  24.057  -5.221  12.672
 1423    HZ   PHE 197           HZ       PHE 197  21.661  -4.897  12.020
 1424    H    PHE 198           H        PHE 198  28.499  -5.073   8.021
 1425    HA   PHE 198           HA       PHE 198  28.931  -5.822   5.210
 1426    HB2  PHE 198           HB2      PHE 198  30.753  -4.185   6.979
 1427    HB3  PHE 198           HB3      PHE 198  31.212  -4.831   5.406
 1428    HD1  PHE 198           HD1      PHE 198  30.191  -3.972   3.361
 1429    HD2  PHE 198           HD2      PHE 198  29.321  -2.278   7.166
 1430    HE1  PHE 198           HE1      PHE 198  29.262  -1.980   2.257
 1431    HE2  PHE 198           HE2      PHE 198  28.391  -0.284   6.069
 1432    HZ   PHE 198           HZ       PHE 198  28.361  -0.133   3.612
 1433    H    TYR 199           H        TYR 199  28.417  -7.936   6.313
 1434    HA   TYR 199           HA       TYR 199  30.433  -9.218   7.843
 1435    HB2  TYR 199           HB2      TYR 199  29.285 -11.326   7.131
 1436    HB3  TYR 199           HB3      TYR 199  28.200 -10.132   7.834
 1437    HD1  TYR 199           HD1      TYR 199  26.622  -8.870   6.364
 1438    HD2  TYR 199           HD2      TYR 199  29.051 -12.031   4.863
 1439    HE1  TYR 199           HE1      TYR 199  25.191  -9.026   4.377
 1440    HE2  TYR 199           HE2      TYR 199  27.618 -12.192   2.876
 1441    HH   TYR 199           HH       TYR 199  25.316  -9.820   2.069
 1442    H    SER 200           H        SER 200  30.058  -8.482   4.522
 1443    HA   SER 200           HA       SER 200  31.197  -8.946   2.631
 1444    HB2  SER 200           HB2      SER 200  33.499  -9.167   4.577
 1445    HB3  SER 200           HB3      SER 200  33.638  -8.891   2.838
 1446    HG   SER 200           HG       SER 200  33.398  -7.066   4.684
 1447    H    ASP 201           H        ASP 201  29.902 -10.953   2.651
 1448    HA   ASP 201           HA       ASP 201  29.720 -13.056   1.882
 1449    HB2  ASP 201           HB2      ASP 201  31.675 -12.659   0.530
 1450    HB3  ASP 201           HB3      ASP 201  32.732 -12.977   1.898
 1451    H    GLN 202           H        GLN 202  31.678 -12.504   4.699
 1452    HA   GLN 202           HA       GLN 202  31.272 -15.222   5.650
 1453    HB2  GLN 202           HB2      GLN 202  33.421 -14.092   6.074
 1454    HB3  GLN 202           HB3      GLN 202  32.584 -12.849   6.991
 1455    HG2  GLN 202           HG2      GLN 202  31.848 -14.595   8.590
 1456    HG3  GLN 202           HG3      GLN 202  32.825 -15.764   7.701
 1457   HE21  GLN 202          HE21      GLN 202  32.871 -12.977   9.783
 1458   HE22  GLN 202          HE22      GLN 202  34.540 -13.089  10.223
  Start of MODEL   18
    1    H1   GLY  -5           H1       GLY  -5 -28.167 -14.365  -2.406
    2    H2   GLY  -5           H2       GLY  -5 -29.096 -15.437  -1.474
    3    H3   GLY  -5           H3       GLY  -5 -28.791 -13.871  -0.909
    4    HA2  GLY  -5           HA2      GLY  -5 -30.334 -14.486  -3.362
    5    HA3  GLY  -5           HA3      GLY  -5 -31.061 -14.158  -1.796
    6    H    ILE  -4           H        ILE  -4 -31.049 -12.081  -0.972
    7    HA   ILE  -4           HA       ILE  -4 -30.301  -9.987  -2.908
    8    HB   ILE  -4           HB       ILE  -4 -31.962  -8.548  -1.751
    9   HG12  ILE  -4          HG12      ILE  -4 -32.748 -11.114  -0.346
   10   HG13  ILE  -4          HG13      ILE  -4 -31.965  -9.733   0.416
   11   HG21  ILE  -4          HG21      ILE  -4 -33.055 -11.120  -2.880
   12   HG22  ILE  -4          HG22      ILE  -4 -33.949  -9.609  -2.717
   13   HG23  ILE  -4          HG23      ILE  -4 -32.561  -9.700  -3.802
   14   HD11  ILE  -4          HD11      ILE  -4 -34.703  -9.745  -0.834
   15   HD12  ILE  -4          HD12      ILE  -4 -34.342  -9.771   0.892
   16   HD13  ILE  -4          HD13      ILE  -4 -33.920  -8.358  -0.076
   17    H    ASP  -3           H        ASP  -3 -29.799  -7.846  -1.833
   18    HA   ASP  -3           HA       ASP  -3 -28.307  -8.285   0.672
   19    HB2  ASP  -3           HB2      ASP  -3 -27.623  -6.537  -1.695
   20    HB3  ASP  -3           HB3      ASP  -3 -26.880  -6.315  -0.116
   21    HA   PRO  -2           HA       PRO  -2 -31.499  -5.504   2.073
   22    HB2  PRO  -2           HB2      PRO  -2 -30.144  -5.761   4.668
   23    HB3  PRO  -2           HB3      PRO  -2 -31.784  -6.229   4.209
   24    HG2  PRO  -2           HG2      PRO  -2 -29.871  -8.055   4.702
   25    HG3  PRO  -2           HG3      PRO  -2 -31.124  -8.316   3.474
   26    HD2  PRO  -2           HD2      PRO  -2 -28.275  -7.455   3.122
   27    HD3  PRO  -2           HD3      PRO  -2 -29.225  -8.617   2.172
   28    H    PHE  -1           H        PHE  -1 -31.157  -3.457   1.399
   29    HA   PHE  -1           HA       PHE  -1 -29.153  -1.886   2.850
   30    HB2  PHE  -1           HB2      PHE  -1 -29.897  -1.699  -0.070
   31    HB3  PHE  -1           HB3      PHE  -1 -28.938  -0.504   0.779
   32    HD1  PHE  -1           HD1      PHE  -1 -27.039  -1.940   2.321
   33    HD2  PHE  -1           HD2      PHE  -1 -28.603  -2.892  -1.520
   34    HE1  PHE  -1           HE1      PHE  -1 -24.998  -3.214   1.810
   35    HE2  PHE  -1           HE2      PHE  -1 -26.567  -4.172  -2.036
   36    HZ   PHE  -1           HZ       PHE  -1 -24.761  -4.334  -0.370
   37    H    THR   0           H        THR   0 -30.971  -1.429   4.287
   38    HA   THR   0           HA       THR   0 -32.831   0.577   3.245
   39    HB   THR   0           HB       THR   0 -33.589   0.612   5.709
   40    HG1  THR   0           HG1      THR   0 -32.400  -1.950   5.854
   41   HG21  THR   0          HG21      THR   0 -34.886  -0.467   3.944
   42   HG22  THR   0          HG22      THR   0 -34.950  -1.413   5.433
   43   HG23  THR   0          HG23      THR   0 -33.910  -1.927   4.104
   44    H    MET   1           H        MET   1 -32.909   2.119   5.735
   45    HA   MET   1           HA       MET   1 -30.613   3.790   5.291
   46    HB2  MET   1           HB2      MET   1 -32.747   4.823   5.863
   47    HB3  MET   1           HB3      MET   1 -32.781   3.959   7.392
   48    HG2  MET   1           HG2      MET   1 -32.108   6.121   7.945
   49    HG3  MET   1           HG3      MET   1 -30.622   5.163   7.963
   50    HE1  MET   1           HE1      MET   1 -28.560   5.659   6.535
   51    HE2  MET   1           HE2      MET   1 -29.426   4.952   5.172
   52    HE3  MET   1           HE3      MET   1 -28.594   6.494   4.982
   53    H    VAL   2           H        VAL   2 -29.441   1.607   5.803
   54    HA   VAL   2           HA       VAL   2 -27.973   2.111   8.157
   55    HB   VAL   2           HB       VAL   2 -30.063   0.792   8.897
   56   HG11  VAL   2          HG11      VAL   2 -29.909  -1.639   8.743
   57   HG12  VAL   2          HG12      VAL   2 -30.104  -0.883   7.160
   58   HG13  VAL   2          HG13      VAL   2 -28.521  -1.477   7.665
   59   HG21  VAL   2          HG21      VAL   2 -28.756  -0.429  10.561
   60   HG22  VAL   2          HG22      VAL   2 -27.301  -0.140   9.603
   61   HG23  VAL   2          HG23      VAL   2 -28.182   1.221  10.300
   62    H    ALA   3           H        ALA   3 -27.479   2.236   5.578
   63    HA   ALA   3           HA       ALA   3 -25.534   0.131   5.084
   64    HB1  ALA   3           HB1      ALA   3 -27.372  -0.491   3.646
   65    HB2  ALA   3           HB2      ALA   3 -27.558   1.174   3.092
   66    HB3  ALA   3           HB3      ALA   3 -26.122   0.254   2.645
   67    H    LEU   4           H        LEU   4 -23.836   0.942   3.672
   68    HA   LEU   4           HA       LEU   4 -23.556   3.845   4.061
   69    HB2  LEU   4           HB2      LEU   4 -21.467   1.690   4.027
   70    HB3  LEU   4           HB3      LEU   4 -21.135   3.399   4.231
   71    HG   LEU   4           HG       LEU   4 -22.551   1.542   6.137
   72   HD11  LEU   4          HD11      LEU   4 -20.752   2.225   7.656
   73   HD12  LEU   4          HD12      LEU   4 -20.139   1.428   6.206
   74   HD13  LEU   4          HD13      LEU   4 -20.039   3.184   6.357
   75   HD21  LEU   4          HD21      LEU   4 -22.251   4.535   6.314
   76   HD22  LEU   4          HD22      LEU   4 -23.758   3.644   6.118
   77   HD23  LEU   4          HD23      LEU   4 -22.830   3.488   7.609
   78    H    SER   5           H        SER   5 -23.108   5.055   2.335
   79    HA   SER   5           HA       SER   5 -22.996   3.687  -0.252
   80    HB2  SER   5           HB2      SER   5 -23.714   5.788  -1.220
   81    HB3  SER   5           HB3      SER   5 -24.749   5.432   0.156
   82    HG   SER   5           HG       SER   5 -22.463   7.091   0.336
   83    H    LEU   6           H        LEU   6 -20.922   3.211  -0.726
   84    HA   LEU   6           HA       LEU   6 -18.889   5.247  -0.102
   85    HB2  LEU   6           HB2      LEU   6 -18.436   2.291  -0.519
   86    HB3  LEU   6           HB3      LEU   6 -17.279   3.470   0.080
   87    HG   LEU   6           HG       LEU   6 -19.736   2.460   1.516
   88   HD11  LEU   6          HD11      LEU   6 -16.799   2.158   2.118
   89   HD12  LEU   6          HD12      LEU   6 -18.129   1.560   3.111
   90   HD13  LEU   6          HD13      LEU   6 -17.867   0.899   1.498
   91   HD21  LEU   6          HD21      LEU   6 -17.735   4.548   2.366
   92   HD22  LEU   6          HD22      LEU   6 -19.441   4.812   1.999
   93   HD23  LEU   6          HD23      LEU   6 -18.980   3.843   3.399
   94    H    LYS   7           H        LYS   7 -17.619   6.021  -1.703
   95    HA   LYS   7           HA       LYS   7 -18.162   5.147  -4.422
   96    HB2  LYS   7           HB2      LYS   7 -16.205   7.224  -3.437
   97    HB3  LYS   7           HB3      LYS   7 -16.632   6.926  -5.111
   98    HG2  LYS   7           HG2      LYS   7 -18.983   7.571  -4.513
   99    HG3  LYS   7           HG3      LYS   7 -18.345   8.103  -2.951
  100    HD2  LYS   7           HD2      LYS   7 -18.168  10.062  -4.132
  101    HD3  LYS   7           HD3      LYS   7 -16.598   9.338  -4.478
  102    HE2  LYS   7           HE2      LYS   7 -17.494   8.431  -6.575
  103    HE3  LYS   7           HE3      LYS   7 -19.032   9.227  -6.248
  104    HZ1  LYS   7           HZ1      LYS   7 -17.841  11.364  -6.259
  105    HZ2  LYS   7           HZ2      LYS   7 -17.733  10.554  -7.744
  106    HZ3  LYS   7           HZ3      LYS   7 -16.410  10.557  -6.685
  107    H    ILE   8           H        ILE   8 -17.178   3.320  -5.019
  108    HA   ILE   8           HA       ILE   8 -14.534   2.732  -3.954
  109    HB   ILE   8           HB       ILE   8 -16.592   1.093  -5.391
  110   HG12  ILE   8          HG12      ILE   8 -16.028  -0.515  -3.564
  111   HG13  ILE   8          HG13      ILE   8 -14.877   0.655  -2.935
  112   HG21  ILE   8          HG21      ILE   8 -14.990  -0.711  -5.745
  113   HG22  ILE   8          HG22      ILE   8 -14.542   0.723  -6.668
  114   HG23  ILE   8          HG23      ILE   8 -13.682   0.329  -5.180
  115   HD11  ILE   8          HD11      ILE   8 -17.862   0.955  -3.092
  116   HD12  ILE   8          HD12      ILE   8 -16.877   0.743  -1.642
  117   HD13  ILE   8          HD13      ILE   8 -16.752   2.229  -2.586
  118    H    SER   9           H        SER   9 -13.020   3.858  -4.946
  119    HA   SER   9           HA       SER   9 -13.137   4.153  -7.857
  120    HB2  SER   9           HB2      SER   9 -11.231   5.438  -5.887
  121    HB3  SER   9           HB3      SER   9 -11.381   5.829  -7.596
  122    HG   SER   9           HG       SER   9 -13.645   5.980  -5.954
  123    H    ILE  10           H        ILE  10 -11.788   3.071  -9.171
  124    HA   ILE  10           HA       ILE  10  -9.645   1.481  -7.928
  125    HB   ILE  10           HB       ILE  10 -11.482   0.524 -10.135
  126   HG12  ILE  10          HG12      ILE  10 -11.387  -0.480  -7.291
  127   HG13  ILE  10          HG13      ILE  10 -12.497   0.786  -7.800
  128   HG21  ILE  10          HG21      ILE  10  -9.344  -0.907  -8.556
  129   HG22  ILE  10          HG22      ILE  10 -10.416  -1.653  -9.742
  130   HG23  ILE  10          HG23      ILE  10  -9.247  -0.434 -10.253
  131   HD11  ILE  10          HD11      ILE  10 -13.568  -1.397  -7.754
  132   HD12  ILE  10          HD12      ILE  10 -13.519  -0.740  -9.390
  133   HD13  ILE  10          HD13      ILE  10 -12.387  -2.005  -8.915
  134    H    GLY  11           H        GLY  11  -8.022   2.828  -8.609
  135    HA2  GLY  11           HA2      GLY  11  -6.368   3.477 -10.076
  136    HA3  GLY  11           HA3      GLY  11  -7.194   2.576 -11.339
  137    H    ASN  12           H        ASN  12  -8.873   3.591 -12.512
  138    HA   ASN  12           HA       ASN  12  -8.780   6.535 -12.383
  139    HB2  ASN  12           HB2      ASN  12  -8.971   6.602 -14.789
  140    HB3  ASN  12           HB3      ASN  12  -7.643   5.543 -14.379
  141   HD21  ASN  12          HD21      ASN  12  -7.769   3.444 -14.806
  142   HD22  ASN  12          HD22      ASN  12  -9.014   2.707 -15.770
  143    H    VAL  13           H        VAL  13 -10.737   3.745 -12.333
  144    HA   VAL  13           HA       VAL  13 -13.152   5.215 -13.099
  145    HB   VAL  13           HB       VAL  13 -12.660   2.959 -14.100
  146   HG11  VAL  13          HG11      VAL  13 -13.264   1.969 -11.319
  147   HG12  VAL  13          HG12      VAL  13 -13.110   0.961 -12.757
  148   HG13  VAL  13          HG13      VAL  13 -11.717   1.862 -12.159
  149   HG21  VAL  13          HG21      VAL  13 -15.223   3.181 -12.529
  150   HG22  VAL  13          HG22      VAL  13 -14.917   3.850 -14.131
  151   HG23  VAL  13          HG23      VAL  13 -14.946   2.102 -13.896
  152    H    VAL  14           H        VAL  14 -15.106   4.903 -11.725
  153    HA   VAL  14           HA       VAL  14 -14.623   4.153  -8.975
  154    HB   VAL  14           HB       VAL  14 -13.989   6.403  -8.687
  155   HG11  VAL  14          HG11      VAL  14 -16.413   7.224 -10.267
  156   HG12  VAL  14          HG12      VAL  14 -15.284   8.316  -9.463
  157   HG13  VAL  14          HG13      VAL  14 -14.733   7.307 -10.799
  158   HG21  VAL  14          HG21      VAL  14 -15.758   7.364  -7.271
  159   HG22  VAL  14          HG22      VAL  14 -16.905   6.197  -7.936
  160   HG23  VAL  14          HG23      VAL  14 -15.534   5.638  -6.978
  161    H    LYS  15           H        LYS  15 -16.289   3.196  -8.126
  162    HA   LYS  15           HA       LYS  15 -18.872   3.339  -9.536
  163    HB2  LYS  15           HB2      LYS  15 -17.492   0.926  -8.336
  164    HB3  LYS  15           HB3      LYS  15 -19.177   0.932  -8.836
  165    HG2  LYS  15           HG2      LYS  15 -16.785   1.355 -10.622
  166    HG3  LYS  15           HG3      LYS  15 -17.792  -0.092 -10.535
  167    HD2  LYS  15           HD2      LYS  15 -19.736   1.284 -11.235
  168    HD3  LYS  15           HD3      LYS  15 -18.649   2.657 -11.436
  169    HE2  LYS  15           HE2      LYS  15 -18.961   1.719 -13.586
  170    HE3  LYS  15           HE3      LYS  15 -17.346   1.249 -13.063
  171    HZ1  LYS  15           HZ1      LYS  15 -18.729  -0.538 -14.126
  172    HZ2  LYS  15           HZ2      LYS  15 -19.711  -0.516 -12.745
  173    HZ3  LYS  15           HZ3      LYS  15 -18.070  -0.939 -12.616
  174    H    THR  16           H        THR  16 -20.735   3.153  -8.209
  175    HA   THR  16           HA       THR  16 -20.177   3.975  -5.437
  176    HB   THR  16           HB       THR  16 -22.785   4.326  -6.929
  177    HG1  THR  16           HG1      THR  16 -20.520   5.509  -7.475
  178   HG21  THR  16          HG21      THR  16 -21.645   5.661  -4.466
  179   HG22  THR  16          HG22      THR  16 -22.934   4.458  -4.486
  180   HG23  THR  16          HG23      THR  16 -23.194   6.042  -5.217
  181    H    MET  17           H        MET  17 -20.434   2.426  -3.967
  182    HA   MET  17           HA       MET  17 -22.443   0.356  -4.448
  183    HB2  MET  17           HB2      MET  17 -19.684  -0.059  -4.781
  184    HB3  MET  17           HB3      MET  17 -20.073  -0.767  -3.218
  185    HG2  MET  17           HG2      MET  17 -21.762  -1.375  -5.599
  186    HG3  MET  17           HG3      MET  17 -20.225  -2.199  -5.372
  187    HE1  MET  17           HE1      MET  17 -19.929  -2.777  -2.311
  188    HE2  MET  17           HE2      MET  17 -20.744  -4.340  -2.218
  189    HE3  MET  17           HE3      MET  17 -19.725  -3.954  -3.607
  190    H    GLN  18           H        GLN  18 -23.210  -0.642  -2.541
  191    HA   GLN  18           HA       GLN  18 -22.635   0.977  -0.167
  192    HB2  GLN  18           HB2      GLN  18 -25.164  -0.343  -1.099
  193    HB3  GLN  18           HB3      GLN  18 -24.946   0.177   0.569
  194    HG2  GLN  18           HG2      GLN  18 -24.885   2.400   0.022
  195    HG3  GLN  18           HG3      GLN  18 -24.410   2.090  -1.648
  196   HE21  GLN  18          HE21      GLN  18 -26.002   3.214  -2.633
  197   HE22  GLN  18          HE22      GLN  18 -27.676   2.802  -2.538
  198    H    PHE  19           H        PHE  19 -22.352   0.040   1.790
  199    HA   PHE  19           HA       PHE  19 -22.218  -2.887   1.926
  200    HB2  PHE  19           HB2      PHE  19 -20.206  -0.886   3.000
  201    HB3  PHE  19           HB3      PHE  19 -20.225  -2.593   3.418
  202    HD1  PHE  19           HD1      PHE  19 -19.539  -4.275   1.807
  203    HD2  PHE  19           HD2      PHE  19 -19.445  -0.128   0.864
  204    HE1  PHE  19           HE1      PHE  19 -18.122  -4.759  -0.145
  205    HE2  PHE  19           HE2      PHE  19 -18.023  -0.604  -1.091
  206    HZ   PHE  19           HZ       PHE  19 -17.315  -2.939  -1.561
  207    H    GLU  20           H        GLU  20 -22.496  -3.616   4.169
  208    HA   GLU  20           HA       GLU  20 -24.331  -1.963   5.641
  209    HB2  GLU  20           HB2      GLU  20 -23.038  -4.616   6.300
  210    HB3  GLU  20           HB3      GLU  20 -24.269  -3.837   7.287
  211    HG2  GLU  20           HG2      GLU  20 -25.833  -3.938   5.403
  212    HG3  GLU  20           HG3      GLU  20 -24.600  -4.753   4.440
  213    HA   PRO  21           HA       PRO  21 -21.734   0.362   8.241
  214    HB2  PRO  21           HB2      PRO  21 -22.906  -0.846  10.671
  215    HB3  PRO  21           HB3      PRO  21 -22.858   0.844  10.170
  216    HG2  PRO  21           HG2      PRO  21 -25.099  -0.663  10.067
  217    HG3  PRO  21           HG3      PRO  21 -24.789   0.678   8.950
  218    HD2  PRO  21           HD2      PRO  21 -24.702  -2.239   8.475
  219    HD3  PRO  21           HD3      PRO  21 -24.996  -0.913   7.340
  220    H    SER  22           H        SER  22 -22.190  -2.925   9.513
  221    HA   SER  22           HA       SER  22 -19.546  -3.040  10.568
  222    HB2  SER  22           HB2      SER  22 -21.480  -5.289   9.946
  223    HB3  SER  22           HB3      SER  22 -20.018  -5.429  10.925
  224    HG   SER  22           HG       SER  22 -20.973  -3.820  12.334
  225    H    THR  23           H        THR  23 -20.997  -5.048   8.013
  226    HA   THR  23           HA       THR  23 -20.058  -6.400   6.486
  227    HB   THR  23           HB       THR  23 -18.780  -3.771   5.767
  228    HG1  THR  23           HG1      THR  23 -21.187  -5.137   5.115
  229   HG21  THR  23          HG21      THR  23 -19.078  -6.289   4.140
  230   HG22  THR  23          HG22      THR  23 -17.561  -5.602   4.722
  231   HG23  THR  23          HG23      THR  23 -18.524  -4.733   3.525
  232    H    MET  24           H        MET  24 -17.282  -4.329   7.271
  233    HA   MET  24           HA       MET  24 -15.227  -4.805   8.115
  234    HB2  MET  24           HB2      MET  24 -16.530  -6.973   9.048
  235    HB3  MET  24           HB3      MET  24 -15.430  -7.752   7.919
  236    HG2  MET  24           HG2      MET  24 -13.544  -7.026   9.065
  237    HG3  MET  24           HG3      MET  24 -14.443  -5.783   9.940
  238    HE1  MET  24           HE1      MET  24 -14.006  -6.215  12.383
  239    HE2  MET  24           HE2      MET  24 -13.619  -7.820  13.014
  240    HE3  MET  24           HE3      MET  24 -12.646  -7.124  11.713
  241    H    VAL  25           H        VAL  25 -13.350  -4.908   7.097
  242    HA   VAL  25           HA       VAL  25 -13.167  -4.593   4.441
  243    HB   VAL  25           HB       VAL  25 -11.077  -5.635   6.322
  244   HG11  VAL  25          HG11      VAL  25 -10.465  -6.410   4.082
  245   HG12  VAL  25          HG12      VAL  25 -10.680  -4.776   3.453
  246   HG13  VAL  25          HG13      VAL  25  -9.395  -5.113   4.615
  247   HG21  VAL  25          HG21      VAL  25 -10.236  -3.345   6.109
  248   HG22  VAL  25          HG22      VAL  25 -11.563  -2.968   5.010
  249   HG23  VAL  25          HG23      VAL  25 -11.902  -3.381   6.691
  250    H    TYR  26           H        TYR  26 -12.460  -7.740   5.984
  251    HA   TYR  26           HA       TYR  26 -11.864  -9.061   3.592
  252    HB2  TYR  26           HB2      TYR  26 -12.036 -11.140   4.774
  253    HB3  TYR  26           HB3      TYR  26 -11.312  -9.951   5.846
  254    HD1  TYR  26           HD1      TYR  26 -14.248 -12.038   5.206
  255    HD2  TYR  26           HD2      TYR  26 -12.499  -9.174   7.820
  256    HE1  TYR  26           HE1      TYR  26 -15.913 -12.600   6.924
  257    HE2  TYR  26           HE2      TYR  26 -14.164  -9.724   9.541
  258    HH   TYR  26           HH       TYR  26 -16.134 -12.471   9.377
  259    H    ASP  27           H        ASP  27 -14.946  -8.410   5.090
  260    HA   ASP  27           HA       ASP  27 -16.425 -10.199   3.373
  261    HB2  ASP  27           HB2      ASP  27 -17.091  -9.423   5.736
  262    HB3  ASP  27           HB3      ASP  27 -17.587  -7.921   4.970
  263    H    ALA  28           H        ALA  28 -15.738  -6.734   3.544
  264    HA   ALA  28           HA       ALA  28 -17.339  -5.896   1.416
  265    HB1  ALA  28           HB1      ALA  28 -14.676  -4.773   2.291
  266    HB2  ALA  28           HB2      ALA  28 -15.883  -3.943   1.310
  267    HB3  ALA  28           HB3      ALA  28 -16.243  -4.359   2.986
  268    H    CYS  29           H        CYS  29 -13.982  -6.926   1.505
  269    HA   CYS  29           HA       CYS  29 -13.277  -6.615  -1.138
  270    HB2  CYS  29           HB2      CYS  29 -12.383  -8.620   0.918
  271    HB3  CYS  29           HB3      CYS  29 -11.597  -8.434  -0.640
  272    HG   CYS  29           HG       CYS  29 -11.744  -6.169   1.905
  273    H    ARG  30           H        ARG  30 -15.173  -9.211   0.281
  274    HA   ARG  30           HA       ARG  30 -14.856 -10.861  -2.068
  275    HB2  ARG  30           HB2      ARG  30 -16.529 -12.381  -1.033
  276    HB3  ARG  30           HB3      ARG  30 -15.101 -12.095  -0.056
  277    HG2  ARG  30           HG2      ARG  30 -16.291 -10.714   1.444
  278    HG3  ARG  30           HG3      ARG  30 -17.702 -10.632   0.382
  279    HD2  ARG  30           HD2      ARG  30 -18.096 -13.010   0.707
  280    HD3  ARG  30           HD3      ARG  30 -16.638 -13.142   1.690
  281    HE   ARG  30           HE       ARG  30 -18.489 -11.207   2.718
  282   HH11  ARG  30          HH11      ARG  30 -17.763 -14.640   2.583
  283   HH12  ARG  30          HH12      ARG  30 -18.572 -15.000   4.079
  284   HH21  ARG  30          HH21      ARG  30 -19.543 -11.679   4.693
  285   HH22  ARG  30          HH22      ARG  30 -19.595 -13.323   5.271
  286    H    MET  31           H        MET  31 -17.418  -8.811  -0.736
  287    HA   MET  31           HA       MET  31 -19.270  -9.476  -2.801
  288    HB2  MET  31           HB2      MET  31 -19.269  -7.075  -0.968
  289    HB3  MET  31           HB3      MET  31 -20.617  -7.655  -1.932
  290    HG2  MET  31           HG2      MET  31 -20.709  -9.700  -0.667
  291    HG3  MET  31           HG3      MET  31 -19.294  -9.221   0.261
  292    HE1  MET  31           HE1      MET  31 -20.504  -6.236   2.335
  293    HE2  MET  31           HE2      MET  31 -19.181  -7.343   1.925
  294    HE3  MET  31           HE3      MET  31 -19.751  -6.165   0.739
  295    H    ILE  32           H        ILE  32 -16.946  -6.851  -2.321
  296    HA   ILE  32           HA       ILE  32 -17.843  -5.266  -4.481
  297    HB   ILE  32           HB       ILE  32 -16.358  -4.409  -2.698
  298   HG12  ILE  32          HG12      ILE  32 -15.239  -4.149  -5.494
  299   HG13  ILE  32          HG13      ILE  32 -16.574  -3.212  -4.827
  300   HG21  ILE  32          HG21      ILE  32 -13.954  -4.820  -2.790
  301   HG22  ILE  32          HG22      ILE  32 -14.854  -6.301  -2.467
  302   HG23  ILE  32          HG23      ILE  32 -14.202  -5.998  -4.079
  303   HD11  ILE  32          HD11      ILE  32 -14.494  -1.955  -4.829
  304   HD12  ILE  32          HD12      ILE  32 -15.083  -2.230  -3.189
  305   HD13  ILE  32          HD13      ILE  32 -13.745  -3.190  -3.818
  306    H    ARG  33           H        ARG  33 -15.260  -7.676  -4.263
  307    HA   ARG  33           HA       ARG  33 -14.475  -7.763  -6.933
  308    HB2  ARG  33           HB2      ARG  33 -13.402  -8.918  -4.966
  309    HB3  ARG  33           HB3      ARG  33 -14.678 -10.121  -5.052
  310    HG2  ARG  33           HG2      ARG  33 -13.933 -10.564  -7.420
  311    HG3  ARG  33           HG3      ARG  33 -12.521  -9.566  -7.064
  312    HD2  ARG  33           HD2      ARG  33 -13.351 -12.133  -5.727
  313    HD3  ARG  33           HD3      ARG  33 -11.910 -11.844  -6.700
  314    HE   ARG  33           HE       ARG  33 -12.031 -10.151  -4.393
  315   HH11  ARG  33          HH11      ARG  33 -11.148 -13.343  -5.534
  316   HH12  ARG  33          HH12      ARG  33 -10.067 -13.652  -4.207
  317   HH21  ARG  33          HH21      ARG  33 -10.559 -10.545  -2.667
  318   HH22  ARG  33          HH22      ARG  33  -9.734 -12.073  -2.589
  319    H    GLU  34           H        GLU  34 -17.291  -8.940  -5.379
  320    HA   GLU  34           HA       GLU  34 -17.975 -10.951  -7.314
  321    HB2  GLU  34           HB2      GLU  34 -18.676 -11.183  -5.002
  322    HB3  GLU  34           HB3      GLU  34 -19.573  -9.675  -5.093
  323    HG2  GLU  34           HG2      GLU  34 -21.089 -10.671  -6.723
  324    HG3  GLU  34           HG3      GLU  34 -20.188 -12.184  -6.630
  325    H    ARG  35           H        ARG  35 -19.540  -7.874  -6.402
  326    HA   ARG  35           HA       ARG  35 -21.141  -7.986  -8.801
  327    HB2  ARG  35           HB2      ARG  35 -22.082  -5.795  -7.886
  328    HB3  ARG  35           HB3      ARG  35 -22.381  -7.266  -6.974
  329    HG2  ARG  35           HG2      ARG  35 -20.010  -6.231  -5.932
  330    HG3  ARG  35           HG3      ARG  35 -21.075  -4.841  -6.164
  331    HD2  ARG  35           HD2      ARG  35 -21.827  -7.385  -4.723
  332    HD3  ARG  35           HD3      ARG  35 -21.331  -5.887  -3.937
  333    HE   ARG  35           HE       ARG  35 -23.379  -5.000  -5.355
  334   HH11  ARG  35          HH11      ARG  35 -23.113  -7.960  -3.489
  335   HH12  ARG  35          HH12      ARG  35 -24.801  -8.006  -3.070
  336   HH21  ARG  35          HH21      ARG  35 -25.600  -5.059  -4.809
  337   HH22  ARG  35          HH22      ARG  35 -26.214  -6.369  -3.845
  338    H    ILE  36           H        ILE  36 -18.342  -6.177  -7.707
  339    HA   ILE  36           HA       ILE  36 -18.488  -4.542 -10.144
  340    HB   ILE  36           HB       ILE  36 -16.670  -4.183  -7.753
  341   HG12  ILE  36          HG12      ILE  36 -19.150  -2.651  -8.571
  342   HG13  ILE  36          HG13      ILE  36 -19.040  -3.768  -7.215
  343   HG21  ILE  36          HG21      ILE  36 -15.695  -3.319  -9.808
  344   HG22  ILE  36          HG22      ILE  36 -17.170  -2.412 -10.145
  345   HG23  ILE  36          HG23      ILE  36 -16.177  -1.992  -8.749
  346   HD11  ILE  36          HD11      ILE  36 -18.926  -1.467  -6.465
  347   HD12  ILE  36          HD12      ILE  36 -17.403  -2.301  -6.146
  348   HD13  ILE  36          HD13      ILE  36 -17.529  -1.182  -7.504
  349    HA   PRO  37           HA       PRO  37 -15.415  -7.534 -11.563
  350    HB2  PRO  37           HB2      PRO  37 -15.569  -6.851 -14.187
  351    HB3  PRO  37           HB3      PRO  37 -16.722  -7.932 -13.397
  352    HG2  PRO  37           HG2      PRO  37 -16.995  -5.047 -14.090
  353    HG3  PRO  37           HG3      PRO  37 -18.199  -6.343 -14.168
  354    HD2  PRO  37           HD2      PRO  37 -18.076  -4.491 -12.156
  355    HD3  PRO  37           HD3      PRO  37 -18.763  -6.115 -11.963
  356    H    GLU  38           H        GLU  38 -15.505  -4.084 -11.926
  357    HA   GLU  38           HA       GLU  38 -12.939  -3.732 -13.087
  358    HB2  GLU  38           HB2      GLU  38 -14.585  -1.881 -11.352
  359    HB3  GLU  38           HB3      GLU  38 -13.084  -1.411 -12.131
  360    HG2  GLU  38           HG2      GLU  38 -14.871  -0.591 -13.449
  361    HG3  GLU  38           HG3      GLU  38 -14.142  -1.937 -14.323
  362    H    ALA  39           H        ALA  39 -14.042  -4.483  -9.930
  363    HA   ALA  39           HA       ALA  39 -11.942  -3.454  -8.377
  364    HB1  ALA  39           HB1      ALA  39 -13.711  -5.837  -7.842
  365    HB2  ALA  39           HB2      ALA  39 -12.740  -4.980  -6.646
  366    HB3  ALA  39           HB3      ALA  39 -14.083  -4.160  -7.441
  367    H    LEU  40           H        LEU  40 -12.374  -6.521 -10.012
  368    HA   LEU  40           HA       LEU  40  -9.910  -7.597  -8.889
  369    HB2  LEU  40           HB2      LEU  40 -10.630  -9.661 -10.056
  370    HB3  LEU  40           HB3      LEU  40 -11.805  -9.047  -8.903
  371    HG   LEU  40           HG       LEU  40 -12.481  -7.860 -11.340
  372   HD11  LEU  40          HD11      LEU  40 -11.853 -10.773 -11.690
  373   HD12  LEU  40          HD12      LEU  40 -12.798  -9.787 -12.811
  374   HD13  LEU  40          HD13      LEU  40 -11.095  -9.413 -12.524
  375   HD21  LEU  40          HD21      LEU  40 -14.480  -9.253 -11.117
  376   HD22  LEU  40          HD22      LEU  40 -13.659 -10.200  -9.873
  377   HD23  LEU  40          HD23      LEU  40 -14.001  -8.492  -9.596
  378    H    ALA  41           H        ALA  41  -9.885  -5.400 -10.892
  379    HA   ALA  41           HA       ALA  41  -9.045  -6.493 -13.386
  380    HB1  ALA  41           HB1      ALA  41  -8.677  -3.706 -12.289
  381    HB2  ALA  41           HB2      ALA  41  -8.465  -4.193 -13.971
  382    HB3  ALA  41           HB3      ALA  41 -10.060  -4.276 -13.223
  383    H    GLY  42           H        GLY  42  -7.579  -7.731 -11.426
  384    HA2  GLY  42           HA2      GLY  42  -4.988  -7.657 -12.423
  385    HA3  GLY  42           HA3      GLY  42  -5.009  -6.679 -10.953
  386    HA   PRO  43           HA       PRO  43  -4.925 -10.820  -9.130
  387    HB2  PRO  43           HB2      PRO  43  -2.908 -10.141  -7.326
  388    HB3  PRO  43           HB3      PRO  43  -2.697 -11.010  -8.845
  389    HG2  PRO  43           HG2      PRO  43  -1.747  -8.412  -8.206
  390    HG3  PRO  43           HG3      PRO  43  -1.668  -9.226  -9.776
  391    HD2  PRO  43           HD2      PRO  43  -3.581  -7.181  -8.798
  392    HD3  PRO  43           HD3      PRO  43  -3.049  -7.536 -10.457
  393    HA   PRO  44           HA       PRO  44  -7.705  -8.662  -6.238
  394    HB2  PRO  44           HB2      PRO  44  -9.069 -10.942  -5.536
  395    HB3  PRO  44           HB3      PRO  44  -9.442  -9.953  -6.950
  396    HG2  PRO  44           HG2      PRO  44  -7.832 -12.471  -6.774
  397    HG3  PRO  44           HG3      PRO  44  -9.044 -12.000  -7.980
  398    HD2  PRO  44           HD2      PRO  44  -6.431 -11.810  -8.507
  399    HD3  PRO  44           HD3      PRO  44  -7.578 -10.580  -9.084
  400    H    ASN  45           H        ASN  45  -5.464 -11.190  -5.665
  401    HA   ASN  45           HA       ASN  45  -5.943 -11.469  -2.852
  402    HB2  ASN  45           HB2      ASN  45  -3.594 -12.316  -4.562
  403    HB3  ASN  45           HB3      ASN  45  -3.824 -12.771  -2.877
  404   HD21  ASN  45          HD21      ASN  45  -3.673 -14.363  -5.358
  405   HD22  ASN  45          HD22      ASN  45  -5.118 -15.321  -5.382
  406    H    ASP  46           H        ASP  46  -4.165  -9.292  -4.844
  407    HA   ASP  46           HA       ASP  46  -2.506  -8.375  -2.595
  408    HB2  ASP  46           HB2      ASP  46  -2.494  -7.541  -5.510
  409    HB3  ASP  46           HB3      ASP  46  -1.395  -6.944  -4.274
  410    H    PHE  47           H        PHE  47  -5.529  -7.957  -3.460
  411    HA   PHE  47           HA       PHE  47  -5.535  -5.046  -3.657
  412    HB2  PHE  47           HB2      PHE  47  -7.646  -7.121  -4.222
  413    HB3  PHE  47           HB3      PHE  47  -7.991  -5.396  -4.201
  414    HD1  PHE  47           HD1      PHE  47  -4.835  -5.345  -5.373
  415    HD2  PHE  47           HD2      PHE  47  -8.667  -6.718  -6.587
  416    HE1  PHE  47           HE1      PHE  47  -4.145  -5.161  -7.723
  417    HE2  PHE  47           HE2      PHE  47  -7.984  -6.542  -8.942
  418    HZ   PHE  47           HZ       PHE  47  -5.722  -5.761  -9.513
  419    H    GLY  48           H        GLY  48  -5.957  -3.832  -2.019
  420    HA2  GLY  48           HA2      GLY  48  -7.578  -4.914   0.197
  421    HA3  GLY  48           HA3      GLY  48  -6.149  -3.931   0.479
  422    H    LEU  49           H        LEU  49  -8.170  -2.944   1.698
  423    HA   LEU  49           HA       LEU  49  -9.621  -1.138  -0.096
  424    HB2  LEU  49           HB2      LEU  49 -10.158  -1.853   2.787
  425    HB3  LEU  49           HB3      LEU  49 -11.158  -0.811   1.792
  426    HG   LEU  49           HG       LEU  49 -10.647  -3.740   1.263
  427   HD11  LEU  49          HD11      LEU  49 -12.925  -4.107   1.956
  428   HD12  LEU  49          HD12      LEU  49 -12.023  -3.338   3.263
  429   HD13  LEU  49          HD13      LEU  49 -13.137  -2.384   2.281
  430   HD21  LEU  49          HD21      LEU  49 -11.037  -2.474  -0.777
  431   HD22  LEU  49          HD22      LEU  49 -12.417  -3.508  -0.408
  432   HD23  LEU  49          HD23      LEU  49 -12.499  -1.777  -0.078
  433    H    PHE  50           H        PHE  50  -8.587   0.654  -0.405
  434    HA   PHE  50           HA       PHE  50  -7.221   2.012   1.805
  435    HB2  PHE  50           HB2      PHE  50  -5.984   1.814  -0.302
  436    HB3  PHE  50           HB3      PHE  50  -7.276   2.647  -1.157
  437    HD1  PHE  50           HD1      PHE  50  -4.558   3.041   1.294
  438    HD2  PHE  50           HD2      PHE  50  -7.450   5.027  -1.118
  439    HE1  PHE  50           HE1      PHE  50  -3.450   5.191   1.742
  440    HE2  PHE  50           HE2      PHE  50  -6.344   7.179  -0.676
  441    HZ   PHE  50           HZ       PHE  50  -4.364   7.274   0.753
  442    H    LEU  51           H        LEU  51  -8.082   3.714   2.810
  443    HA   LEU  51           HA       LEU  51 -10.700   4.625   1.891
  444    HB2  LEU  51           HB2      LEU  51 -10.263   3.855   4.268
  445    HB3  LEU  51           HB3      LEU  51  -9.302   5.303   4.479
  446    HG   LEU  51           HG       LEU  51 -11.693   5.338   5.363
  447   HD11  LEU  51          HD11      LEU  51 -12.052   7.664   4.729
  448   HD12  LEU  51          HD12      LEU  51 -10.363   7.361   5.138
  449   HD13  LEU  51          HD13      LEU  51 -10.849   7.506   3.448
  450   HD21  LEU  51          HD21      LEU  51 -12.758   4.287   3.436
  451   HD22  LEU  51          HD22      LEU  51 -13.443   5.880   3.759
  452   HD23  LEU  51          HD23      LEU  51 -12.305   5.663   2.429
  453    H    SER  52           H        SER  52 -10.778   6.350   0.636
  454    HA   SER  52           HA       SER  52  -8.599   8.235   0.525
  455    HB2  SER  52           HB2      SER  52 -11.286   8.277  -0.878
  456    HB3  SER  52           HB3      SER  52  -9.902   9.302  -1.260
  457    HG   SER  52           HG       SER  52  -8.747   7.426  -1.834
  458    H    ASP  53           H        ASP  53  -8.480   9.348   2.374
  459    HA   ASP  53           HA       ASP  53 -10.786  10.323   3.783
  460    HB2  ASP  53           HB2      ASP  53  -8.719   9.569   4.928
  461    HB3  ASP  53           HB3      ASP  53  -7.844  10.911   4.199
  462    H    ASP  54           H        ASP  54  -8.049  11.827   2.112
  463    HA   ASP  54           HA       ASP  54  -9.459  13.882   0.853
  464    HB2  ASP  54           HB2      ASP  54  -9.943  14.877   2.982
  465    HB3  ASP  54           HB3      ASP  54  -8.288  14.645   3.537
  466    H    ASP  55           H        ASP  55  -6.488  13.625   2.746
  467    HA   ASP  55           HA       ASP  55  -4.920  14.391   0.383
  468    HB2  ASP  55           HB2      ASP  55  -4.585  15.791   2.375
  469    HB3  ASP  55           HB3      ASP  55  -4.214  14.366   3.334
  470    HA   PRO  56           HA       PRO  56  -3.512  10.241  -0.302
  471    HB2  PRO  56           HB2      PRO  56  -0.767  10.910  -0.540
  472    HB3  PRO  56           HB3      PRO  56  -1.937  10.709  -1.845
  473    HG2  PRO  56           HG2      PRO  56  -0.977  13.189  -0.529
  474    HG3  PRO  56           HG3      PRO  56  -1.515  12.935  -2.199
  475    HD2  PRO  56           HD2      PRO  56  -3.053  14.217  -0.422
  476    HD3  PRO  56           HD3      PRO  56  -3.762  13.125  -1.632
  477    H    LYS  57           H        LYS  57  -1.803  12.264   2.059
  478    HA   LYS  57           HA       LYS  57  -0.626   9.929   3.334
  479    HB2  LYS  57           HB2      LYS  57  -0.547  12.848   4.106
  480    HB3  LYS  57           HB3      LYS  57   0.355  11.566   4.899
  481    HG2  LYS  57           HG2      LYS  57   1.544  11.122   2.819
  482    HG3  LYS  57           HG3      LYS  57   0.656  12.439   2.043
  483    HD2  LYS  57           HD2      LYS  57   1.572  14.013   3.658
  484    HD3  LYS  57           HD3      LYS  57   2.440  12.698   4.452
  485    HE2  LYS  57           HE2      LYS  57   3.868  14.016   2.940
  486    HE3  LYS  57           HE3      LYS  57   3.756  12.315   2.490
  487    HZ1  LYS  57           HZ1      LYS  57   2.490  12.791   0.644
  488    HZ2  LYS  57           HZ2      LYS  57   3.518  14.143   0.679
  489    HZ3  LYS  57           HZ3      LYS  57   1.928  14.268   1.257
  490    H    LYS  58           H        LYS  58  -3.372  12.050   3.779
  491    HA   LYS  58           HA       LYS  58  -3.965  11.254   6.460
  492    HB2  LYS  58           HB2      LYS  58  -5.775  12.356   4.305
  493    HB3  LYS  58           HB3      LYS  58  -6.209  12.188   5.998
  494    HG2  LYS  58           HG2      LYS  58  -4.567  13.822   6.634
  495    HG3  LYS  58           HG3      LYS  58  -3.970  13.917   4.972
  496    HD2  LYS  58           HD2      LYS  58  -6.179  14.696   4.246
  497    HD3  LYS  58           HD3      LYS  58  -6.737  14.656   5.917
  498    HE2  LYS  58           HE2      LYS  58  -5.066  16.329   6.517
  499    HE3  LYS  58           HE3      LYS  58  -4.484  16.353   4.853
  500    HZ1  LYS  58           HZ1      LYS  58  -6.687  17.125   4.151
  501    HZ2  LYS  58           HZ2      LYS  58  -5.968  18.197   5.257
  502    HZ3  LYS  58           HZ3      LYS  58  -7.199  17.147   5.770
  503    H    GLY  59           H        GLY  59  -4.613  10.024   3.285
  504    HA2  GLY  59           HA2      GLY  59  -6.714   8.253   3.794
  505    HA3  GLY  59           HA3      GLY  59  -5.502   8.053   2.535
  506    H    ILE  60           H        ILE  60  -6.648   5.912   3.986
  507    HA   ILE  60           HA       ILE  60  -4.323   4.921   5.460
  508    HB   ILE  60           HB       ILE  60  -5.802   3.998   7.245
  509   HG12  ILE  60          HG12      ILE  60  -7.849   5.902   6.085
  510   HG13  ILE  60          HG13      ILE  60  -7.927   4.147   5.982
  511   HG21  ILE  60          HG21      ILE  60  -4.464   5.992   7.635
  512   HG22  ILE  60          HG22      ILE  60  -5.769   7.002   7.012
  513   HG23  ILE  60          HG23      ILE  60  -5.998   6.085   8.501
  514   HD11  ILE  60          HD11      ILE  60  -8.092   4.019   8.415
  515   HD12  ILE  60          HD12      ILE  60  -8.026   5.779   8.508
  516   HD13  ILE  60          HD13      ILE  60  -9.390   4.987   7.717
  517    H    TRP  61           H        TRP  61  -4.251   2.635   5.655
  518    HA   TRP  61           HA       TRP  61  -5.860   1.244   3.652
  519    HB2  TRP  61           HB2      TRP  61  -3.351   0.472   5.138
  520    HB3  TRP  61           HB3      TRP  61  -4.271  -0.680   4.174
  521    HD1  TRP  61           HD1      TRP  61  -1.820   2.174   3.871
  522    HE1  TRP  61           HE1      TRP  61  -1.099   2.431   1.414
  523    HE3  TRP  61           HE3      TRP  61  -5.211  -0.985   1.734
  524    HZ2  TRP  61           HZ2      TRP  61  -1.888   1.415  -1.102
  525    HZ3  TRP  61           HZ3      TRP  61  -5.165  -1.289  -0.705
  526    HH2  TRP  61           HH2      TRP  61  -3.536  -0.112  -2.091
  527    H    LEU  62           H        LEU  62  -7.535   0.099   4.197
  528    HA   LEU  62           HA       LEU  62  -8.272  -0.158   6.967
  529    HB2  LEU  62           HB2      LEU  62  -9.654  -1.203   4.498
  530    HB3  LEU  62           HB3      LEU  62 -10.362  -1.025   6.091
  531    HG   LEU  62           HG       LEU  62  -9.412   1.262   4.364
  532   HD11  LEU  62          HD11      LEU  62 -12.195   0.270   4.947
  533   HD12  LEU  62          HD12      LEU  62 -11.792   1.755   4.084
  534   HD13  LEU  62          HD13      LEU  62 -11.357   0.191   3.397
  535   HD21  LEU  62          HD21      LEU  62  -9.275   1.728   6.756
  536   HD22  LEU  62          HD22      LEU  62 -10.555   2.668   5.988
  537   HD23  LEU  62          HD23      LEU  62 -10.961   1.243   6.946
  538    H    GLU  63           H        GLU  63  -7.477  -1.772   8.175
  539    HA   GLU  63           HA       GLU  63  -6.505  -4.199   7.038
  540    HB2  GLU  63           HB2      GLU  63  -6.120  -4.833   9.403
  541    HB3  GLU  63           HB3      GLU  63  -5.454  -3.257   9.001
  542    HG2  GLU  63           HG2      GLU  63  -7.764  -2.406   9.905
  543    HG3  GLU  63           HG3      GLU  63  -7.751  -3.956  10.748
  544    H    ALA  64           H        ALA  64  -7.255  -6.336   7.588
  545    HA   ALA  64           HA       ALA  64 -10.018  -6.652   7.092
  546    HB1  ALA  64           HB1      ALA  64  -9.614  -9.036   7.341
  547    HB2  ALA  64           HB2      ALA  64  -8.335  -8.286   6.386
  548    HB3  ALA  64           HB3      ALA  64  -8.045  -8.706   8.074
  549    H    GLY  65           H        GLY  65  -8.155  -6.518  10.015
  550    HA2  GLY  65           HA2      GLY  65 -10.191  -7.762  11.639
  551    HA3  GLY  65           HA3      GLY  65  -8.674  -7.085  12.199
  552    H    LYS  66           H        LYS  66 -11.012  -5.246  10.286
  553    HA   LYS  66           HA       LYS  66 -12.396  -4.328  12.627
  554    HB2  LYS  66           HB2      LYS  66 -11.610  -2.236  12.889
  555    HB3  LYS  66           HB3      LYS  66 -10.171  -2.865  12.100
  556    HG2  LYS  66           HG2      LYS  66 -12.414  -1.538  10.607
  557    HG3  LYS  66           HG3      LYS  66 -11.043  -0.653  11.271
  558    HD2  LYS  66           HD2      LYS  66  -9.528  -1.705   9.825
  559    HD3  LYS  66           HD3      LYS  66 -10.677  -2.983   9.416
  560    HE2  LYS  66           HE2      LYS  66 -10.991  -0.070   8.693
  561    HE3  LYS  66           HE3      LYS  66 -10.409  -1.328   7.603
  562    HZ1  LYS  66           HZ1      LYS  66 -13.092  -1.144   8.851
  563    HZ2  LYS  66           HZ2      LYS  66 -12.548  -2.475   7.957
  564    HZ3  LYS  66           HZ3      LYS  66 -12.713  -0.965   7.206
  565    H    ALA  67           H        ALA  67 -14.237  -2.998  12.142
  566    HA   ALA  67           HA       ALA  67 -15.413  -3.785   9.604
  567    HB1  ALA  67           HB1      ALA  67 -17.497  -3.012  10.561
  568    HB2  ALA  67           HB2      ALA  67 -16.644  -4.026  11.729
  569    HB3  ALA  67           HB3      ALA  67 -16.636  -2.270  11.909
  570    H    LEU  68           H        LEU  68 -16.906  -1.960   8.593
  571    HA   LEU  68           HA       LEU  68 -14.988  -0.025   7.662
  572    HB2  LEU  68           HB2      LEU  68 -17.907  -0.320   6.977
  573    HB3  LEU  68           HB3      LEU  68 -16.746   0.688   6.137
  574    HG   LEU  68           HG       LEU  68 -16.638  -2.324   6.299
  575   HD11  LEU  68          HD11      LEU  68 -17.388  -0.495   4.024
  576   HD12  LEU  68          HD12      LEU  68 -17.201  -2.246   3.920
  577   HD13  LEU  68          HD13      LEU  68 -18.482  -1.554   4.915
  578   HD21  LEU  68          HD21      LEU  68 -14.429  -1.314   6.149
  579   HD22  LEU  68          HD22      LEU  68 -14.858  -2.115   4.637
  580   HD23  LEU  68          HD23      LEU  68 -14.949  -0.359   4.762
  581    H    ASP  69           H        ASP  69 -18.217   0.287   9.105
  582    HA   ASP  69           HA       ASP  69 -18.020   3.106   9.459
  583    HB2  ASP  69           HB2      ASP  69 -20.188   2.027   9.155
  584    HB3  ASP  69           HB3      ASP  69 -19.959   1.083  10.620
  585    H    TYR  70           H        TYR  70 -16.700   0.533  11.160
  586    HA   TYR  70           HA       TYR  70 -16.616   1.483  13.781
  587    HB2  TYR  70           HB2      TYR  70 -15.798  -0.679  13.515
  588    HB3  TYR  70           HB3      TYR  70 -14.840  -0.264  12.100
  589    HD1  TYR  70           HD1      TYR  70 -14.996   0.020  15.791
  590    HD2  TYR  70           HD2      TYR  70 -12.595   0.356  12.301
  591    HE1  TYR  70           HE1      TYR  70 -12.987   0.188  17.198
  592    HE2  TYR  70           HE2      TYR  70 -10.579   0.527  13.692
  593    HH   TYR  70           HH       TYR  70 -10.580  -0.189  17.029
  594    H    TYR  71           H        TYR  71 -14.706   2.286  10.934
  595    HA   TYR  71           HA       TYR  71 -13.216   4.358  12.286
  596    HB2  TYR  71           HB2      TYR  71 -13.441   3.399   9.457
  597    HB3  TYR  71           HB3      TYR  71 -12.755   4.989   9.774
  598    HD1  TYR  71           HD1      TYR  71 -10.678   5.188  11.127
  599    HD2  TYR  71           HD2      TYR  71 -12.219   1.415   9.907
  600    HE1  TYR  71           HE1      TYR  71  -8.502   4.137  11.607
  601    HE2  TYR  71           HE2      TYR  71 -10.051   0.363  10.386
  602    HH   TYR  71           HH       TYR  71  -7.632   1.876  12.180
  603    H    MET  72           H        MET  72 -13.505   6.265  10.065
  604    HA   MET  72           HA       MET  72 -15.920   7.579  11.030
  605    HB2  MET  72           HB2      MET  72 -13.680   8.577   9.264
  606    HB3  MET  72           HB3      MET  72 -15.039   9.551   9.805
  607    HG2  MET  72           HG2      MET  72 -14.335   9.264  12.120
  608    HG3  MET  72           HG3      MET  72 -12.982   8.266  11.586
  609    HE1  MET  72           HE1      MET  72 -12.109   9.795   8.918
  610    HE2  MET  72           HE2      MET  72 -10.846  10.854   9.545
  611    HE3  MET  72           HE3      MET  72 -10.959   9.188  10.109
  612    H    LEU  73           H        LEU  73 -15.517   5.349   8.775
  613    HA   LEU  73           HA       LEU  73 -16.411   6.697   6.404
  614    HB2  LEU  73           HB2      LEU  73 -16.874   3.825   6.416
  615    HB3  LEU  73           HB3      LEU  73 -15.981   4.812   5.285
  616    HG   LEU  73           HG       LEU  73 -14.924   3.669   7.868
  617   HD11  LEU  73          HD11      LEU  73 -15.223   2.019   6.122
  618   HD12  LEU  73          HD12      LEU  73 -14.362   3.045   4.976
  619   HD13  LEU  73          HD13      LEU  73 -13.506   2.352   6.355
  620   HD21  LEU  73          HD21      LEU  73 -13.926   5.835   7.415
  621   HD22  LEU  73          HD22      LEU  73 -12.763   4.540   7.130
  622   HD23  LEU  73          HD23      LEU  73 -13.550   5.334   5.765
  623    H    ARG  74           H        ARG  74 -18.290   6.634   5.419
  624    HA   ARG  74           HA       ARG  74 -20.554   5.191   6.242
  625    HB2  ARG  74           HB2      ARG  74 -21.871   7.134   7.136
  626    HB3  ARG  74           HB3      ARG  74 -20.568   6.608   8.185
  627    HG2  ARG  74           HG2      ARG  74 -19.202   8.469   7.294
  628    HG3  ARG  74           HG3      ARG  74 -20.627   9.016   6.398
  629    HD2  ARG  74           HD2      ARG  74 -20.589  10.231   8.419
  630    HD3  ARG  74           HD3      ARG  74 -21.859   9.034   8.575
  631    HE   ARG  74           HE       ARG  74 -19.694   7.802   9.652
  632   HH11  ARG  74          HH11      ARG  74 -21.282  10.874  10.265
  633   HH12  ARG  74          HH12      ARG  74 -20.831  10.902  11.942
  634   HH21  ARG  74          HH21      ARG  74 -19.111   7.843  11.845
  635   HH22  ARG  74          HH22      ARG  74 -19.588   9.191  12.845
  636    H    ASN  75           H        ASN  75 -22.502   7.045   5.470
  637    HA   ASN  75           HA       ASN  75 -22.429   6.748   2.680
  638    HB2  ASN  75           HB2      ASN  75 -24.177   8.289   4.565
  639    HB3  ASN  75           HB3      ASN  75 -24.345   8.533   2.828
  640   HD21  ASN  75          HD21      ASN  75 -24.542   6.188   5.420
  641   HD22  ASN  75          HD22      ASN  75 -25.514   5.039   4.552
  642    H    GLY  76           H        GLY  76 -20.760   7.654   1.593
  643    HA2  GLY  76           HA2      GLY  76 -20.688   9.804   0.250
  644    HA3  GLY  76           HA3      GLY  76 -20.505  10.589   1.809
  645    H    ASP  77           H        ASP  77 -18.809   8.027   2.501
  646    HA   ASP  77           HA       ASP  77 -16.328   9.352   1.910
  647    HB2  ASP  77           HB2      ASP  77 -16.945   6.776   3.359
  648    HB3  ASP  77           HB3      ASP  77 -15.317   7.418   3.162
  649    H    THR  78           H        THR  78 -14.801   8.828   0.488
  650    HA   THR  78           HA       THR  78 -15.441   6.889  -1.571
  651    HB   THR  78           HB       THR  78 -12.928   8.554  -1.382
  652    HG1  THR  78           HG1      THR  78 -14.530  10.069  -1.205
  653   HG21  THR  78          HG21      THR  78 -14.523   7.565  -3.752
  654   HG22  THR  78          HG22      THR  78 -13.043   6.821  -3.141
  655   HG23  THR  78          HG23      THR  78 -12.999   8.451  -3.814
  656    H    MET  79           H        MET  79 -14.519   4.889  -1.745
  657    HA   MET  79           HA       MET  79 -12.222   4.297  -0.017
  658    HB2  MET  79           HB2      MET  79 -14.454   3.421   0.891
  659    HB3  MET  79           HB3      MET  79 -14.449   2.317  -0.479
  660    HG2  MET  79           HG2      MET  79 -12.294   1.417   0.273
  661    HG3  MET  79           HG3      MET  79 -12.344   2.495   1.665
  662    HE1  MET  79           HE1      MET  79 -13.671  -0.694  -0.031
  663    HE2  MET  79           HE2      MET  79 -15.068  -1.140   0.961
  664    HE3  MET  79           HE3      MET  79 -15.148   0.280  -0.086
  665    H    GLU  80           H        GLU  80 -10.628   3.767  -1.251
  666    HA   GLU  80           HA       GLU  80 -11.055   3.036  -4.024
  667    HB2  GLU  80           HB2      GLU  80  -9.327   4.700  -3.016
  668    HB3  GLU  80           HB3      GLU  80  -8.403   3.263  -2.615
  669    HG2  GLU  80           HG2      GLU  80  -8.082   2.707  -4.873
  670    HG3  GLU  80           HG3      GLU  80  -9.324   3.841  -5.407
  671    H    TYR  81           H        TYR  81 -11.072   0.912  -4.738
  672    HA   TYR  81           HA       TYR  81  -9.947  -1.127  -2.972
  673    HB2  TYR  81           HB2      TYR  81 -12.252  -1.467  -3.887
  674    HB3  TYR  81           HB3      TYR  81 -11.576  -1.455  -5.511
  675    HD1  TYR  81           HD1      TYR  81 -11.523  -3.309  -2.292
  676    HD2  TYR  81           HD2      TYR  81 -10.710  -3.443  -6.466
  677    HE1  TYR  81           HE1      TYR  81 -11.142  -5.732  -2.136
  678    HE2  TYR  81           HE2      TYR  81 -10.329  -5.870  -6.324
  679    HH   TYR  81           HH       TYR  81  -9.701  -7.529  -4.626
  680    H    ARG  82           H        ARG  82  -7.850  -1.283  -3.278
  681    HA   ARG  82           HA       ARG  82  -6.812  -1.281  -6.018
  682    HB2  ARG  82           HB2      ARG  82  -5.001   0.298  -5.359
  683    HB3  ARG  82           HB3      ARG  82  -6.602   1.025  -5.394
  684    HG2  ARG  82           HG2      ARG  82  -6.756   0.952  -3.007
  685    HG3  ARG  82           HG3      ARG  82  -5.256   0.030  -2.895
  686    HD2  ARG  82           HD2      ARG  82  -5.498   2.823  -3.998
  687    HD3  ARG  82           HD3      ARG  82  -4.961   2.421  -2.368
  688    HE   ARG  82           HE       ARG  82  -3.165   1.079  -3.647
  689   HH11  ARG  82          HH11      ARG  82  -4.589   4.077  -4.727
  690   HH12  ARG  82          HH12      ARG  82  -3.138   4.636  -5.517
  691   HH21  ARG  82          HH21      ARG  82  -1.254   1.785  -4.710
  692   HH22  ARG  82          HH22      ARG  82  -1.240   3.330  -5.509
  693    H    LYS  83           H        LYS  83  -4.379  -1.699  -5.973
  694    HA   LYS  83           HA       LYS  83  -3.920  -4.059  -4.434
  695    HB2  LYS  83           HB2      LYS  83  -3.035  -3.817  -6.710
  696    HB3  LYS  83           HB3      LYS  83  -2.057  -2.451  -6.196
  697    HG2  LYS  83           HG2      LYS  83  -0.499  -3.762  -5.201
  698    HG3  LYS  83           HG3      LYS  83  -1.674  -4.995  -4.744
  699    HD2  LYS  83           HD2      LYS  83  -1.737  -5.841  -6.997
  700    HD3  LYS  83           HD3      LYS  83  -0.715  -4.518  -7.564
  701    HE2  LYS  83           HE2      LYS  83   1.157  -5.334  -6.367
  702    HE3  LYS  83           HE3      LYS  83   0.169  -6.475  -5.460
  703    HZ1  LYS  83           HZ1      LYS  83   1.527  -7.449  -7.308
  704    HZ2  LYS  83           HZ2      LYS  83   0.513  -6.635  -8.404
  705    HZ3  LYS  83           HZ3      LYS  83  -0.128  -7.812  -7.361
  706    H    LYS  84           H        LYS  84  -2.950  -4.273  -2.548
  707    HA   LYS  84           HA       LYS  84  -2.517  -2.212  -0.747
  708    HB2  LYS  84           HB2      LYS  84  -1.164  -4.913  -0.871
  709    HB3  LYS  84           HB3      LYS  84  -1.137  -3.848   0.521
  710    HG2  LYS  84           HG2      LYS  84  -3.674  -4.951  -0.640
  711    HG3  LYS  84           HG3      LYS  84  -2.738  -5.768   0.613
  712    HD2  LYS  84           HD2      LYS  84  -2.910  -3.456   1.822
  713    HD3  LYS  84           HD3      LYS  84  -4.299  -3.239   0.755
  714    HE2  LYS  84           HE2      LYS  84  -4.984  -4.182   2.899
  715    HE3  LYS  84           HE3      LYS  84  -5.270  -5.320   1.583
  716    HZ1  LYS  84           HZ1      LYS  84  -3.215  -6.463   2.188
  717    HZ2  LYS  84           HZ2      LYS  84  -4.299  -6.432   3.486
  718    HZ3  LYS  84           HZ3      LYS  84  -2.971  -5.381   3.470
  719    H    GLN  85           H        GLN  85  -0.478  -3.499  -3.206
  720    HA   GLN  85           HA       GLN  85   1.913  -2.313  -2.060
  721    HB2  GLN  85           HB2      GLN  85   2.183  -3.881  -4.514
  722    HB3  GLN  85           HB3      GLN  85   3.045  -4.024  -2.988
  723    HG2  GLN  85           HG2      GLN  85   0.900  -5.114  -2.110
  724    HG3  GLN  85           HG3      GLN  85   0.455  -5.277  -3.807
  725   HE21  GLN  85          HE21      GLN  85   2.428  -6.409  -1.247
  726   HE22  GLN  85          HE22      GLN  85   3.191  -7.694  -2.112
  727    H    ARG  86           H        ARG  86   3.268  -1.036  -3.302
  728    HA   ARG  86           HA       ARG  86   2.174  -0.042  -5.829
  729    HB2  ARG  86           HB2      ARG  86   3.362   2.198  -5.055
  730    HB3  ARG  86           HB3      ARG  86   1.698   1.845  -4.630
  731    HG2  ARG  86           HG2      ARG  86   2.828   2.735  -2.719
  732    HG3  ARG  86           HG3      ARG  86   2.468   1.035  -2.428
  733    HD2  ARG  86           HD2      ARG  86   4.755   1.806  -1.711
  734    HD3  ARG  86           HD3      ARG  86   4.719   0.404  -2.777
  735    HE   ARG  86           HE       ARG  86   5.775   1.612  -4.392
  736   HH11  ARG  86          HH11      ARG  86   4.674   3.816  -1.899
  737   HH12  ARG  86          HH12      ARG  86   5.553   5.170  -2.536
  738   HH21  ARG  86          HH21      ARG  86   6.944   3.362  -5.221
  739   HH22  ARG  86          HH22      ARG  86   6.852   4.917  -4.438
  740    HA   PRO  87           HA       PRO  87   6.007  -1.059  -7.569
  741    HB2  PRO  87           HB2      PRO  87   6.104   1.507  -9.024
  742    HB3  PRO  87           HB3      PRO  87   6.013  -0.140  -9.655
  743    HG2  PRO  87           HG2      PRO  87   3.911   1.515  -9.762
  744    HG3  PRO  87           HG3      PRO  87   3.711  -0.223  -9.475
  745    HD2  PRO  87           HD2      PRO  87   3.614   2.046  -7.524
  746    HD3  PRO  87           HD3      PRO  87   2.595   0.593  -7.616
  747    H    LEU  88           H        LEU  88   7.807  -1.066  -6.441
  748    HA   LEU  88           HA       LEU  88   9.009   1.505  -5.691
  749    HB2  LEU  88           HB2      LEU  88   9.193  -1.205  -4.492
  750    HB3  LEU  88           HB3      LEU  88  10.602  -0.162  -4.392
  751    HG   LEU  88           HG       LEU  88   8.602   1.520  -3.583
  752   HD11  LEU  88          HD11      LEU  88   7.297   0.304  -1.914
  753   HD12  LEU  88          HD12      LEU  88   6.952  -0.253  -3.552
  754   HD13  LEU  88          HD13      LEU  88   7.982  -1.215  -2.492
  755   HD21  LEU  88          HD21      LEU  88  10.312  -0.284  -1.886
  756   HD22  LEU  88          HD22      LEU  88  10.791   1.268  -2.574
  757   HD23  LEU  88          HD23      LEU  88   9.525   1.201  -1.348
  758    H    LYS  89           H        LYS  89  10.669   2.225  -6.777
  759    HA   LYS  89           HA       LYS  89  12.058   0.534  -8.689
  760    HB2  LYS  89           HB2      LYS  89  12.502   3.441  -7.962
  761    HB3  LYS  89           HB3      LYS  89  13.195   2.606  -9.343
  762    HG2  LYS  89           HG2      LYS  89  10.246   3.042  -8.925
  763    HG3  LYS  89           HG3      LYS  89  11.285   4.080  -9.902
  764    HD2  LYS  89           HD2      LYS  89  10.925   1.127 -10.380
  765    HD3  LYS  89           HD3      LYS  89   9.991   2.380 -11.200
  766    HE2  LYS  89           HE2      LYS  89  12.049   3.326 -12.108
  767    HE3  LYS  89           HE3      LYS  89  12.993   2.095 -11.273
  768    HZ1  LYS  89           HZ1      LYS  89  10.907   1.468 -13.288
  769    HZ2  LYS  89           HZ2      LYS  89  12.044   0.406 -12.616
  770    HZ3  LYS  89           HZ3      LYS  89  12.553   1.638 -13.662
  771    H    ILE  90           H        ILE  90  13.744  -0.687  -7.952
  772    HA   ILE  90           HA       ILE  90  15.192   0.322  -5.588
  773    HB   ILE  90           HB       ILE  90  14.305  -2.534  -6.050
  774   HG12  ILE  90          HG12      ILE  90  12.482  -1.048  -5.301
  775   HG13  ILE  90          HG13      ILE  90  12.906  -2.233  -4.072
  776   HG21  ILE  90          HG21      ILE  90  16.477  -2.486  -4.996
  777   HG22  ILE  90          HG22      ILE  90  15.902  -1.326  -3.796
  778   HG23  ILE  90          HG23      ILE  90  15.256  -2.967  -3.818
  779   HD11  ILE  90          HD11      ILE  90  13.744   0.657  -4.109
  780   HD12  ILE  90          HD12      ILE  90  12.502  -0.061  -3.082
  781   HD13  ILE  90          HD13      ILE  90  14.192  -0.527  -2.881
  782    H    ARG  91           H        ARG  91  17.384   0.288  -5.789
  783    HA   ARG  91           HA       ARG  91  18.510  -1.290  -7.998
  784    HB2  ARG  91           HB2      ARG  91  18.908   1.185  -8.041
  785    HB3  ARG  91           HB3      ARG  91  19.758   1.025  -6.510
  786    HG2  ARG  91           HG2      ARG  91  21.404  -0.438  -7.570
  787    HG3  ARG  91           HG3      ARG  91  20.566  -0.249  -9.111
  788    HD2  ARG  91           HD2      ARG  91  21.746   2.016  -7.507
  789    HD3  ARG  91           HD3      ARG  91  22.547   1.229  -8.866
  790    HE   ARG  91           HE       ARG  91  20.457   1.983 -10.148
  791   HH11  ARG  91          HH11      ARG  91  21.920   3.761  -7.504
  792   HH12  ARG  91          HH12      ARG  91  21.373   5.313  -8.083
  793   HH21  ARG  91          HH21      ARG  91  19.740   3.999 -10.908
  794   HH22  ARG  91          HH22      ARG  91  20.124   5.446 -10.016
  795    H    MET  92           H        MET  92  19.611  -3.042  -7.461
  796    HA   MET  92           HA       MET  92  20.066  -3.687  -4.692
  797    HB2  MET  92           HB2      MET  92  20.025  -5.091  -7.278
  798    HB3  MET  92           HB3      MET  92  21.176  -5.730  -6.114
  799    HG2  MET  92           HG2      MET  92  18.843  -6.734  -6.186
  800    HG3  MET  92           HG3      MET  92  19.514  -6.327  -4.613
  801    HE1  MET  92           HE1      MET  92  17.868  -4.149  -7.433
  802    HE2  MET  92           HE2      MET  92  16.824  -5.564  -7.311
  803    HE3  MET  92           HE3      MET  92  16.226  -3.981  -6.813
  804    H    LEU  93           H        LEU  93  22.226  -4.992  -4.327
  805    HA   LEU  93           HA       LEU  93  24.140  -2.995  -3.949
  806    HB2  LEU  93           HB2      LEU  93  24.562  -5.986  -3.877
  807    HB3  LEU  93           HB3      LEU  93  25.645  -4.792  -3.201
  808    HG   LEU  93           HG       LEU  93  24.539  -5.597  -1.342
  809   HD11  LEU  93          HD11      LEU  93  24.451  -3.186  -1.345
  810   HD12  LEU  93          HD12      LEU  93  22.915  -3.220  -2.213
  811   HD13  LEU  93          HD13      LEU  93  23.012  -3.850  -0.568
  812   HD21  LEU  93          HD21      LEU  93  22.883  -6.932  -2.626
  813   HD22  LEU  93          HD22      LEU  93  22.224  -6.166  -1.180
  814   HD23  LEU  93          HD23      LEU  93  21.890  -5.481  -2.768
  815    H    ASP  94           H        ASP  94  23.931  -5.554  -6.357
  816    HA   ASP  94           HA       ASP  94  26.496  -5.105  -7.498
  817    HB2  ASP  94           HB2      ASP  94  25.146  -7.210  -7.722
  818    HB3  ASP  94           HB3      ASP  94  24.076  -6.349  -8.824
  819    H    GLY  95           H        GLY  95  23.645  -3.337  -7.598
  820    HA2  GLY  95           HA2      GLY  95  23.550  -1.175  -8.595
  821    HA3  GLY  95           HA3      GLY  95  24.685  -1.724  -9.824
  822    H    THR  96           H        THR  96  22.235  -3.936  -9.043
  823    HA   THR  96           HA       THR  96  21.065  -3.558 -11.679
  824    HB   THR  96           HB       THR  96  20.578  -5.781  -9.685
  825    HG1  THR  96           HG1      THR  96  22.108  -6.875 -11.233
  826   HG21  THR  96          HG21      THR  96  18.879  -5.615 -11.434
  827   HG22  THR  96          HG22      THR  96  19.874  -7.052 -11.665
  828   HG23  THR  96          HG23      THR  96  20.137  -5.627 -12.671
  829    H    VAL  97           H        VAL  97  19.054  -2.749 -11.978
  830    HA   VAL  97           HA       VAL  97  17.576  -2.091  -9.525
  831    HB   VAL  97           HB       VAL  97  18.268  -0.092 -10.676
  832   HG11  VAL  97          HG11      VAL  97  17.556   0.434 -12.950
  833   HG12  VAL  97          HG12      VAL  97  18.596  -0.989 -12.900
  834   HG13  VAL  97          HG13      VAL  97  16.854  -1.178 -13.099
  835   HG21  VAL  97          HG21      VAL  97  16.105   0.992 -11.075
  836   HG22  VAL  97          HG22      VAL  97  15.327  -0.591 -11.099
  837   HG23  VAL  97          HG23      VAL  97  16.086  -0.004  -9.620
  838    H    LYS  98           H        LYS  98  15.529  -2.652  -9.275
  839    HA   LYS  98           HA       LYS  98  14.066  -3.829 -11.522
  840    HB2  LYS  98           HB2      LYS  98  13.406  -5.804 -10.405
  841    HB3  LYS  98           HB3      LYS  98  15.142  -5.699 -10.164
  842    HG2  LYS  98           HG2      LYS  98  14.896  -5.084  -7.906
  843    HG3  LYS  98           HG3      LYS  98  13.181  -4.719  -8.112
  844    HD2  LYS  98           HD2      LYS  98  14.329  -7.482  -8.471
  845    HD3  LYS  98           HD3      LYS  98  13.704  -6.903  -6.924
  846    HE2  LYS  98           HE2      LYS  98  11.856  -7.949  -7.768
  847    HE3  LYS  98           HE3      LYS  98  11.590  -6.307  -8.356
  848    HZ1  LYS  98           HZ1      LYS  98  12.745  -8.560  -9.921
  849    HZ2  LYS  98           HZ2      LYS  98  12.517  -6.981 -10.499
  850    HZ3  LYS  98           HZ3      LYS  98  11.177  -7.930 -10.086
  851    H    THR  99           H        THR  99  11.751  -3.838 -11.200
  852    HA   THR  99           HA       THR  99  10.900  -2.026  -9.048
  853    HB   THR  99           HB       THR  99   9.495  -2.565 -11.673
  854    HG1  THR  99           HG1      THR  99  11.538  -1.382 -11.826
  855   HG21  THR  99          HG21      THR  99   8.013  -1.897  -9.843
  856   HG22  THR  99          HG22      THR  99   8.138  -0.623 -11.056
  857   HG23  THR  99          HG23      THR  99   9.021  -0.482  -9.537
  858    H    ILE 100           H        ILE 100   9.798  -3.013  -7.465
  859    HA   ILE 100           HA       ILE 100   8.318  -5.458  -8.129
  860    HB   ILE 100           HB       ILE 100  10.495  -5.936  -6.993
  861   HG12  ILE 100          HG12      ILE 100   8.197  -7.228  -6.668
  862   HG13  ILE 100          HG13      ILE 100   9.655  -7.700  -5.808
  863   HG21  ILE 100          HG21      ILE 100   9.266  -4.410  -4.708
  864   HG22  ILE 100          HG22      ILE 100  10.698  -5.432  -4.580
  865   HG23  ILE 100          HG23      ILE 100  10.728  -3.998  -5.608
  866   HD11  ILE 100          HD11      ILE 100   7.714  -7.710  -4.355
  867   HD12  ILE 100          HD12      ILE 100   8.884  -6.497  -3.837
  868   HD13  ILE 100          HD13      ILE 100   7.430  -6.005  -4.704
  869    H    MET 101           H        MET 101   6.379  -5.750  -7.009
  870    HA   MET 101           HA       MET 101   5.259  -3.301  -5.913
  871    HB2  MET 101           HB2      MET 101   3.956  -5.996  -6.348
  872    HB3  MET 101           HB3      MET 101   3.130  -4.480  -6.027
  873    HG2  MET 101           HG2      MET 101   4.787  -5.050  -8.472
  874    HG3  MET 101           HG3      MET 101   3.031  -5.173  -8.388
  875    HE1  MET 101           HE1      MET 101   2.072  -1.440  -7.581
  876    HE2  MET 101           HE2      MET 101   1.450  -3.071  -7.836
  877    HE3  MET 101           HE3      MET 101   2.439  -2.715  -6.418
  878    H    VAL 102           H        VAL 102   5.583  -2.888  -3.873
  879    HA   VAL 102           HA       VAL 102   5.202  -5.058  -1.908
  880    HB   VAL 102           HB       VAL 102   6.769  -2.787  -0.934
  881   HG11  VAL 102          HG11      VAL 102   8.140  -4.604  -0.016
  882   HG12  VAL 102          HG12      VAL 102   6.426  -4.814   0.345
  883   HG13  VAL 102          HG13      VAL 102   7.184  -5.771  -0.928
  884   HG21  VAL 102          HG21      VAL 102   7.949  -4.545  -3.083
  885   HG22  VAL 102          HG22      VAL 102   7.670  -2.805  -3.186
  886   HG23  VAL 102          HG23      VAL 102   8.858  -3.444  -2.048
  887    H    ASP 103           H        ASP 103   3.943  -4.666  -0.173
  888    HA   ASP 103           HA       ASP 103   1.777  -2.995  -0.437
  889    HB2  ASP 103           HB2      ASP 103   2.908  -4.073   2.149
  890    HB3  ASP 103           HB3      ASP 103   1.262  -3.514   1.898
  891    H    ASP 104           H        ASP 104   1.292  -0.942   0.010
  892    HA   ASP 104           HA       ASP 104   3.288   0.852   1.101
  893    HB2  ASP 104           HB2      ASP 104   1.865   1.670  -0.690
  894    HB3  ASP 104           HB3      ASP 104   0.416   1.283   0.228
  895    H    SER 105           H        SER 105   0.784  -1.113   2.246
  896    HA   SER 105           HA       SER 105  -0.145   0.507   4.400
  897    HB2  SER 105           HB2      SER 105  -1.108  -1.827   5.084
  898    HB3  SER 105           HB3      SER 105  -1.719  -1.018   3.639
  899    HG   SER 105           HG       SER 105  -0.892  -3.393   3.641
  900    H    LYS 106           H        LYS 106   2.592  -1.456   3.966
  901    HA   LYS 106           HA       LYS 106   2.980  -1.635   6.870
  902    HB2  LYS 106           HB2      LYS 106   4.192  -3.738   6.492
  903    HB3  LYS 106           HB3      LYS 106   2.530  -3.842   5.933
  904    HG2  LYS 106           HG2      LYS 106   3.532  -4.779   4.139
  905    HG3  LYS 106           HG3      LYS 106   3.694  -3.091   3.655
  906    HD2  LYS 106           HD2      LYS 106   5.920  -3.091   4.796
  907    HD3  LYS 106           HD3      LYS 106   5.757  -4.843   4.961
  908    HE2  LYS 106           HE2      LYS 106   7.003  -4.574   3.016
  909    HE3  LYS 106           HE3      LYS 106   5.358  -4.828   2.429
  910    HZ1  LYS 106           HZ1      LYS 106   6.497  -2.989   1.313
  911    HZ2  LYS 106           HZ2      LYS 106   6.631  -2.176   2.791
  912    HZ3  LYS 106           HZ3      LYS 106   5.104  -2.475   2.125
  913    H    THR 107           H        THR 107   5.378  -1.944   7.400
  914    HA   THR 107           HA       THR 107   6.624   0.430   6.348
  915    HB   THR 107           HB       THR 107   8.273   0.047   8.187
  916    HG1  THR 107           HG1      THR 107   6.562  -1.999   9.123
  917   HG21  THR 107          HG21      THR 107   5.367  -0.099   8.978
  918   HG22  THR 107          HG22      THR 107   6.244   1.370   8.545
  919   HG23  THR 107          HG23      THR 107   6.688   0.471   9.998
  920    H    VAL 108           H        VAL 108   9.375  -0.339   6.895
  921    HA   VAL 108           HA       VAL 108   9.887  -1.186   4.177
  922    HB   VAL 108           HB       VAL 108  11.979  -0.374   6.150
  923   HG11  VAL 108          HG11      VAL 108  12.776  -1.306   4.067
  924   HG12  VAL 108          HG12      VAL 108  11.817  -0.135   3.160
  925   HG13  VAL 108          HG13      VAL 108  13.156   0.415   4.169
  926   HG21  VAL 108          HG21      VAL 108  10.252   1.331   6.239
  927   HG22  VAL 108          HG22      VAL 108  11.679   1.946   5.405
  928   HG23  VAL 108          HG23      VAL 108  10.261   1.452   4.479
  929    H    THR 109           H        THR 109  10.731  -2.336   7.428
  930    HA   THR 109           HA       THR 109  12.552  -4.283   6.893
  931    HB   THR 109           HB       THR 109  10.244  -4.634   8.805
  932    HG1  THR 109           HG1      THR 109  12.280  -3.640  10.091
  933   HG21  THR 109          HG21      THR 109  11.899  -5.872  10.138
  934   HG22  THR 109          HG22      THR 109  13.096  -5.641   8.862
  935   HG23  THR 109          HG23      THR 109  11.657  -6.613   8.557
  936    H    ASP 110           H        ASP 110   9.023  -4.845   6.935
  937    HA   ASP 110           HA       ASP 110   9.092  -7.476   5.955
  938    HB2  ASP 110           HB2      ASP 110   7.123  -6.373   7.031
  939    HB3  ASP 110           HB3      ASP 110   6.905  -5.408   5.574
  940    H    MET 111           H        MET 111   9.018  -4.377   4.357
  941    HA   MET 111           HA       MET 111   8.530  -5.182   1.716
  942    HB2  MET 111           HB2      MET 111   8.401  -2.862   2.371
  943    HB3  MET 111           HB3      MET 111  10.097  -2.855   2.830
  944    HG2  MET 111           HG2      MET 111  10.511  -3.468   0.348
  945    HG3  MET 111           HG3      MET 111   8.875  -2.851   0.108
  946    HE1  MET 111           HE1      MET 111   9.051  -0.915   2.682
  947    HE2  MET 111           HE2      MET 111   9.541   0.659   2.050
  948    HE3  MET 111           HE3      MET 111   8.247  -0.246   1.265
  949    H    LEU 112           H        LEU 112  11.584  -4.583   3.414
  950    HA   LEU 112           HA       LEU 112  13.260  -5.129   1.224
  951    HB2  LEU 112           HB2      LEU 112  13.652  -4.096   3.669
  952    HB3  LEU 112           HB3      LEU 112  14.241  -5.723   3.957
  953    HG   LEU 112           HG       LEU 112  15.790  -5.423   1.997
  954   HD11  LEU 112          HD11      LEU 112  14.572  -3.620   0.886
  955   HD12  LEU 112          HD12      LEU 112  14.895  -2.551   2.254
  956   HD13  LEU 112          HD13      LEU 112  16.229  -3.136   1.255
  957   HD21  LEU 112          HD21      LEU 112  16.601  -5.205   4.254
  958   HD22  LEU 112          HD22      LEU 112  17.352  -3.978   3.233
  959   HD23  LEU 112          HD23      LEU 112  16.043  -3.533   4.326
  960    H    MET 113           H        MET 113  11.935  -7.139   3.777
  961    HA   MET 113           HA       MET 113  13.260  -9.544   3.269
  962    HB2  MET 113           HB2      MET 113  11.742  -9.112   5.192
  963    HB3  MET 113           HB3      MET 113  10.372  -9.138   4.087
  964    HG2  MET 113           HG2      MET 113  10.980 -11.487   3.506
  965    HG3  MET 113           HG3      MET 113  12.191 -11.428   4.786
  966    HE1  MET 113           HE1      MET 113   9.860 -10.764   7.929
  967    HE2  MET 113           HE2      MET 113  11.528 -10.925   7.379
  968    HE3  MET 113           HE3      MET 113  10.566  -9.534   6.881
  969    H    THR 114           H        THR 114  10.328  -8.189   1.890
  970    HA   THR 114           HA       THR 114   9.760 -10.267   0.070
  971    HB   THR 114           HB       THR 114   8.996  -7.350   0.080
  972    HG1  THR 114           HG1      THR 114   7.980  -9.696   1.193
  973   HG21  THR 114          HG21      THR 114   7.967  -9.577  -1.683
  974   HG22  THR 114          HG22      THR 114   8.825  -8.124  -2.208
  975   HG23  THR 114          HG23      THR 114   7.206  -7.997  -1.517
  976    H    ILE 115           H        ILE 115  11.734  -7.316  -0.231
  977    HA   ILE 115           HA       ILE 115  11.961  -7.519  -3.078
  978    HB   ILE 115           HB       ILE 115  13.592  -5.884  -1.127
  979   HG12  ILE 115          HG12      ILE 115  11.250  -5.101  -2.879
  980   HG13  ILE 115          HG13      ILE 115  11.182  -5.335  -1.135
  981   HG21  ILE 115          HG21      ILE 115  14.240  -4.555  -3.083
  982   HG22  ILE 115          HG22      ILE 115  14.784  -6.227  -3.224
  983   HG23  ILE 115          HG23      ILE 115  13.373  -5.678  -4.131
  984   HD11  ILE 115          HD11      ILE 115  11.285  -2.983  -1.685
  985   HD12  ILE 115          HD12      ILE 115  12.751  -3.480  -0.838
  986   HD13  ILE 115          HD13      ILE 115  12.781  -3.238  -2.585
  987    H    CYS 116           H        CYS 116  14.122  -8.243  -0.341
  988    HA   CYS 116           HA       CYS 116  16.338  -8.996  -1.911
  989    HB2  CYS 116           HB2      CYS 116  17.210 -10.044   0.105
  990    HB3  CYS 116           HB3      CYS 116  16.505  -8.480   0.499
  991    HG   CYS 116           HG       CYS 116  14.014 -10.282   1.039
  992    H    ALA 117           H        ALA 117  13.470 -10.680  -0.911
  993    HA   ALA 117           HA       ALA 117  14.349 -13.307  -1.567
  994    HB1  ALA 117           HB1      ALA 117  12.515 -12.883   0.003
  995    HB2  ALA 117           HB2      ALA 117  11.543 -12.231  -1.316
  996    HB3  ALA 117           HB3      ALA 117  12.012 -13.932  -1.324
  997    H    ARG 118           H        ARG 118  13.011 -10.649  -3.369
  998    HA   ARG 118           HA       ARG 118  12.129 -12.118  -5.633
  999    HB2  ARG 118           HB2      ARG 118  13.127  -9.250  -5.569
 1000    HB3  ARG 118           HB3      ARG 118  12.176 -10.002  -6.839
 1001    HG2  ARG 118           HG2      ARG 118  11.245  -9.526  -4.023
 1002    HG3  ARG 118           HG3      ARG 118  10.817  -8.561  -5.430
 1003    HD2  ARG 118           HD2      ARG 118   9.008  -9.936  -5.238
 1004    HD3  ARG 118           HD3      ARG 118  10.001 -10.842  -6.373
 1005    HE   ARG 118           HE       ARG 118   9.995 -11.454  -3.492
 1006   HH11  ARG 118          HH11      ARG 118   9.685 -12.453  -6.839
 1007   HH12  ARG 118          HH12      ARG 118   9.470 -14.131  -6.447
 1008   HH21  ARG 118          HH21      ARG 118   9.681 -13.666  -2.974
 1009   HH22  ARG 118          HH22      ARG 118   9.471 -14.825  -4.261
 1010    H    ILE 119           H        ILE 119  15.178 -10.568  -4.755
 1011    HA   ILE 119           HA       ILE 119  16.468 -11.177  -7.233
 1012    HB   ILE 119           HB       ILE 119  18.028 -10.680  -4.731
 1013   HG12  ILE 119          HG12      ILE 119  16.107  -9.119  -4.595
 1014   HG13  ILE 119          HG13      ILE 119  17.634  -8.281  -4.846
 1015   HG21  ILE 119          HG21      ILE 119  18.262  -9.676  -7.564
 1016   HG22  ILE 119          HG22      ILE 119  19.409  -9.357  -6.261
 1017   HG23  ILE 119          HG23      ILE 119  19.179 -11.005  -6.851
 1018   HD11  ILE 119          HD11      ILE 119  17.103  -8.023  -7.209
 1019   HD12  ILE 119          HD12      ILE 119  15.574  -8.865  -6.955
 1020   HD13  ILE 119          HD13      ILE 119  15.862  -7.309  -6.178
 1021    H    GLY 120           H        GLY 120  16.501 -12.492  -3.955
 1022    HA2  GLY 120           HA2      GLY 120  16.748 -14.948  -3.751
 1023    HA3  GLY 120           HA3      GLY 120  18.009 -14.822  -4.972
 1024    H    ILE 121           H        ILE 121  17.741 -12.355  -2.591
 1025    HA   ILE 121           HA       ILE 121  20.392 -12.953  -1.609
 1026    HB   ILE 121           HB       ILE 121  18.480 -10.755  -0.808
 1027   HG12  ILE 121          HG12      ILE 121  20.822 -10.670  -2.721
 1028   HG13  ILE 121          HG13      ILE 121  19.126 -10.650  -3.191
 1029   HG21  ILE 121          HG21      ILE 121  20.467  -9.646   0.108
 1030   HG22  ILE 121          HG22      ILE 121  20.127 -11.178   0.911
 1031   HG23  ILE 121          HG23      ILE 121  21.427 -11.076  -0.278
 1032   HD11  ILE 121          HD11      ILE 121  18.829  -8.515  -2.053
 1033   HD12  ILE 121          HD12      ILE 121  20.519  -8.539  -1.553
 1034   HD13  ILE 121          HD13      ILE 121  20.106  -8.423  -3.264
 1035    H    THR 122           H        THR 122  17.082 -12.956  -0.418
 1036    HA   THR 122           HA       THR 122  16.069 -13.946   1.356
 1037    HB   THR 122           HB       THR 122  18.731 -15.189   2.064
 1038    HG1  THR 122           HG1      THR 122  18.469 -16.383   0.351
 1039   HG21  THR 122          HG21      THR 122  17.038 -15.322   3.827
 1040   HG22  THR 122          HG22      THR 122  17.340 -16.912   3.126
 1041   HG23  THR 122          HG23      THR 122  15.888 -16.014   2.682
 1042    H    ASN 123           H        ASN 123  19.343 -12.893   2.240
 1043    HA   ASN 123           HA       ASN 123  18.618 -12.071   4.876
 1044    HB2  ASN 123           HB2      ASN 123  20.919 -12.764   4.089
 1045    HB3  ASN 123           HB3      ASN 123  21.022 -11.223   3.252
 1046   HD21  ASN 123          HD21      ASN 123  22.658 -12.316   5.346
 1047   HD22  ASN 123          HD22      ASN 123  22.631 -11.162   6.634
 1048    H    HIS 124           H        HIS 124  17.907 -10.120   5.576
 1049    HA   HIS 124           HA       HIS 124  18.045  -7.841   3.752
 1050    HB2  HIS 124           HB2      HIS 124  15.703  -7.304   3.968
 1051    HB3  HIS 124           HB3      HIS 124  15.867  -8.936   3.334
 1052    HD1  HIS 124           HD1      HIS 124  14.296  -7.010   5.994
 1053    HD2  HIS 124           HD2      HIS 124  15.351 -10.985   5.365
 1054    HE1  HIS 124           HE1      HIS 124  12.952  -8.339   7.641
 1055    HE2  HIS 124           HE2      HIS 124  13.764 -10.712   7.396
 1056    H    ASP 125           H        ASP 125  18.574  -9.031   6.762
 1057    HA   ASP 125           HA       ASP 125  17.637  -6.767   8.279
 1058    HB2  ASP 125           HB2      ASP 125  19.184  -9.245   8.975
 1059    HB3  ASP 125           HB3      ASP 125  19.094  -7.904  10.113
 1060    H    GLU 126           H        GLU 126  20.541  -7.706   6.629
 1061    HA   GLU 126           HA       GLU 126  22.080  -5.619   7.967
 1062    HB2  GLU 126           HB2      GLU 126  23.963  -6.371   6.531
 1063    HB3  GLU 126           HB3      GLU 126  23.344  -7.616   7.590
 1064    HG2  GLU 126           HG2      GLU 126  22.067  -8.530   5.658
 1065    HG3  GLU 126           HG3      GLU 126  22.869  -7.335   4.636
 1066    H    TYR 127           H        TYR 127  19.777  -5.072   6.163
 1067    HA   TYR 127           HA       TYR 127  21.231  -3.239   4.404
 1068    HB2  TYR 127           HB2      TYR 127  18.824  -4.878   3.612
 1069    HB3  TYR 127           HB3      TYR 127  19.534  -3.595   2.641
 1070    HD1  TYR 127           HD1      TYR 127  22.141  -3.919   2.229
 1071    HD2  TYR 127           HD2      TYR 127  19.410  -7.038   3.116
 1072    HE1  TYR 127           HE1      TYR 127  23.678  -5.526   1.217
 1073    HE2  TYR 127           HE2      TYR 127  20.935  -8.672   2.112
 1074    HH   TYR 127           HH       TYR 127  22.756  -8.699   0.434
 1075    H    SER 128           H        SER 128  20.483  -1.222   4.347
 1076    HA   SER 128           HA       SER 128  17.883  -0.654   5.584
 1077    HB2  SER 128           HB2      SER 128  18.825   1.716   5.660
 1078    HB3  SER 128           HB3      SER 128  19.594   0.551   6.738
 1079    HG   SER 128           HG       SER 128  21.204   1.677   5.675
 1080    H    LEU 129           H        LEU 129  17.097   1.610   4.452
 1081    HA   LEU 129           HA       LEU 129  17.402   1.176   1.557
 1082    HB2  LEU 129           HB2      LEU 129  15.133   0.539   2.784
 1083    HB3  LEU 129           HB3      LEU 129  14.841   2.262   2.643
 1084    HG   LEU 129           HG       LEU 129  15.537   0.574   0.246
 1085   HD11  LEU 129          HD11      LEU 129  13.565  -0.404   1.285
 1086   HD12  LEU 129          HD12      LEU 129  12.793   1.182   1.332
 1087   HD13  LEU 129          HD13      LEU 129  13.146   0.419  -0.218
 1088   HD21  LEU 129          HD21      LEU 129  15.752   2.985  -0.030
 1089   HD22  LEU 129          HD22      LEU 129  14.397   2.362  -0.970
 1090   HD23  LEU 129          HD23      LEU 129  14.101   3.209   0.549
 1091    H    VAL 130           H        VAL 130  17.510   3.037   0.296
 1092    HA   VAL 130           HA       VAL 130  17.319   5.601   1.697
 1093    HB   VAL 130           HB       VAL 130  19.674   5.202   1.755
 1094   HG11  VAL 130          HG11      VAL 130  20.989   4.677  -0.228
 1095   HG12  VAL 130          HG12      VAL 130  19.805   3.421   0.136
 1096   HG13  VAL 130          HG13      VAL 130  19.504   4.563  -1.172
 1097   HG21  VAL 130          HG21      VAL 130  19.083   7.005  -0.583
 1098   HG22  VAL 130          HG22      VAL 130  19.091   7.469   1.118
 1099   HG23  VAL 130          HG23      VAL 130  20.589   6.969   0.334
 1100    H    ARG 131           H        ARG 131  15.914   6.816   0.648
 1101    HA   ARG 131           HA       ARG 131  15.266   6.084  -2.120
 1102    HB2  ARG 131           HB2      ARG 131  13.683   7.908  -0.323
 1103    HB3  ARG 131           HB3      ARG 131  13.135   7.056  -1.760
 1104    HG2  ARG 131           HG2      ARG 131  13.481   4.917  -0.516
 1105    HG3  ARG 131           HG3      ARG 131  13.779   5.887   0.930
 1106    HD2  ARG 131           HD2      ARG 131  11.490   5.282   0.981
 1107    HD3  ARG 131           HD3      ARG 131  11.562   6.985   0.519
 1108    HE   ARG 131           HE       ARG 131  11.243   6.200  -1.810
 1109   HH11  ARG 131          HH11      ARG 131  10.146   4.276   0.883
 1110   HH12  ARG 131          HH12      ARG 131   9.036   3.339  -0.060
 1111   HH21  ARG 131          HH21      ARG 131   9.762   4.991  -3.074
 1112   HH22  ARG 131          HH22      ARG 131   8.814   3.749  -2.324
 1113    H    GLU 132           H        GLU 132  16.640   7.240  -3.393
 1114    HA   GLU 132           HA       GLU 132  16.950  10.070  -2.965
 1115    HB2  GLU 132           HB2      GLU 132  17.792   8.341  -5.310
 1116    HB3  GLU 132           HB3      GLU 132  18.239  10.025  -5.085
 1117    HG2  GLU 132           HG2      GLU 132  19.408   9.395  -3.003
 1118    HG3  GLU 132           HG3      GLU 132  19.025   7.706  -3.337
 1119    H    LEU 133           H        LEU 133  15.271  11.327  -3.361
 1120    HA   LEU 133           HA       LEU 133  13.299  10.449  -5.322
 1121    HB2  LEU 133           HB2      LEU 133  13.045  12.632  -3.270
 1122    HB3  LEU 133           HB3      LEU 133  11.761  11.936  -4.229
 1123    HG   LEU 133           HG       LEU 133  13.251  10.668  -1.950
 1124   HD11  LEU 133          HD11      LEU 133  10.352  11.290  -2.480
 1125   HD12  LEU 133          HD12      LEU 133  10.967  10.445  -1.057
 1126   HD13  LEU 133          HD13      LEU 133  11.420  12.124  -1.351
 1127   HD21  LEU 133          HD21      LEU 133  13.033   9.000  -3.729
 1128   HD22  LEU 133          HD22      LEU 133  11.968   8.633  -2.371
 1129   HD23  LEU 133          HD23      LEU 133  11.307   9.344  -3.843
 1130    H    MET 134           H        MET 134  11.956  12.611  -5.910
 1131    HA   MET 134           HA       MET 134  13.825  14.465  -7.264
 1132    HB2  MET 134           HB2      MET 134  12.091  14.609  -9.054
 1133    HB3  MET 134           HB3      MET 134  12.771  12.992  -8.896
 1134    HG2  MET 134           HG2      MET 134  10.546  12.496  -9.032
 1135    HG3  MET 134           HG3      MET 134  10.754  12.621  -7.287
 1136    HE1  MET 134           HE1      MET 134   8.545  13.278  -6.305
 1137    HE2  MET 134           HE2      MET 134   7.329  14.225  -7.164
 1138    HE3  MET 134           HE3      MET 134   7.897  12.698  -7.839
 1139    H    GLU 135           H        GLU 135  11.684  14.077  -4.890
 1140    HA   GLU 135           HA       GLU 135   9.674  15.798  -4.844
 1141    HB2  GLU 135           HB2      GLU 135  11.518  14.732  -2.888
 1142    HB3  GLU 135           HB3      GLU 135  10.726  16.224  -2.380
 1143    HG2  GLU 135           HG2      GLU 135   9.004  14.238  -3.671
 1144    HG3  GLU 135           HG3      GLU 135   9.663  13.800  -2.109
 1145    H    GLU 136           H        GLU 136   9.297  17.857  -5.095
 1146    HA   GLU 136           HA       GLU 136  11.205  19.890  -5.370
 1147    HB2  GLU 136           HB2      GLU 136   9.337  21.433  -5.218
 1148    HB3  GLU 136           HB3      GLU 136   8.831  20.024  -6.144
 1149    HG2  GLU 136           HG2      GLU 136   7.756  19.116  -4.111
 1150    HG3  GLU 136           HG3      GLU 136   8.222  20.577  -3.251
 1151    H    LYS 137           H        LYS 137   9.611  18.522  -2.617
 1152    HA   LYS 137           HA       LYS 137  10.409  20.678  -0.844
 1153    HB2  LYS 137           HB2      LYS 137   8.895  18.120  -0.278
 1154    HB3  LYS 137           HB3      LYS 137   9.136  19.438   0.861
 1155    HG2  LYS 137           HG2      LYS 137   7.840  20.927  -0.540
 1156    HG3  LYS 137           HG3      LYS 137   7.663  19.659  -1.752
 1157    HD2  LYS 137           HD2      LYS 137   6.394  18.305  -0.205
 1158    HD3  LYS 137           HD3      LYS 137   6.643  19.492   1.078
 1159    HE2  LYS 137           HE2      LYS 137   4.425  19.735   0.117
 1160    HE3  LYS 137           HE3      LYS 137   5.412  21.152  -0.228
 1161    HZ1  LYS 137           HZ1      LYS 137   5.007  18.929  -2.151
 1162    HZ2  LYS 137           HZ2      LYS 137   5.725  20.436  -2.455
 1163    HZ3  LYS 137           HZ3      LYS 137   4.067  20.341  -2.128
 1164    H    LYS 138           H        LYS 138  10.641  17.132  -0.605
 1165    HA   LYS 138           HA       LYS 138  12.773  17.257   1.258
 1166    HB2  LYS 138           HB2      LYS 138  11.847  14.923  -0.430
 1167    HB3  LYS 138           HB3      LYS 138  12.928  14.819   0.954
 1168    HG2  LYS 138           HG2      LYS 138  11.094  15.782   2.347
 1169    HG3  LYS 138           HG3      LYS 138  10.048  15.625   0.934
 1170    HD2  LYS 138           HD2      LYS 138  11.577  13.261   1.944
 1171    HD3  LYS 138           HD3      LYS 138  10.075  13.742   2.732
 1172    HE2  LYS 138           HE2      LYS 138  10.343  13.175  -0.217
 1173    HE3  LYS 138           HE3      LYS 138   9.804  11.992   0.975
 1174    HZ1  LYS 138           HZ1      LYS 138   7.998  13.596   1.555
 1175    HZ2  LYS 138           HZ2      LYS 138   7.887  12.945  -0.007
 1176    HZ3  LYS 138           HZ3      LYS 138   8.454  14.528   0.208
 1177    H    ASP 169           H        ASP 169  12.837  15.699  -1.928
 1178    HA   ASP 169           HA       ASP 169  14.575  15.131  -3.264
 1179    HB2  ASP 169           HB2      ASP 169  14.355  17.600  -3.735
 1180    HB3  ASP 169           HB3      ASP 169  15.626  17.884  -2.552
 1181    H    GLU 170           H        GLU 170  14.677  14.326  -0.643
 1182    HA   GLU 170           HA       GLU 170  17.395  14.684   0.333
 1183    HB2  GLU 170           HB2      GLU 170  14.953  14.573   1.579
 1184    HB3  GLU 170           HB3      GLU 170  15.523  12.924   1.778
 1185    HG2  GLU 170           HG2      GLU 170  17.163  15.310   2.558
 1186    HG3  GLU 170           HG3      GLU 170  16.018  14.532   3.649
 1187    H    LEU 171           H        LEU 171  18.413  12.627   1.232
 1188    HA   LEU 171           HA       LEU 171  18.474  10.565  -0.763
 1189    HB2  LEU 171           HB2      LEU 171  19.676  10.574   2.008
 1190    HB3  LEU 171           HB3      LEU 171  20.072   9.462   0.711
 1191    HG   LEU 171           HG       LEU 171  20.657  12.403   0.818
 1192   HD11  LEU 171          HD11      LEU 171  22.449   9.981   0.756
 1193   HD12  LEU 171          HD12      LEU 171  22.992  11.658   0.717
 1194   HD13  LEU 171          HD13      LEU 171  22.165  11.032   2.142
 1195   HD21  LEU 171          HD21      LEU 171  19.996  11.784  -1.437
 1196   HD22  LEU 171          HD22      LEU 171  21.737  12.073  -1.371
 1197   HD23  LEU 171          HD23      LEU 171  21.119  10.419  -1.406
 1198    H    ASN 172           H        ASN 172  16.867  11.180   2.211
 1199    HA   ASN 172           HA       ASN 172  15.367  10.024   3.457
 1200    HB2  ASN 172           HB2      ASN 172  14.724   8.912   0.726
 1201    HB3  ASN 172           HB3      ASN 172  13.725   8.658   2.139
 1202   HD21  ASN 172          HD21      ASN 172  14.491  10.670  -0.428
 1203   HD22  ASN 172          HD22      ASN 172  13.467  12.004  -0.017
 1204    H    TRP 173           H        TRP 173  17.197   8.859   4.522
 1205    HA   TRP 173           HA       TRP 173  17.677   6.154   3.587
 1206    HB2  TRP 173           HB2      TRP 173  18.788   7.888   5.784
 1207    HB3  TRP 173           HB3      TRP 173  19.047   6.147   5.806
 1208    HD1  TRP 173           HD1      TRP 173  19.890   9.257   3.680
 1209    HE1  TRP 173           HE1      TRP 173  22.030   8.762   2.358
 1210    HE3  TRP 173           HE3      TRP 173  20.494   4.340   4.933
 1211    HZ2  TRP 173           HZ2      TRP 173  23.759   6.573   1.901
 1212    HZ3  TRP 173           HZ3      TRP 173  22.421   3.118   4.013
 1213    HH2  TRP 173           HH2      TRP 173  24.018   4.213   2.529
 1214    H    LEU 174           H        LEU 174  15.931   4.909   3.958
 1215    HA   LEU 174           HA       LEU 174  14.038   5.442   5.996
 1216    HB2  LEU 174           HB2      LEU 174  14.424   2.948   4.351
 1217    HB3  LEU 174           HB3      LEU 174  13.035   3.290   5.360
 1218    HG   LEU 174           HG       LEU 174  13.824   4.591   2.773
 1219   HD11  LEU 174          HD11      LEU 174  11.454   3.979   2.254
 1220   HD12  LEU 174          HD12      LEU 174  12.518   2.607   2.560
 1221   HD13  LEU 174          HD13      LEU 174  11.395   3.146   3.810
 1222   HD21  LEU 174          HD21      LEU 174  11.795   5.588   4.775
 1223   HD22  LEU 174          HD22      LEU 174  13.262   6.423   4.263
 1224   HD23  LEU 174          HD23      LEU 174  11.946   6.164   3.113
 1225    H    ASP 175           H        ASP 175  13.890   4.812   7.962
 1226    HA   ASP 175           HA       ASP 175  16.039   3.357   9.236
 1227    HB2  ASP 175           HB2      ASP 175  15.067   4.080  11.280
 1228    HB3  ASP 175           HB3      ASP 175  14.831   5.419  10.158
 1229    H    HIS 176           H        HIS 176  13.366   2.423   7.626
 1230    HA   HIS 176           HA       HIS 176  12.264   0.465   7.401
 1231    HB2  HIS 176           HB2      HIS 176  14.102  -0.409   9.610
 1232    HB3  HIS 176           HB3      HIS 176  12.803  -1.451   9.038
 1233    HD1  HIS 176           HD1      HIS 176  12.988  -2.292   6.560
 1234    HD2  HIS 176           HD2      HIS 176  16.336  -0.319   8.002
 1235    HE1  HIS 176           HE1      HIS 176  14.798  -2.747   4.891
 1236    HE2  HIS 176           HE2      HIS 176  16.886  -1.850   5.991
 1237    H    GLY 177           H        GLY 177  11.494   2.716   9.207
 1238    HA2  GLY 177           HA2      GLY 177   9.460   1.202  10.733
 1239    HA3  GLY 177           HA3      GLY 177  10.288   2.585  11.437
 1240    H    ARG 178           H        ARG 178  10.335   4.221   9.172
 1241    HA   ARG 178           HA       ARG 178   7.818   5.459   9.252
 1242    HB2  ARG 178           HB2      ARG 178   9.918   6.609   8.678
 1243    HB3  ARG 178           HB3      ARG 178  10.007   5.692   7.181
 1244    HG2  ARG 178           HG2      ARG 178   9.182   7.818   6.614
 1245    HG3  ARG 178           HG3      ARG 178   7.804   6.715   6.550
 1246    HD2  ARG 178           HD2      ARG 178   7.255   8.849   7.646
 1247    HD3  ARG 178           HD3      ARG 178   7.067   7.475   8.736
 1248    HE   ARG 178           HE       ARG 178   9.595   8.926   8.797
 1249   HH11  ARG 178          HH11      ARG 178   6.520   8.206  10.329
 1250   HH12  ARG 178          HH12      ARG 178   6.991   8.894  11.861
 1251   HH21  ARG 178          HH21      ARG 178  10.203   9.825  10.794
 1252   HH22  ARG 178          HH22      ARG 178   9.076   9.828  12.121
 1253    H    THR 179           H        THR 179   6.043   5.359   7.926
 1254    HA   THR 179           HA       THR 179   5.844   3.095   6.136
 1255    HB   THR 179           HB       THR 179   3.539   3.414   6.156
 1256    HG1  THR 179           HG1      THR 179   2.760   5.643   6.897
 1257   HG21  THR 179          HG21      THR 179   4.475   4.751   8.691
 1258   HG22  THR 179          HG22      THR 179   4.281   3.014   8.438
 1259   HG23  THR 179          HG23      THR 179   2.867   4.069   8.431
 1260    H    LEU 180           H        LEU 180   5.093   3.368   3.874
 1261    HA   LEU 180           HA       LEU 180   6.888   5.137   2.556
 1262    HB2  LEU 180           HB2      LEU 180   4.615   3.631   1.277
 1263    HB3  LEU 180           HB3      LEU 180   6.106   4.167   0.523
 1264    HG   LEU 180           HG       LEU 180   5.749   1.940   2.514
 1265   HD11  LEU 180          HD11      LEU 180   6.832   2.010  -0.297
 1266   HD12  LEU 180          HD12      LEU 180   6.748   0.587   0.740
 1267   HD13  LEU 180          HD13      LEU 180   5.265   1.374   0.201
 1268   HD21  LEU 180          HD21      LEU 180   8.345   3.057   1.462
 1269   HD22  LEU 180          HD22      LEU 180   7.728   3.281   3.101
 1270   HD23  LEU 180          HD23      LEU 180   8.149   1.665   2.529
 1271    H    ARG 181           H        ARG 181   3.399   5.017   2.870
 1272    HA   ARG 181           HA       ARG 181   2.680   7.299   1.450
 1273    HB2  ARG 181           HB2      ARG 181   1.303   5.429   2.577
 1274    HB3  ARG 181           HB3      ARG 181   1.398   6.423   4.018
 1275    HG2  ARG 181           HG2      ARG 181   0.329   8.268   2.716
 1276    HG3  ARG 181           HG3      ARG 181   0.080   7.105   1.405
 1277    HD2  ARG 181           HD2      ARG 181  -1.173   7.237   4.100
 1278    HD3  ARG 181           HD3      ARG 181  -1.904   6.861   2.534
 1279    HE   ARG 181           HE       ARG 181  -0.537   4.697   2.727
 1280   HH11  ARG 181          HH11      ARG 181  -2.113   6.326   5.397
 1281   HH12  ARG 181          HH12      ARG 181  -2.033   4.947   6.452
 1282   HH21  ARG 181          HH21      ARG 181  -0.359   2.920   4.134
 1283   HH22  ARG 181          HH22      ARG 181  -1.020   3.006   5.741
 1284    H    GLU 182           H        GLU 182   3.971   6.862   4.656
 1285    HA   GLU 182           HA       GLU 182   3.381   9.489   5.631
 1286    HB2  GLU 182           HB2      GLU 182   3.859   7.176   6.860
 1287    HB3  GLU 182           HB3      GLU 182   5.508   7.778   6.839
 1288    HG2  GLU 182           HG2      GLU 182   4.892   9.698   8.107
 1289    HG3  GLU 182           HG3      GLU 182   3.186   9.292   7.955
 1290    H    GLN 183           H        GLN 183   6.048   7.854   4.110
 1291    HA   GLN 183           HA       GLN 183   8.037   9.828   4.453
 1292    HB2  GLN 183           HB2      GLN 183   7.649   7.681   2.365
 1293    HB3  GLN 183           HB3      GLN 183   9.081   8.698   2.446
 1294    HG2  GLN 183           HG2      GLN 183   9.813   7.742   4.408
 1295    HG3  GLN 183           HG3      GLN 183   8.209   7.162   4.846
 1296   HE21  GLN 183          HE21      GLN 183   8.972   5.093   5.225
 1297   HE22  GLN 183          HE22      GLN 183   9.436   4.029   3.946
 1298    H    GLY 184           H        GLY 184   5.322   9.545   2.324
 1299    HA2  GLY 184           HA2      GLY 184   4.456  11.012   0.781
 1300    HA3  GLY 184           HA3      GLY 184   5.648  12.189   1.319
 1301    H    VAL 185           H        VAL 185   6.513   9.021   0.172
 1302    HA   VAL 185           HA       VAL 185   8.017  10.188  -2.020
 1303    HB   VAL 185           HB       VAL 185   8.946   7.950  -2.299
 1304   HG11  VAL 185          HG11      VAL 185  10.035   7.728  -0.126
 1305   HG12  VAL 185          HG12      VAL 185   9.907   9.424  -0.591
 1306   HG13  VAL 185          HG13      VAL 185   8.800   8.752   0.609
 1307   HG21  VAL 185          HG21      VAL 185   6.935   6.648  -1.838
 1308   HG22  VAL 185          HG22      VAL 185   8.268   6.114  -0.815
 1309   HG23  VAL 185          HG23      VAL 185   6.994   7.132  -0.143
 1310    H    GLU 186           H        GLU 186   7.876   9.374  -4.205
 1311    HA   GLU 186           HA       GLU 186   5.162   8.583  -4.953
 1312    HB2  GLU 186           HB2      GLU 186   7.483   9.696  -6.537
 1313    HB3  GLU 186           HB3      GLU 186   6.019   9.087  -7.289
 1314    HG2  GLU 186           HG2      GLU 186   6.069  11.304  -5.268
 1315    HG3  GLU 186           HG3      GLU 186   6.098  11.548  -7.011
 1316    H    GLU 187           H        GLU 187   5.568   7.329  -7.310
 1317    HA   GLU 187           HA       GLU 187   6.738   4.791  -6.420
 1318    HB2  GLU 187           HB2      GLU 187   4.746   5.480  -8.571
 1319    HB3  GLU 187           HB3      GLU 187   5.359   3.856  -8.294
 1320    HG2  GLU 187           HG2      GLU 187   4.297   3.692  -6.213
 1321    HG3  GLU 187           HG3      GLU 187   4.017   5.428  -6.120
 1322    H    HIS 188           H        HIS 188   7.222   7.342  -8.649
 1323    HA   HIS 188           HA       HIS 188   8.728   5.712 -10.534
 1324    HB2  HIS 188           HB2      HIS 188   8.954   7.881 -11.795
 1325    HB3  HIS 188           HB3      HIS 188   7.305   7.314 -11.569
 1326    HD1  HIS 188           HD1      HIS 188   5.705   8.855 -10.420
 1327    HD2  HIS 188           HD2      HIS 188   9.647  10.125 -10.078
 1328    HE1  HIS 188           HE1      HIS 188   5.603  11.142  -9.372
 1329    HE2  HIS 188           HE2      HIS 188   7.976  11.984  -9.448
 1330    H    GLU 189           H        GLU 189   9.456   7.208  -7.691
 1331    HA   GLU 189           HA       GLU 189  11.974   8.387  -8.514
 1332    HB2  GLU 189           HB2      GLU 189  10.818   8.062  -5.739
 1333    HB3  GLU 189           HB3      GLU 189  12.163   9.101  -6.200
 1334    HG2  GLU 189           HG2      GLU 189  10.677  10.444  -7.576
 1335    HG3  GLU 189           HG3      GLU 189   9.328   9.386  -7.175
 1336    H    THR 190           H        THR 190  14.007   7.557  -8.082
 1337    HA   THR 190           HA       THR 190  14.071   4.701  -7.831
 1338    HB   THR 190           HB       THR 190  16.364   6.648  -8.142
 1339    HG1  THR 190           HG1      THR 190  14.837   6.604  -9.914
 1340   HG21  THR 190          HG21      THR 190  17.092   4.487  -7.235
 1341   HG22  THR 190          HG22      THR 190  17.643   4.696  -8.897
 1342   HG23  THR 190          HG23      THR 190  16.263   3.653  -8.549
 1343    H    LEU 191           H        LEU 191  14.412   3.546  -6.111
 1344    HA   LEU 191           HA       LEU 191  15.509   4.836  -3.691
 1345    HB2  LEU 191           HB2      LEU 191  13.827   2.329  -3.694
 1346    HB3  LEU 191           HB3      LEU 191  14.251   3.335  -2.328
 1347    HG   LEU 191           HG       LEU 191  12.075   3.926  -2.563
 1348   HD11  LEU 191          HD11      LEU 191  13.325   5.761  -4.589
 1349   HD12  LEU 191          HD12      LEU 191  11.805   6.035  -3.738
 1350   HD13  LEU 191          HD13      LEU 191  13.322   5.983  -2.839
 1351   HD21  LEU 191          HD21      LEU 191  11.598   2.426  -4.399
 1352   HD22  LEU 191          HD22      LEU 191  10.826   3.991  -4.659
 1353   HD23  LEU 191          HD23      LEU 191  12.296   3.573  -5.542
 1354    H    LEU 192           H        LEU 192  17.191   3.679  -2.580
 1355    HA   LEU 192           HA       LEU 192  18.340   1.543  -4.253
 1356    HB2  LEU 192           HB2      LEU 192  20.034   3.224  -2.476
 1357    HB3  LEU 192           HB3      LEU 192  20.433   2.460  -4.003
 1358    HG   LEU 192           HG       LEU 192  18.628   4.866  -3.787
 1359   HD11  LEU 192          HD11      LEU 192  21.570   4.774  -4.403
 1360   HD12  LEU 192          HD12      LEU 192  20.531   6.200  -4.475
 1361   HD13  LEU 192          HD13      LEU 192  20.841   5.412  -2.928
 1362   HD21  LEU 192          HD21      LEU 192  18.372   3.535  -5.822
 1363   HD22  LEU 192          HD22      LEU 192  19.097   5.108  -6.161
 1364   HD23  LEU 192          HD23      LEU 192  20.106   3.661  -6.122
 1365    H    LEU 193           H        LEU 193  18.922  -0.316  -3.265
 1366    HA   LEU 193           HA       LEU 193  18.443  -0.610  -0.427
 1367    HB2  LEU 193           HB2      LEU 193  17.728  -2.306  -2.093
 1368    HB3  LEU 193           HB3      LEU 193  19.407  -2.601  -2.491
 1369    HG   LEU 193           HG       LEU 193  18.557  -2.976   0.344
 1370   HD11  LEU 193          HD11      LEU 193  18.022  -4.954  -1.871
 1371   HD12  LEU 193          HD12      LEU 193  17.833  -5.255  -0.143
 1372   HD13  LEU 193          HD13      LEU 193  16.795  -4.080  -0.952
 1373   HD21  LEU 193          HD21      LEU 193  20.217  -4.740   0.256
 1374   HD22  LEU 193          HD22      LEU 193  20.419  -4.497  -1.479
 1375   HD23  LEU 193          HD23      LEU 193  20.906  -3.233  -0.348
 1376    H    ARG 194           H        ARG 194  19.984  -0.489   1.101
 1377    HA   ARG 194           HA       ARG 194  22.807  -0.438   0.232
 1378    HB2  ARG 194           HB2      ARG 194  21.410   1.258   2.306
 1379    HB3  ARG 194           HB3      ARG 194  23.156   1.158   2.154
 1380    HG2  ARG 194           HG2      ARG 194  21.290   2.120   0.003
 1381    HG3  ARG 194           HG3      ARG 194  22.206   3.156   1.097
 1382    HD2  ARG 194           HD2      ARG 194  23.274   1.277  -0.994
 1383    HD3  ARG 194           HD3      ARG 194  23.402   3.038  -0.952
 1384    HE   ARG 194           HE       ARG 194  24.608   1.852   1.349
 1385   HH11  ARG 194          HH11      ARG 194  25.101   2.486  -2.064
 1386   HH12  ARG 194          HH12      ARG 194  26.840   2.469  -1.944
 1387   HH21  ARG 194          HH21      ARG 194  26.873   1.808   1.509
 1388   HH22  ARG 194          HH22      ARG 194  27.853   2.084   0.098
 1389    H    ARG 195           H        ARG 195  24.312  -1.419   1.606
 1390    HA   ARG 195           HA       ARG 195  23.174  -3.258   3.527
 1391    HB2  ARG 195           HB2      ARG 195  25.440  -4.132   3.792
 1392    HB3  ARG 195           HB3      ARG 195  24.983  -4.051   2.099
 1393    HG2  ARG 195           HG2      ARG 195  26.658  -2.672   1.605
 1394    HG3  ARG 195           HG3      ARG 195  26.351  -1.654   3.014
 1395    HD2  ARG 195           HD2      ARG 195  27.782  -4.308   3.087
 1396    HD3  ARG 195           HD3      ARG 195  28.583  -2.738   3.044
 1397    HE   ARG 195           HE       ARG 195  27.147  -3.924   5.296
 1398   HH11  ARG 195          HH11      ARG 195  28.660  -1.093   3.891
 1399   HH12  ARG 195          HH12      ARG 195  29.014  -0.347   5.421
 1400   HH21  ARG 195          HH21      ARG 195  27.656  -2.945   7.345
 1401   HH22  ARG 195          HH22      ARG 195  28.442  -1.396   7.378
 1402    H    LYS 196           H        LYS 196  23.091  -3.032   5.621
 1403    HA   LYS 196           HA       LYS 196  24.383  -0.721   6.872
 1404    HB2  LYS 196           HB2      LYS 196  21.922  -1.073   7.198
 1405    HB3  LYS 196           HB3      LYS 196  22.286  -2.584   8.019
 1406    HG2  LYS 196           HG2      LYS 196  23.408  -1.423   9.789
 1407    HG3  LYS 196           HG3      LYS 196  23.266   0.111   8.929
 1408    HD2  LYS 196           HD2      LYS 196  20.795  -0.097   9.074
 1409    HD3  LYS 196           HD3      LYS 196  21.011  -1.550  10.054
 1410    HE2  LYS 196           HE2      LYS 196  22.142  -0.289  11.763
 1411    HE3  LYS 196           HE3      LYS 196  22.124   1.161  10.760
 1412    HZ1  LYS 196           HZ1      LYS 196  19.799  -0.187  12.024
 1413    HZ2  LYS 196           HZ2      LYS 196  19.646   1.035  10.858
 1414    HZ3  LYS 196           HZ3      LYS 196  20.397   1.368  12.333
 1415    H    PHE 197           H        PHE 197  24.236  -4.200   6.820
 1416    HA   PHE 197           HA       PHE 197  26.764  -4.272   8.327
 1417    HB2  PHE 197           HB2      PHE 197  24.824  -6.581   8.408
 1418    HB3  PHE 197           HB3      PHE 197  26.187  -6.259   9.469
 1419    HD1  PHE 197           HD1      PHE 197  25.928  -3.904  10.739
 1420    HD2  PHE 197           HD2      PHE 197  22.736  -6.339   9.341
 1421    HE1  PHE 197           HE1      PHE 197  24.438  -2.870  12.389
 1422    HE2  PHE 197           HE2      PHE 197  21.222  -5.303  10.984
 1423    HZ   PHE 197           HZ       PHE 197  22.003  -3.653  12.501
 1424    H    PHE 198           H        PHE 198  27.880  -6.531   7.727
 1425    HA   PHE 198           HA       PHE 198  27.072  -7.401   5.064
 1426    HB2  PHE 198           HB2      PHE 198  29.470  -7.292   4.277
 1427    HB3  PHE 198           HB3      PHE 198  28.644  -5.752   4.448
 1428    HD1  PHE 198           HD1      PHE 198  31.121  -7.991   6.059
 1429    HD2  PHE 198           HD2      PHE 198  29.484  -4.072   5.820
 1430    HE1  PHE 198           HE1      PHE 198  32.966  -7.140   7.447
 1431    HE2  PHE 198           HE2      PHE 198  31.324  -3.212   7.198
 1432    HZ   PHE 198           HZ       PHE 198  33.070  -4.746   8.019
 1433    H    TYR 199           H        TYR 199  26.887  -8.685   7.606
 1434    HA   TYR 199           HA       TYR 199  28.953 -10.637   7.798
 1435    HB2  TYR 199           HB2      TYR 199  27.455 -11.828   9.342
 1436    HB3  TYR 199           HB3      TYR 199  27.587 -10.125   9.751
 1437    HD1  TYR 199           HD1      TYR 199  25.370 -12.752   8.467
 1438    HD2  TYR 199           HD2      TYR 199  25.663  -8.658   9.596
 1439    HE1  TYR 199           HE1      TYR 199  22.917 -12.576   8.452
 1440    HE2  TYR 199           HE2      TYR 199  23.216  -8.476   9.588
 1441    HH   TYR 199           HH       TYR 199  21.168 -11.221   9.380
 1442    H    SER 200           H        SER 200  25.904 -10.397   6.123
 1443    HA   SER 200           HA       SER 200  24.922 -11.613   4.510
 1444    HB2  SER 200           HB2      SER 200  27.798 -12.234   3.834
 1445    HB3  SER 200           HB3      SER 200  26.424 -12.462   2.749
 1446    HG   SER 200           HG       SER 200  26.222 -10.006   3.656
 1447    H    ASP 201           H        ASP 201  24.324 -12.896   6.498
 1448    HA   ASP 201           HA       ASP 201  23.412 -14.857   7.127
 1449    HB2  ASP 201           HB2      ASP 201  23.338 -15.439   4.732
 1450    HB3  ASP 201           HB3      ASP 201  24.964 -16.086   4.855
 1451    H    GLN 202           H        GLN 202  26.714 -14.229   7.046
 1452    HA   GLN 202           HA       GLN 202  27.278 -16.417   8.920
 1453    HB2  GLN 202           HB2      GLN 202  29.118 -14.571   7.393
 1454    HB3  GLN 202           HB3      GLN 202  29.677 -15.673   8.641
 1455    HG2  GLN 202           HG2      GLN 202  28.306 -16.447   6.080
 1456    HG3  GLN 202           HG3      GLN 202  30.026 -16.597   6.434
 1457   HE21  GLN 202          HE21      GLN 202  30.715 -18.164   7.905
 1458   HE22  GLN 202          HE22      GLN 202  29.715 -19.509   8.343
  Start of MODEL   19
    1    H1   GLY  -5           H1       GLY  -5 -29.688 -10.730  -2.561
    2    H2   GLY  -5           H2       GLY  -5 -30.562  -9.282  -2.500
    3    H3   GLY  -5           H3       GLY  -5 -30.484 -10.165  -3.947
    4    HA2  GLY  -5           HA2      GLY  -5 -32.620 -10.518  -2.965
    5    HA3  GLY  -5           HA3      GLY  -5 -31.683 -12.004  -2.896
    6    H    ILE  -4           H        ILE  -4 -33.701 -10.089  -1.184
    7    HA   ILE  -4           HA       ILE  -4 -34.189  -9.710   1.004
    8    HB   ILE  -4           HB       ILE  -4 -32.708 -12.288   1.582
    9   HG12  ILE  -4          HG12      ILE  -4 -35.585 -11.940   0.695
   10   HG13  ILE  -4          HG13      ILE  -4 -34.290 -12.584  -0.309
   11   HG21  ILE  -4          HG21      ILE  -4 -34.331 -12.501   3.405
   12   HG22  ILE  -4          HG22      ILE  -4 -33.408 -11.005   3.545
   13   HG23  ILE  -4          HG23      ILE  -4 -35.062 -10.966   2.938
   14   HD11  ILE  -4          HD11      ILE  -4 -34.036 -14.463   1.226
   15   HD12  ILE  -4          HD12      ILE  -4 -35.336 -13.818   2.228
   16   HD13  ILE  -4          HD13      ILE  -4 -35.677 -14.359   0.585
   17    H    ASP  -3           H        ASP  -3 -32.368  -8.073   0.414
   18    HA   ASP  -3           HA       ASP  -3 -29.851  -8.577   1.784
   19    HB2  ASP  -3           HB2      ASP  -3 -30.747  -6.248   0.067
   20    HB3  ASP  -3           HB3      ASP  -3 -29.126  -6.458   0.721
   21    HA   PRO  -2           HA       PRO  -2 -31.093  -6.139   5.256
   22    HB2  PRO  -2           HB2      PRO  -2 -28.752  -6.036   6.559
   23    HB3  PRO  -2           HB3      PRO  -2 -29.643  -7.554   6.392
   24    HG2  PRO  -2           HG2      PRO  -2 -27.258  -6.578   4.885
   25    HG3  PRO  -2           HG3      PRO  -2 -27.638  -8.215   5.451
   26    HD2  PRO  -2           HD2      PRO  -2 -28.019  -7.286   2.863
   27    HD3  PRO  -2           HD3      PRO  -2 -28.824  -8.699   3.571
   28    H    PHE  -1           H        PHE  -1 -30.584  -4.721   2.887
   29    HA   PHE  -1           HA       PHE  -1 -29.048  -2.398   3.802
   30    HB2  PHE  -1           HB2      PHE  -1 -29.758  -3.298   1.005
   31    HB3  PHE  -1           HB3      PHE  -1 -28.996  -1.760   1.379
   32    HD1  PHE  -1           HD1      PHE  -1 -26.774  -1.865   2.682
   33    HD2  PHE  -1           HD2      PHE  -1 -28.460  -5.157   0.592
   34    HE1  PHE  -1           HE1      PHE  -1 -24.559  -2.933   2.589
   35    HE2  PHE  -1           HE2      PHE  -1 -26.250  -6.236   0.493
   36    HZ   PHE  -1           HZ       PHE  -1 -24.296  -5.122   1.494
   37    H    THR   0           H        THR   0 -30.992  -1.967   5.088
   38    HA   THR   0           HA       THR   0 -33.236  -0.893   3.596
   39    HB   THR   0           HB       THR   0 -34.179  -0.475   5.913
   40    HG1  THR   0           HG1      THR   0 -32.935  -2.078   7.412
   41   HG21  THR   0          HG21      THR   0 -33.441  -3.311   5.171
   42   HG22  THR   0          HG22      THR   0 -34.833  -2.412   4.565
   43   HG23  THR   0          HG23      THR   0 -34.735  -2.838   6.273
   44    H    MET   1           H        MET   1 -32.385   0.526   6.559
   45    HA   MET   1           HA       MET   1 -31.371   2.910   5.185
   46    HB2  MET   1           HB2      MET   1 -33.597   3.225   6.310
   47    HB3  MET   1           HB3      MET   1 -32.817   2.862   7.839
   48    HG2  MET   1           HG2      MET   1 -33.090   5.234   7.613
   49    HG3  MET   1           HG3      MET   1 -31.377   4.832   7.555
   50    HE1  MET   1           HE1      MET   1 -30.257   5.782   4.038
   51    HE2  MET   1           HE2      MET   1 -29.799   5.649   5.736
   52    HE3  MET   1           HE3      MET   1 -30.356   4.225   4.860
   53    H    VAL   2           H        VAL   2 -30.111   0.553   6.117
   54    HA   VAL   2           HA       VAL   2 -28.052   1.785   7.793
   55    HB   VAL   2           HB       VAL   2 -27.571  -0.452   8.797
   56   HG11  VAL   2          HG11      VAL   2 -30.325   0.650   9.334
   57   HG12  VAL   2          HG12      VAL   2 -29.417  -0.412  10.410
   58   HG13  VAL   2          HG13      VAL   2 -28.815   1.208  10.057
   59   HG21  VAL   2          HG21      VAL   2 -29.285  -2.189   8.720
   60   HG22  VAL   2          HG22      VAL   2 -30.220  -1.220   7.579
   61   HG23  VAL   2          HG23      VAL   2 -28.638  -1.848   7.114
   62    H    ALA   3           H        ALA   3 -27.634   2.176   5.367
   63    HA   ALA   3           HA       ALA   3 -25.618   0.214   4.595
   64    HB1  ALA   3           HB1      ALA   3 -26.316   0.518   2.182
   65    HB2  ALA   3           HB2      ALA   3 -27.404  -0.452   3.187
   66    HB3  ALA   3           HB3      ALA   3 -27.814   1.220   2.797
   67    H    LEU   4           H        LEU   4 -23.935   1.056   3.455
   68    HA   LEU   4           HA       LEU   4 -23.665   3.978   3.702
   69    HB2  LEU   4           HB2      LEU   4 -21.793   1.699   4.127
   70    HB3  LEU   4           HB3      LEU   4 -21.127   3.182   3.478
   71    HG   LEU   4           HG       LEU   4 -21.739   4.409   5.444
   72   HD11  LEU   4          HD11      LEU   4 -22.886   3.443   7.321
   73   HD12  LEU   4          HD12      LEU   4 -23.897   3.371   5.879
   74   HD13  LEU   4          HD13      LEU   4 -23.076   1.918   6.452
   75   HD21  LEU   4          HD21      LEU   4 -20.577   1.743   6.211
   76   HD22  LEU   4          HD22      LEU   4 -19.681   3.113   5.553
   77   HD23  LEU   4          HD23      LEU   4 -20.444   3.239   7.137
   78    H    SER   5           H        SER   5 -23.380   5.091   1.888
   79    HA   SER   5           HA       SER   5 -23.165   3.597  -0.616
   80    HB2  SER   5           HB2      SER   5 -23.766   6.532  -0.154
   81    HB3  SER   5           HB3      SER   5 -23.784   5.717  -1.711
   82    HG   SER   5           HG       SER   5 -25.607   5.616   0.380
   83    H    LEU   6           H        LEU   6 -21.101   3.113  -1.047
   84    HA   LEU   6           HA       LEU   6 -19.067   5.115  -0.334
   85    HB2  LEU   6           HB2      LEU   6 -18.740   2.131  -0.669
   86    HB3  LEU   6           HB3      LEU   6 -17.501   3.259  -0.137
   87    HG   LEU   6           HG       LEU   6 -20.020   2.537   1.367
   88   HD11  LEU   6          HD11      LEU   6 -18.509   1.524   2.972
   89   HD12  LEU   6          HD12      LEU   6 -18.310   0.788   1.382
   90   HD13  LEU   6          HD13      LEU   6 -17.125   1.956   1.967
   91   HD21  LEU   6          HD21      LEU   6 -17.783   4.416   2.102
   92   HD22  LEU   6          HD22      LEU   6 -19.449   4.862   1.733
   93   HD23  LEU   6          HD23      LEU   6 -19.090   3.908   3.172
   94    H    LYS   7           H        LYS   7 -17.762   5.900  -1.840
   95    HA   LYS   7           HA       LYS   7 -18.084   5.009  -4.589
   96    HB2  LYS   7           HB2      LYS   7 -16.643   7.316  -3.302
   97    HB3  LYS   7           HB3      LYS   7 -16.407   6.909  -4.995
   98    HG2  LYS   7           HG2      LYS   7 -18.753   7.281  -5.443
   99    HG3  LYS   7           HG3      LYS   7 -19.046   7.606  -3.730
  100    HD2  LYS   7           HD2      LYS   7 -17.748   9.579  -3.786
  101    HD3  LYS   7           HD3      LYS   7 -17.073   9.174  -5.365
  102    HE2  LYS   7           HE2      LYS   7 -19.199   9.521  -6.421
  103    HE3  LYS   7           HE3      LYS   7 -19.986   9.752  -4.859
  104    HZ1  LYS   7           HZ1      LYS   7 -18.681  11.746  -4.519
  105    HZ2  LYS   7           HZ2      LYS   7 -19.537  11.861  -5.980
  106    HZ3  LYS   7           HZ3      LYS   7 -17.875  11.510  -5.993
  107    H    ILE   8           H        ILE   8 -16.993   3.163  -4.976
  108    HA   ILE   8           HA       ILE   8 -14.341   2.806  -3.840
  109    HB   ILE   8           HB       ILE   8 -16.213   0.989  -5.325
  110   HG12  ILE   8          HG12      ILE   8 -15.678  -0.523  -3.416
  111   HG13  ILE   8          HG13      ILE   8 -14.631   0.725  -2.757
  112   HG21  ILE   8          HG21      ILE   8 -13.274   0.448  -4.916
  113   HG22  ILE   8          HG22      ILE   8 -14.466  -0.714  -5.496
  114   HG23  ILE   8          HG23      ILE   8 -14.078   0.708  -6.464
  115   HD11  ILE   8          HD11      ILE   8 -17.604   0.938  -3.147
  116   HD12  ILE   8          HD12      ILE   8 -16.760   0.682  -1.618
  117   HD13  ILE   8          HD13      ILE   8 -16.554   2.198  -2.495
  118    H    SER   9           H        SER   9 -12.801   3.896  -4.823
  119    HA   SER   9           HA       SER   9 -12.905   4.243  -7.712
  120    HB2  SER   9           HB2      SER   9 -10.850   5.711  -7.225
  121    HB3  SER   9           HB3      SER   9 -12.406   6.272  -6.617
  122    HG   SER   9           HG       SER   9 -10.369   6.148  -5.186
  123    H    ILE  10           H        ILE  10 -11.902   2.866  -8.992
  124    HA   ILE  10           HA       ILE  10  -9.625   1.347  -7.901
  125    HB   ILE  10           HB       ILE  10 -11.440   0.522 -10.178
  126   HG12  ILE  10          HG12      ILE  10 -11.370  -0.526  -7.337
  127   HG13  ILE  10          HG13      ILE  10 -12.581   0.595  -7.950
  128   HG21  ILE  10          HG21      ILE  10  -9.309  -0.992  -8.668
  129   HG22  ILE  10          HG22      ILE  10 -10.359  -1.668  -9.913
  130   HG23  ILE  10          HG23      ILE  10  -9.195  -0.410 -10.329
  131   HD11  ILE  10          HD11      ILE  10 -13.432  -1.672  -7.890
  132   HD12  ILE  10          HD12      ILE  10 -13.322  -1.091  -9.552
  133   HD13  ILE  10          HD13      ILE  10 -12.111  -2.211  -8.928
  134    H    GLY  11           H        GLY  11  -8.009   2.736  -8.479
  135    HA2  GLY  11           HA2      GLY  11  -6.424   3.644  -9.886
  136    HA3  GLY  11           HA3      GLY  11  -7.224   2.836 -11.230
  137    H    ASN  12           H        ASN  12  -8.839   3.896 -12.369
  138    HA   ASN  12           HA       ASN  12  -9.079   6.780 -11.805
  139    HB2  ASN  12           HB2      ASN  12  -9.283   7.152 -14.215
  140    HB3  ASN  12           HB3      ASN  12  -7.769   6.336 -13.842
  141   HD21  ASN  12          HD21      ASN  12  -9.494   6.465 -16.282
  142   HD22  ASN  12          HD22      ASN  12  -9.747   4.805 -16.725
  143    H    VAL  13           H        VAL  13 -10.744   3.853 -12.115
  144    HA   VAL  13           HA       VAL  13 -13.217   5.063 -13.058
  145    HB   VAL  13           HB       VAL  13 -12.509   2.819 -13.879
  146   HG11  VAL  13          HG11      VAL  13 -13.109   1.926 -11.067
  147   HG12  VAL  13          HG12      VAL  13 -12.806   0.863 -12.442
  148   HG13  VAL  13          HG13      VAL  13 -11.530   1.929 -11.854
  149   HG21  VAL  13          HG21      VAL  13 -14.698   1.744 -13.687
  150   HG22  VAL  13          HG22      VAL  13 -15.127   2.859 -12.389
  151   HG23  VAL  13          HG23      VAL  13 -14.840   3.472 -14.018
  152    H    VAL  14           H        VAL  14 -15.176   5.013 -11.847
  153    HA   VAL  14           HA       VAL  14 -14.765   4.771  -8.946
  154    HB   VAL  14           HB       VAL  14 -14.924   7.133  -9.402
  155   HG11  VAL  14          HG11      VAL  14 -17.537   6.561 -10.785
  156   HG12  VAL  14          HG12      VAL  14 -16.861   8.158 -10.463
  157   HG13  VAL  14          HG13      VAL  14 -16.036   7.058 -11.567
  158   HG21  VAL  14          HG21      VAL  14 -17.492   6.059  -8.240
  159   HG22  VAL  14          HG22      VAL  14 -15.994   6.387  -7.368
  160   HG23  VAL  14          HG23      VAL  14 -16.922   7.720  -8.062
  161    H    LYS  15           H        LYS  15 -15.858   3.145  -8.205
  162    HA   LYS  15           HA       LYS  15 -18.340   2.328  -9.554
  163    HB2  LYS  15           HB2      LYS  15 -16.486   0.779  -7.733
  164    HB3  LYS  15           HB3      LYS  15 -17.960   0.143  -8.447
  165    HG2  LYS  15           HG2      LYS  15 -15.629   1.161 -10.054
  166    HG3  LYS  15           HG3      LYS  15 -15.855  -0.528  -9.603
  167    HD2  LYS  15           HD2      LYS  15 -17.990  -0.565 -10.794
  168    HD3  LYS  15           HD3      LYS  15 -17.780   1.131 -11.231
  169    HE2  LYS  15           HE2      LYS  15 -15.783   0.573 -12.503
  170    HE3  LYS  15           HE3      LYS  15 -15.932  -1.118 -12.024
  171    HZ1  LYS  15           HZ1      LYS  15 -18.017   0.335 -13.557
  172    HZ2  LYS  15           HZ2      LYS  15 -17.917  -1.334 -13.277
  173    HZ3  LYS  15           HZ3      LYS  15 -16.786  -0.577 -14.288
  174    H    THR  16           H        THR  16 -20.221   2.433  -8.475
  175    HA   THR  16           HA       THR  16 -20.082   3.463  -5.727
  176    HB   THR  16           HB       THR  16 -22.456   3.503  -7.597
  177    HG1  THR  16           HG1      THR  16 -20.260   4.816  -7.924
  178   HG21  THR  16          HG21      THR  16 -23.021   3.728  -5.223
  179   HG22  THR  16          HG22      THR  16 -23.279   5.249  -6.077
  180   HG23  THR  16          HG23      THR  16 -21.851   5.037  -5.062
  181    H    MET  17           H        MET  17 -20.369   2.008  -4.180
  182    HA   MET  17           HA       MET  17 -22.394  -0.076  -4.541
  183    HB2  MET  17           HB2      MET  17 -19.515  -0.467  -3.828
  184    HB3  MET  17           HB3      MET  17 -20.712  -1.472  -3.030
  185    HG2  MET  17           HG2      MET  17 -21.523  -2.133  -5.310
  186    HG3  MET  17           HG3      MET  17 -20.111  -1.305  -5.965
  187    HE1  MET  17           HE1      MET  17 -19.724  -4.803  -2.970
  188    HE2  MET  17           HE2      MET  17 -20.463  -3.234  -2.632
  189    HE3  MET  17           HE3      MET  17 -21.292  -4.397  -3.672
  190    H    GLN  18           H        GLN  18 -23.389  -0.726  -2.620
  191    HA   GLN  18           HA       GLN  18 -22.784   1.013  -0.346
  192    HB2  GLN  18           HB2      GLN  18 -25.362  -0.260  -1.222
  193    HB3  GLN  18           HB3      GLN  18 -25.140   0.418   0.392
  194    HG2  GLN  18           HG2      GLN  18 -24.897   2.562  -0.387
  195    HG3  GLN  18           HG3      GLN  18 -24.456   2.034  -2.011
  196   HE21  GLN  18          HE21      GLN  18 -25.915   3.073  -3.172
  197   HE22  GLN  18          HE22      GLN  18 -27.619   2.848  -3.046
  198    H    PHE  19           H        PHE  19 -22.505   0.171   1.661
  199    HA   PHE  19           HA       PHE  19 -22.330  -2.745   1.877
  200    HB2  PHE  19           HB2      PHE  19 -20.306  -0.679   2.801
  201    HB3  PHE  19           HB3      PHE  19 -20.283  -2.366   3.292
  202    HD1  PHE  19           HD1      PHE  19 -19.961  -0.093   0.413
  203    HD2  PHE  19           HD2      PHE  19 -19.301  -4.014   1.921
  204    HE1  PHE  19           HE1      PHE  19 -18.599  -0.625  -1.570
  205    HE2  PHE  19           HE2      PHE  19 -17.940  -4.554  -0.056
  206    HZ   PHE  19           HZ       PHE  19 -17.555  -2.888  -1.775
  207    H    GLU  20           H        GLU  20 -22.517  -3.416   4.150
  208    HA   GLU  20           HA       GLU  20 -24.384  -1.831   5.611
  209    HB2  GLU  20           HB2      GLU  20 -22.788  -4.249   6.489
  210    HB3  GLU  20           HB3      GLU  20 -24.188  -3.577   7.319
  211    HG2  GLU  20           HG2      GLU  20 -25.627  -4.139   5.485
  212    HG3  GLU  20           HG3      GLU  20 -24.247  -4.644   4.509
  213    HA   PRO  21           HA       PRO  21 -21.854   0.976   7.901
  214    HB2  PRO  21           HB2      PRO  21 -23.033   0.054  10.410
  215    HB3  PRO  21           HB3      PRO  21 -23.147   1.631   9.635
  216    HG2  PRO  21           HG2      PRO  21 -25.111  -0.419   9.695
  217    HG3  PRO  21           HG3      PRO  21 -25.190   1.140   8.859
  218    HD2  PRO  21           HD2      PRO  21 -25.020  -1.412   7.680
  219    HD3  PRO  21           HD3      PRO  21 -24.857   0.158   6.869
  220    H    SER  22           H        SER  22 -22.283  -2.250   9.317
  221    HA   SER  22           HA       SER  22 -19.682  -2.221  10.514
  222    HB2  SER  22           HB2      SER  22 -20.210  -4.742  10.745
  223    HB3  SER  22           HB3      SER  22 -21.230  -3.603  11.625
  224    HG   SER  22           HG       SER  22 -22.641  -4.929  10.620
  225    H    THR  23           H        THR  23 -21.011  -4.452   8.086
  226    HA   THR  23           HA       THR  23 -20.030  -5.813   6.594
  227    HB   THR  23           HB       THR  23 -18.651  -3.227   5.879
  228    HG1  THR  23           HG1      THR  23 -20.949  -4.567   4.836
  229   HG21  THR  23          HG21      THR  23 -18.300  -4.250   3.683
  230   HG22  THR  23          HG22      THR  23 -18.953  -5.770   4.294
  231   HG23  THR  23          HG23      THR  23 -17.445  -5.133   4.948
  232    H    MET  24           H        MET  24 -17.280  -3.730   7.389
  233    HA   MET  24           HA       MET  24 -15.230  -4.158   8.261
  234    HB2  MET  24           HB2      MET  24 -16.587  -6.276   9.298
  235    HB3  MET  24           HB3      MET  24 -15.394  -7.094   8.300
  236    HG2  MET  24           HG2      MET  24 -13.626  -6.305   9.518
  237    HG3  MET  24           HG3      MET  24 -14.538  -4.926  10.148
  238    HE1  MET  24           HE1      MET  24 -14.286  -5.031  12.660
  239    HE2  MET  24           HE2      MET  24 -14.018  -6.546  13.529
  240    HE3  MET  24           HE3      MET  24 -12.922  -6.071  12.230
  241    H    VAL  25           H        VAL  25 -13.351  -4.378   7.272
  242    HA   VAL  25           HA       VAL  25 -13.148  -4.264   4.595
  243    HB   VAL  25           HB       VAL  25 -11.058  -5.262   6.514
  244   HG11  VAL  25          HG11      VAL  25 -10.701  -4.421   3.635
  245   HG12  VAL  25          HG12      VAL  25  -9.402  -4.756   4.779
  246   HG13  VAL  25          HG13      VAL  25 -10.484  -6.053   4.270
  247   HG21  VAL  25          HG21      VAL  25 -10.217  -2.979   6.280
  248   HG22  VAL  25          HG22      VAL  25 -11.553  -2.603   5.191
  249   HG23  VAL  25          HG23      VAL  25 -11.877  -3.003   6.877
  250    H    TYR  26           H        TYR  26 -12.707  -7.296   6.430
  251    HA   TYR  26           HA       TYR  26 -12.003  -8.807   4.169
  252    HB2  TYR  26           HB2      TYR  26 -12.356 -10.806   5.537
  253    HB3  TYR  26           HB3      TYR  26 -11.410  -9.589   6.376
  254    HD1  TYR  26           HD1      TYR  26 -14.581 -11.403   6.284
  255    HD2  TYR  26           HD2      TYR  26 -12.300  -8.468   8.353
  256    HE1  TYR  26           HE1      TYR  26 -16.090 -11.594   8.210
  257    HE2  TYR  26           HE2      TYR  26 -13.807  -8.654  10.279
  258    HH   TYR  26           HH       TYR  26 -15.889 -11.159  10.754
  259    H    ASP  27           H        ASP  27 -15.122  -8.093   5.590
  260    HA   ASP  27           HA       ASP  27 -16.562  -9.916   3.885
  261    HB2  ASP  27           HB2      ASP  27 -17.439  -9.278   6.099
  262    HB3  ASP  27           HB3      ASP  27 -17.578  -7.610   5.561
  263    H    ALA  28           H        ALA  28 -15.843  -6.449   3.916
  264    HA   ALA  28           HA       ALA  28 -17.309  -5.710   1.657
  265    HB1  ALA  28           HB1      ALA  28 -16.239  -4.109   3.175
  266    HB2  ALA  28           HB2      ALA  28 -14.657  -4.606   2.577
  267    HB3  ALA  28           HB3      ALA  28 -15.798  -3.810   1.494
  268    H    CYS  29           H        CYS  29 -13.940  -6.775   1.907
  269    HA   CYS  29           HA       CYS  29 -13.213  -6.565  -0.757
  270    HB2  CYS  29           HB2      CYS  29 -11.589  -6.928   1.005
  271    HB3  CYS  29           HB3      CYS  29 -12.258  -8.520   1.339
  272    HG   CYS  29           HG       CYS  29 -10.654  -7.632  -1.560
  273    H    ARG  30           H        ARG  30 -15.047  -9.118   0.814
  274    HA   ARG  30           HA       ARG  30 -14.609 -11.000  -1.307
  275    HB2  ARG  30           HB2      ARG  30 -16.143 -12.459  -0.173
  276    HB3  ARG  30           HB3      ARG  30 -15.097 -11.713   1.022
  277    HG2  ARG  30           HG2      ARG  30 -16.930 -10.102   1.536
  278    HG3  ARG  30           HG3      ARG  30 -17.955 -11.000   0.416
  279    HD2  ARG  30           HD2      ARG  30 -18.350 -11.664   2.737
  280    HD3  ARG  30           HD3      ARG  30 -17.744 -13.000   1.764
  281    HE   ARG  30           HE       ARG  30 -15.488 -12.089   2.860
  282   HH11  ARG  30          HH11      ARG  30 -18.607 -12.645   4.341
  283   HH12  ARG  30          HH12      ARG  30 -17.930 -13.165   5.852
  284   HH21  ARG  30          HH21      ARG  30 -14.597 -12.812   4.805
  285   HH22  ARG  30          HH22      ARG  30 -15.645 -13.289   6.116
  286    H    MET  31           H        MET  31 -17.161  -8.734  -0.444
  287    HA   MET  31           HA       MET  31 -18.952  -9.634  -2.480
  288    HB2  MET  31           HB2      MET  31 -18.963  -7.065  -0.896
  289    HB3  MET  31           HB3      MET  31 -20.289  -7.691  -1.863
  290    HG2  MET  31           HG2      MET  31 -20.463  -9.626  -0.415
  291    HG3  MET  31           HG3      MET  31 -19.112  -9.039   0.547
  292    HE1  MET  31           HE1      MET  31 -20.453  -5.877   2.235
  293    HE2  MET  31           HE2      MET  31 -19.096  -6.988   1.989
  294    HE3  MET  31           HE3      MET  31 -19.619  -5.920   0.678
  295    H    ILE  32           H        ILE  32 -16.741  -6.876  -2.149
  296    HA   ILE  32           HA       ILE  32 -17.586  -5.493  -4.427
  297    HB   ILE  32           HB       ILE  32 -16.161  -4.447  -2.754
  298   HG12  ILE  32          HG12      ILE  32 -14.865  -4.527  -5.483
  299   HG13  ILE  32          HG13      ILE  32 -16.246  -3.531  -5.036
  300   HG21  ILE  32          HG21      ILE  32 -13.753  -4.895  -2.668
  301   HG22  ILE  32          HG22      ILE  32 -14.704  -6.305  -2.202
  302   HG23  ILE  32          HG23      ILE  32 -13.968  -6.228  -3.804
  303   HD11  ILE  32          HD11      ILE  32 -14.186  -2.254  -5.056
  304   HD12  ILE  32          HD12      ILE  32 -14.872  -2.337  -3.433
  305   HD13  ILE  32          HD13      ILE  32 -13.490  -3.347  -3.859
  306    H    ARG  33           H        ARG  33 -14.983  -7.883  -4.097
  307    HA   ARG  33           HA       ARG  33 -14.214  -7.985  -6.781
  308    HB2  ARG  33           HB2      ARG  33 -14.163 -10.103  -4.635
  309    HB3  ARG  33           HB3      ARG  33 -13.447 -10.331  -6.225
  310    HG2  ARG  33           HG2      ARG  33 -11.977  -8.408  -5.827
  311    HG3  ARG  33           HG3      ARG  33 -12.679  -8.221  -4.219
  312    HD2  ARG  33           HD2      ARG  33 -11.332 -10.739  -5.169
  313    HD3  ARG  33           HD3      ARG  33 -10.489  -9.452  -4.311
  314    HE   ARG  33           HE       ARG  33 -11.984  -9.892  -2.417
  315   HH11  ARG  33          HH11      ARG  33 -11.804 -12.336  -4.912
  316   HH12  ARG  33          HH12      ARG  33 -12.154 -13.654  -3.829
  317   HH21  ARG  33          HH21      ARG  33 -12.430 -11.621  -0.974
  318   HH22  ARG  33          HH22      ARG  33 -12.501 -13.249  -1.590
  319    H    GLU  34           H        GLU  34 -16.992  -9.272  -5.208
  320    HA   GLU  34           HA       GLU  34 -17.602 -11.235  -7.214
  321    HB2  GLU  34           HB2      GLU  34 -19.112 -10.117  -4.872
  322    HB3  GLU  34           HB3      GLU  34 -19.878 -11.190  -6.027
  323    HG2  GLU  34           HG2      GLU  34 -17.472 -11.810  -4.340
  324    HG3  GLU  34           HG3      GLU  34 -19.105 -12.437  -4.115
  325    H    ARG  35           H        ARG  35 -18.677  -7.963  -6.443
  326    HA   ARG  35           HA       ARG  35 -20.572  -7.912  -8.630
  327    HB2  ARG  35           HB2      ARG  35 -19.698  -5.352  -7.429
  328    HB3  ARG  35           HB3      ARG  35 -21.317  -5.931  -7.778
  329    HG2  ARG  35           HG2      ARG  35 -19.682  -6.948  -5.476
  330    HG3  ARG  35           HG3      ARG  35 -20.745  -5.549  -5.357
  331    HD2  ARG  35           HD2      ARG  35 -21.614  -8.326  -6.154
  332    HD3  ARG  35           HD3      ARG  35 -21.774  -7.625  -4.541
  333    HE   ARG  35           HE       ARG  35 -23.062  -6.327  -6.852
  334   HH11  ARG  35          HH11      ARG  35 -23.319  -8.021  -3.785
  335   HH12  ARG  35          HH12      ARG  35 -24.977  -7.572  -3.533
  336   HH21  ARG  35          HH21      ARG  35 -25.245  -5.733  -6.505
  337   HH22  ARG  35          HH22      ARG  35 -26.068  -6.272  -5.068
  338    H    ILE  36           H        ILE  36 -17.499  -6.335  -7.843
  339    HA   ILE  36           HA       ILE  36 -17.363  -5.231 -10.563
  340    HB   ILE  36           HB       ILE  36 -15.666  -4.434  -8.201
  341   HG12  ILE  36          HG12      ILE  36 -18.205  -3.073  -9.115
  342   HG13  ILE  36          HG13      ILE  36 -18.143  -4.189  -7.755
  343   HG21  ILE  36          HG21      ILE  36 -15.387  -2.355  -9.475
  344   HG22  ILE  36          HG22      ILE  36 -14.829  -3.760 -10.386
  345   HG23  ILE  36          HG23      ILE  36 -16.385  -3.021 -10.767
  346   HD11  ILE  36          HD11      ILE  36 -16.565  -2.711  -6.622
  347   HD12  ILE  36          HD12      ILE  36 -16.643  -1.592  -7.983
  348   HD13  ILE  36          HD13      ILE  36 -18.079  -1.889  -7.002
  349    HA   PRO  37           HA       PRO  37 -14.117  -8.358 -11.087
  350    HB2  PRO  37           HB2      PRO  37 -13.832  -7.982 -13.768
  351    HB3  PRO  37           HB3      PRO  37 -15.092  -8.995 -13.057
  352    HG2  PRO  37           HG2      PRO  37 -15.266  -6.201 -14.096
  353    HG3  PRO  37           HG3      PRO  37 -16.426  -7.532 -14.247
  354    HD2  PRO  37           HD2      PRO  37 -16.708  -5.502 -12.455
  355    HD3  PRO  37           HD3      PRO  37 -17.340  -7.137 -12.180
  356    H    GLU  38           H        GLU  38 -14.130  -4.979 -11.884
  357    HA   GLU  38           HA       GLU  38 -11.448  -4.713 -12.731
  358    HB2  GLU  38           HB2      GLU  38 -13.378  -2.744 -11.504
  359    HB3  GLU  38           HB3      GLU  38 -11.755  -2.288 -11.994
  360    HG2  GLU  38           HG2      GLU  38 -13.349  -1.676 -13.691
  361    HG3  GLU  38           HG3      GLU  38 -12.272  -2.932 -14.295
  362    H    ALA  39           H        ALA  39 -12.941  -4.912  -9.615
  363    HA   ALA  39           HA       ALA  39 -10.954  -3.707  -8.043
  364    HB1  ALA  39           HB1      ALA  39 -12.016  -4.849  -6.172
  365    HB2  ALA  39           HB2      ALA  39 -13.231  -4.174  -7.258
  366    HB3  ALA  39           HB3      ALA  39 -12.882  -5.903  -7.289
  367    H    LEU  40           H        LEU  40 -11.347  -6.969  -9.233
  368    HA   LEU  40           HA       LEU  40  -9.047  -7.914  -7.688
  369    HB2  LEU  40           HB2      LEU  40  -9.824 -10.130  -8.378
  370    HB3  LEU  40           HB3      LEU  40 -11.081  -9.211  -7.559
  371    HG   LEU  40           HG       LEU  40 -11.371  -8.617 -10.276
  372   HD11  LEU  40          HD11      LEU  40  -9.968 -10.457 -10.843
  373   HD12  LEU  40          HD12      LEU  40 -10.920 -11.545  -9.828
  374   HD13  LEU  40          HD13      LEU  40 -11.642 -10.831 -11.273
  375   HD21  LEU  40          HD21      LEU  40 -13.487  -9.798 -10.021
  376   HD22  LEU  40          HD22      LEU  40 -12.915 -10.487  -8.500
  377   HD23  LEU  40          HD23      LEU  40 -13.141  -8.742  -8.649
  378    H    ALA  41           H        ALA  41  -8.716  -6.170 -10.019
  379    HA   ALA  41           HA       ALA  41  -8.036  -7.500 -12.352
  380    HB1  ALA  41           HB1      ALA  41  -8.173  -5.062 -12.160
  381    HB2  ALA  41           HB2      ALA  41  -6.685  -5.055 -11.213
  382    HB3  ALA  41           HB3      ALA  41  -6.655  -5.573 -12.899
  383    H    GLY  42           H        GLY  42  -6.382  -7.487  -9.334
  384    HA2  GLY  42           HA2      GLY  42  -4.216  -9.076 -10.564
  385    HA3  GLY  42           HA3      GLY  42  -3.925  -7.979  -9.216
  386    HA   PRO  43           HA       PRO  43  -4.759 -12.072  -7.284
  387    HB2  PRO  43           HB2      PRO  43  -2.826 -11.209  -5.280
  388    HB3  PRO  43           HB3      PRO  43  -2.771 -12.619  -6.340
  389    HG2  PRO  43           HG2      PRO  43  -1.093 -10.501  -6.610
  390    HG3  PRO  43           HG3      PRO  43  -1.605 -11.511  -7.973
  391    HD2  PRO  43           HD2      PRO  43  -2.596  -8.815  -7.132
  392    HD3  PRO  43           HD3      PRO  43  -2.293  -9.447  -8.764
  393    HA   PRO  44           HA       PRO  44  -7.749  -9.867  -4.742
  394    HB2  PRO  44           HB2      PRO  44  -8.716 -12.206  -3.569
  395    HB3  PRO  44           HB3      PRO  44  -9.327 -11.464  -5.049
  396    HG2  PRO  44           HG2      PRO  44  -7.432 -13.738  -4.708
  397    HG3  PRO  44           HG3      PRO  44  -8.691 -13.494  -5.932
  398    HD2  PRO  44           HD2      PRO  44  -6.096 -13.128  -6.501
  399    HD3  PRO  44           HD3      PRO  44  -7.355 -12.095  -7.209
  400    H    ASN  45           H        ASN  45  -5.471 -12.265  -3.588
  401    HA   ASN  45           HA       ASN  45  -5.830 -11.779  -0.810
  402    HB2  ASN  45           HB2      ASN  45  -3.466 -12.938  -2.306
  403    HB3  ASN  45           HB3      ASN  45  -3.654 -12.958  -0.556
  404   HD21  ASN  45          HD21      ASN  45  -4.620 -14.358  -3.555
  405   HD22  ASN  45          HD22      ASN  45  -5.571 -15.643  -2.893
  406    H    ASP  46           H        ASP  46  -4.129 -10.188  -3.331
  407    HA   ASP  46           HA       ASP  46  -2.531  -8.632  -1.423
  408    HB2  ASP  46           HB2      ASP  46  -2.261  -8.988  -4.416
  409    HB3  ASP  46           HB3      ASP  46  -1.259  -7.905  -3.452
  410    H    PHE  47           H        PHE  47  -5.447  -8.290  -2.106
  411    HA   PHE  47           HA       PHE  47  -5.249  -5.450  -2.856
  412    HB2  PHE  47           HB2      PHE  47  -7.214  -7.535  -3.660
  413    HB3  PHE  47           HB3      PHE  47  -7.822  -5.906  -3.391
  414    HD1  PHE  47           HD1      PHE  47  -7.092  -4.054  -4.827
  415    HD2  PHE  47           HD2      PHE  47  -5.816  -8.052  -5.516
  416    HE1  PHE  47           HE1      PHE  47  -6.363  -3.432  -7.087
  417    HE2  PHE  47           HE2      PHE  47  -5.078  -7.433  -7.778
  418    HZ   PHE  47           HZ       PHE  47  -5.377  -5.065  -8.560
  419    H    GLY  48           H        GLY  48  -6.069  -3.984  -1.460
  420    HA2  GLY  48           HA2      GLY  48  -7.849  -4.958   0.674
  421    HA3  GLY  48           HA3      GLY  48  -6.403  -4.048   1.089
  422    H    LEU  49           H        LEU  49  -8.322  -2.823   2.114
  423    HA   LEU  49           HA       LEU  49  -9.619  -1.043   0.185
  424    HB2  LEU  49           HB2      LEU  49 -10.178  -1.469   3.120
  425    HB3  LEU  49           HB3      LEU  49 -11.092  -0.424   2.052
  426    HG   LEU  49           HG       LEU  49 -10.907  -3.431   1.862
  427   HD11  LEU  49          HD11      LEU  49 -13.282  -3.356   2.444
  428   HD12  LEU  49          HD12      LEU  49 -12.276  -2.667   3.718
  429   HD13  LEU  49          HD13      LEU  49 -13.176  -1.605   2.636
  430   HD21  LEU  49          HD21      LEU  49 -12.471  -1.468   0.192
  431   HD22  LEU  49          HD22      LEU  49 -11.081  -2.411  -0.347
  432   HD23  LEU  49          HD23      LEU  49 -12.582  -3.226   0.097
  433    H    PHE  50           H        PHE  50  -8.460   0.691  -0.240
  434    HA   PHE  50           HA       PHE  50  -7.061   2.085   1.926
  435    HB2  PHE  50           HB2      PHE  50  -5.814   1.725  -0.168
  436    HB3  PHE  50           HB3      PHE  50  -7.042   2.622  -1.055
  437    HD1  PHE  50           HD1      PHE  50  -4.264   2.873   1.322
  438    HD2  PHE  50           HD2      PHE  50  -7.146   5.021  -0.955
  439    HE1  PHE  50           HE1      PHE  50  -3.045   4.965   1.758
  440    HE2  PHE  50           HE2      PHE  50  -5.932   7.116  -0.523
  441    HZ   PHE  50           HZ       PHE  50  -3.883   7.092   0.836
  442    H    LEU  51           H        LEU  51  -7.919   3.813   2.881
  443    HA   LEU  51           HA       LEU  51 -10.400   4.888   1.777
  444    HB2  LEU  51           HB2      LEU  51 -10.019   4.155   4.249
  445    HB3  LEU  51           HB3      LEU  51  -9.201   5.697   4.410
  446    HG   LEU  51           HG       LEU  51 -11.619   5.646   5.144
  447   HD11  LEU  51          HD11      LEU  51 -12.187   7.807   4.161
  448   HD12  LEU  51          HD12      LEU  51 -10.499   7.756   4.676
  449   HD13  LEU  51          HD13      LEU  51 -10.904   7.602   2.965
  450   HD21  LEU  51          HD21      LEU  51 -13.325   5.786   3.398
  451   HD22  LEU  51          HD22      LEU  51 -12.094   5.470   2.174
  452   HD23  LEU  51          HD23      LEU  51 -12.488   4.234   3.368
  453    H    SER  52           H        SER  52 -10.230   6.546   0.465
  454    HA   SER  52           HA       SER  52  -7.862   8.236   0.550
  455    HB2  SER  52           HB2      SER  52 -10.163   8.204  -1.421
  456    HB3  SER  52           HB3      SER  52  -8.658   9.107  -1.600
  457    HG   SER  52           HG       SER  52  -8.393   6.390  -1.125
  458    H    ASP  53           H        ASP  53  -8.007   9.713   2.115
  459    HA   ASP  53           HA       ASP  53 -10.535  10.957   2.778
  460    HB2  ASP  53           HB2      ASP  53  -8.898  10.364   4.551
  461    HB3  ASP  53           HB3      ASP  53  -7.763  11.516   3.860
  462    H    ASP  54           H        ASP  54  -7.359  12.012   1.571
  463    HA   ASP  54           HA       ASP  54  -8.276  14.105  -0.044
  464    HB2  ASP  54           HB2      ASP  54  -9.109  15.207   1.920
  465    HB3  ASP  54           HB3      ASP  54  -7.619  14.899   2.801
  466    H    ASP  55           H        ASP  55  -5.773  13.490   2.382
  467    HA   ASP  55           HA       ASP  55  -3.718  14.289   0.429
  468    HB2  ASP  55           HB2      ASP  55  -3.747  15.832   2.272
  469    HB3  ASP  55           HB3      ASP  55  -3.812  14.525   3.445
  470    HA   PRO  56           HA       PRO  56  -1.965  10.228   0.278
  471    HB2  PRO  56           HB2      PRO  56   0.701  11.012   0.839
  472    HB3  PRO  56           HB3      PRO  56  -0.034  10.754  -0.744
  473    HG2  PRO  56           HG2      PRO  56   0.393  13.279   0.758
  474    HG3  PRO  56           HG3      PRO  56   0.383  12.996  -0.992
  475    HD2  PRO  56           HD2      PRO  56  -1.662  14.213   0.218
  476    HD3  PRO  56           HD3      PRO  56  -1.939  13.067  -1.111
  477    H    LYS  57           H        LYS  57  -1.169  12.266   3.081
  478    HA   LYS  57           HA       LYS  57  -0.322   9.915   4.587
  479    HB2  LYS  57           HB2      LYS  57  -0.653  12.744   5.597
  480    HB3  LYS  57           HB3      LYS  57   0.203  11.420   6.388
  481    HG2  LYS  57           HG2      LYS  57   1.028  12.550   3.730
  482    HG3  LYS  57           HG3      LYS  57   1.648  13.135   5.272
  483    HD2  LYS  57           HD2      LYS  57   1.860  10.317   4.226
  484    HD3  LYS  57           HD3      LYS  57   3.162  11.507   4.267
  485    HE2  LYS  57           HE2      LYS  57   1.725  10.324   6.639
  486    HE3  LYS  57           HE3      LYS  57   3.374   9.977   6.129
  487    HZ1  LYS  57           HZ1      LYS  57   3.873  12.366   6.504
  488    HZ2  LYS  57           HZ2      LYS  57   3.466  11.521   7.912
  489    HZ3  LYS  57           HZ3      LYS  57   2.334  12.547   7.185
  490    H    LYS  58           H        LYS  58  -3.095  12.022   4.278
  491    HA   LYS  58           HA       LYS  58  -4.451  11.181   6.631
  492    HB2  LYS  58           HB2      LYS  58  -5.559  12.284   4.043
  493    HB3  LYS  58           HB3      LYS  58  -6.452  12.136   5.549
  494    HG2  LYS  58           HG2      LYS  58  -5.049  13.768   6.607
  495    HG3  LYS  58           HG3      LYS  58  -3.989  13.828   5.194
  496    HD2  LYS  58           HD2      LYS  58  -5.852  14.645   3.840
  497    HD3  LYS  58           HD3      LYS  58  -6.901  14.601   5.255
  498    HE2  LYS  58           HE2      LYS  58  -5.500  16.266   6.351
  499    HE3  LYS  58           HE3      LYS  58  -4.423  16.291   4.955
  500    HZ1  LYS  58           HZ1      LYS  58  -5.980  18.135   4.894
  501    HZ2  LYS  58           HZ2      LYS  58  -7.293  17.063   4.941
  502    HZ3  LYS  58           HZ3      LYS  58  -6.262  17.081   3.594
  503    H    GLY  59           H        GLY  59  -4.219  10.016   3.353
  504    HA2  GLY  59           HA2      GLY  59  -6.289   8.103   3.419
  505    HA3  GLY  59           HA3      GLY  59  -4.878   8.054   2.369
  506    H    ILE  60           H        ILE  60  -6.250   5.893   3.864
  507    HA   ILE  60           HA       ILE  60  -3.955   4.892   5.357
  508    HB   ILE  60           HB       ILE  60  -5.475   4.099   7.205
  509   HG12  ILE  60          HG12      ILE  60  -7.336   6.222   6.116
  510   HG13  ILE  60          HG13      ILE  60  -7.593   4.490   5.937
  511   HG21  ILE  60          HG21      ILE  60  -5.399   6.216   8.425
  512   HG22  ILE  60          HG22      ILE  60  -3.910   5.932   7.522
  513   HG23  ILE  60          HG23      ILE  60  -5.107   7.076   6.913
  514   HD11  ILE  60          HD11      ILE  60  -8.933   5.411   7.740
  515   HD12  ILE  60          HD12      ILE  60  -7.747   4.259   8.356
  516   HD13  ILE  60          HD13      ILE  60  -7.473   5.992   8.541
  517    H    TRP  61           H        TRP  61  -4.055   2.626   5.779
  518    HA   TRP  61           HA       TRP  61  -5.694   1.182   3.843
  519    HB2  TRP  61           HB2      TRP  61  -3.293   0.389   5.489
  520    HB3  TRP  61           HB3      TRP  61  -4.249  -0.785   4.586
  521    HD1  TRP  61           HD1      TRP  61  -1.662   1.950   4.120
  522    HE1  TRP  61           HE1      TRP  61  -0.864   1.947   1.670
  523    HE3  TRP  61           HE3      TRP  61  -5.078  -1.313   2.180
  524    HZ2  TRP  61           HZ2      TRP  61  -1.598   0.711  -0.759
  525    HZ3  TRP  61           HZ3      TRP  61  -4.963  -1.854  -0.215
  526    HH2  TRP  61           HH2      TRP  61  -3.260  -0.861  -1.654
  527    H    LEU  62           H        LEU  62  -7.468   0.207   4.419
  528    HA   LEU  62           HA       LEU  62  -8.273   0.154   7.186
  529    HB2  LEU  62           HB2      LEU  62  -9.695  -0.926   4.751
  530    HB3  LEU  62           HB3      LEU  62 -10.408  -0.611   6.321
  531    HG   LEU  62           HG       LEU  62  -9.287   1.514   4.490
  532   HD11  LEU  62          HD11      LEU  62 -11.280   0.492   3.544
  533   HD12  LEU  62          HD12      LEU  62 -12.140   0.733   5.066
  534   HD13  LEU  62          HD13      LEU  62 -11.623   2.125   4.114
  535   HD21  LEU  62          HD21      LEU  62  -9.172   2.116   6.844
  536   HD22  LEU  62          HD22      LEU  62 -10.408   3.061   6.010
  537   HD23  LEU  62          HD23      LEU  62 -10.878   1.705   7.036
  538    H    GLU  63           H        GLU  63  -7.707  -1.464   8.503
  539    HA   GLU  63           HA       GLU  63  -6.847  -4.012   7.493
  540    HB2  GLU  63           HB2      GLU  63  -6.431  -4.531   9.843
  541    HB3  GLU  63           HB3      GLU  63  -5.790  -2.939   9.451
  542    HG2  GLU  63           HG2      GLU  63  -7.898  -1.963  10.388
  543    HG3  GLU  63           HG3      GLU  63  -8.314  -3.579  10.953
  544    H    ALA  64           H        ALA  64  -7.771  -6.055   8.225
  545    HA   ALA  64           HA       ALA  64 -10.630  -6.078   7.950
  546    HB1  ALA  64           HB1      ALA  64  -9.222  -7.832   6.979
  547    HB2  ALA  64           HB2      ALA  64  -8.740  -8.338   8.598
  548    HB3  ALA  64           HB3      ALA  64 -10.420  -8.501   8.087
  549    H    GLY  65           H        GLY  65  -8.789  -5.295  10.504
  550    HA2  GLY  65           HA2      GLY  65 -10.298  -6.785  12.512
  551    HA3  GLY  65           HA3      GLY  65  -8.866  -5.813  12.803
  552    H    LYS  66           H        LYS  66 -11.154  -4.222  10.842
  553    HA   LYS  66           HA       LYS  66 -12.710  -3.226  13.075
  554    HB2  LYS  66           HB2      LYS  66 -11.969  -1.087  13.166
  555    HB3  LYS  66           HB3      LYS  66 -10.480  -1.800  12.563
  556    HG2  LYS  66           HG2      LYS  66 -12.594  -0.595  10.795
  557    HG3  LYS  66           HG3      LYS  66 -11.212   0.299  11.423
  558    HD2  LYS  66           HD2      LYS  66  -9.822  -0.589   9.912
  559    HD3  LYS  66           HD3      LYS  66 -10.481  -2.212  10.130
  560    HE2  LYS  66           HE2      LYS  66 -10.798  -1.269   7.839
  561    HE3  LYS  66           HE3      LYS  66 -12.287  -1.760   8.639
  562    HZ1  LYS  66           HZ1      LYS  66 -11.300   1.030   8.580
  563    HZ2  LYS  66           HZ2      LYS  66 -12.817   0.485   9.108
  564    HZ3  LYS  66           HZ3      LYS  66 -12.407   0.401   7.467
  565    H    ALA  67           H        ALA  67 -14.479  -1.773  12.337
  566    HA   ALA  67           HA       ALA  67 -15.556  -2.837   9.850
  567    HB1  ALA  67           HB1      ALA  67 -16.860  -1.082  11.926
  568    HB2  ALA  67           HB2      ALA  67 -17.669  -1.932  10.608
  569    HB3  ALA  67           HB3      ALA  67 -16.901  -2.848  11.908
  570    H    LEU  68           H        LEU  68 -17.042  -1.076   8.679
  571    HA   LEU  68           HA       LEU  68 -15.135   0.797   7.594
  572    HB2  LEU  68           HB2      LEU  68 -18.037   0.331   6.917
  573    HB3  LEU  68           HB3      LEU  68 -16.936   1.345   6.011
  574    HG   LEU  68           HG       LEU  68 -16.640  -1.637   6.380
  575   HD11  LEU  68          HD11      LEU  68 -17.524  -0.031   3.986
  576   HD12  LEU  68          HD12      LEU  68 -17.239  -1.771   4.015
  577   HD13  LEU  68          HD13      LEU  68 -18.548  -1.077   4.972
  578   HD21  LEU  68          HD21      LEU  68 -15.101   0.320   4.682
  579   HD22  LEU  68          HD22      LEU  68 -14.504  -0.499   6.124
  580   HD23  LEU  68          HD23      LEU  68 -14.896  -1.431   4.679
  581    H    ASP  69           H        ASP  69 -18.365   1.095   9.017
  582    HA   ASP  69           HA       ASP  69 -18.398   3.923   9.092
  583    HB2  ASP  69           HB2      ASP  69 -20.480   2.820   9.052
  584    HB3  ASP  69           HB3      ASP  69 -20.062   1.780  10.406
  585    H    TYR  70           H        TYR  70 -16.997   1.587  11.168
  586    HA   TYR  70           HA       TYR  70 -16.867   2.914  13.595
  587    HB2  TYR  70           HB2      TYR  70 -16.013   0.773  13.695
  588    HB3  TYR  70           HB3      TYR  70 -15.141   0.923  12.176
  589    HD1  TYR  70           HD1      TYR  70 -15.074   1.927  15.755
  590    HD2  TYR  70           HD2      TYR  70 -12.879   1.482  12.142
  591    HE1  TYR  70           HE1      TYR  70 -12.982   2.335  16.981
  592    HE2  TYR  70           HE2      TYR  70 -10.785   1.882  13.348
  593    HH   TYR  70           HH       TYR  70 -10.574   1.827  16.737
  594    H    TYR  71           H        TYR  71 -14.958   3.338  10.664
  595    HA   TYR  71           HA       TYR  71 -13.368   5.457  11.797
  596    HB2  TYR  71           HB2      TYR  71 -13.554   4.150   9.129
  597    HB3  TYR  71           HB3      TYR  71 -12.819   5.745   9.240
  598    HD1  TYR  71           HD1      TYR  71 -10.928   6.023  10.977
  599    HD2  TYR  71           HD2      TYR  71 -12.275   2.259   9.531
  600    HE1  TYR  71           HE1      TYR  71  -8.808   4.988  11.691
  601    HE2  TYR  71           HE2      TYR  71 -10.161   1.216  10.233
  602    HH   TYR  71           HH       TYR  71  -8.068   2.573  12.365
  603    H    MET  72           H        MET  72 -13.443   7.027   9.326
  604    HA   MET  72           HA       MET  72 -15.561   8.828  10.153
  605    HB2  MET  72           HB2      MET  72 -13.408   9.194   8.060
  606    HB3  MET  72           HB3      MET  72 -14.431  10.454   8.733
  607    HG2  MET  72           HG2      MET  72 -13.384  10.265  10.865
  608    HG3  MET  72           HG3      MET  72 -12.495   8.830  10.358
  609    HE1  MET  72           HE1      MET  72 -10.471   8.854   8.658
  610    HE2  MET  72           HE2      MET  72 -11.538   9.568   7.449
  611    HE3  MET  72           HE3      MET  72  -9.960  10.289   7.769
  612    H    LEU  73           H        LEU  73 -15.584   6.280   8.113
  613    HA   LEU  73           HA       LEU  73 -16.731   7.735   5.854
  614    HB2  LEU  73           HB2      LEU  73 -16.457   5.466   4.672
  615    HB3  LEU  73           HB3      LEU  73 -15.051   6.479   4.930
  616    HG   LEU  73           HG       LEU  73 -15.640   4.433   6.999
  617   HD11  LEU  73          HD11      LEU  73 -15.987   3.207   4.905
  618   HD12  LEU  73          HD12      LEU  73 -14.427   3.782   4.315
  619   HD13  LEU  73          HD13      LEU  73 -14.500   2.708   5.713
  620   HD21  LEU  73          HD21      LEU  73 -13.185   4.342   6.990
  621   HD22  LEU  73          HD22      LEU  73 -13.171   5.511   5.666
  622   HD23  LEU  73          HD23      LEU  73 -13.803   5.977   7.244
  623    H    ARG  74           H        ARG  74 -18.613   7.576   5.218
  624    HA   ARG  74           HA       ARG  74 -20.361   5.365   5.856
  625    HB2  ARG  74           HB2      ARG  74 -21.007   8.221   6.657
  626    HB3  ARG  74           HB3      ARG  74 -22.128   6.867   6.730
  627    HG2  ARG  74           HG2      ARG  74 -21.433   6.444   8.769
  628    HG3  ARG  74           HG3      ARG  74 -19.842   6.062   8.112
  629    HD2  ARG  74           HD2      ARG  74 -19.451   8.605   8.194
  630    HD3  ARG  74           HD3      ARG  74 -20.830   8.621   9.299
  631    HE   ARG  74           HE       ARG  74 -18.559   6.847   9.794
  632   HH11  ARG  74          HH11      ARG  74 -20.581   9.524  10.796
  633   HH12  ARG  74          HH12      ARG  74 -19.961   9.538  12.425
  634   HH21  ARG  74          HH21      ARG  74 -17.719   6.894  11.918
  635   HH22  ARG  74          HH22      ARG  74 -18.334   8.062  13.051
  636    H    ASN  75           H        ASN  75 -22.577   7.317   5.114
  637    HA   ASN  75           HA       ASN  75 -22.491   6.877   2.309
  638    HB2  ASN  75           HB2      ASN  75 -24.338   8.345   4.152
  639    HB3  ASN  75           HB3      ASN  75 -24.483   8.589   2.413
  640   HD21  ASN  75          HD21      ASN  75 -24.665   6.247   5.001
  641   HD22  ASN  75          HD22      ASN  75 -25.558   5.058   4.105
  642    H    GLY  76           H        GLY  76 -20.847   7.840   1.233
  643    HA2  GLY  76           HA2      GLY  76 -20.898  10.084  -0.035
  644    HA3  GLY  76           HA3      GLY  76 -20.563  10.753   1.552
  645    H    ASP  77           H        ASP  77 -18.714   8.564   2.321
  646    HA   ASP  77           HA       ASP  77 -16.404   9.921   1.377
  647    HB2  ASP  77           HB2      ASP  77 -16.647   7.388   3.007
  648    HB3  ASP  77           HB3      ASP  77 -15.160   8.300   2.764
  649    H    THR  78           H        THR  78 -14.681   9.169   0.176
  650    HA   THR  78           HA       THR  78 -15.357   7.127  -1.798
  651    HB   THR  78           HB       THR  78 -12.995   9.026  -1.713
  652    HG1  THR  78           HG1      THR  78 -14.815  10.262  -2.021
  653   HG21  THR  78          HG21      THR  78 -14.073   7.309  -3.954
  654   HG22  THR  78          HG22      THR  78 -12.568   7.042  -3.074
  655   HG23  THR  78          HG23      THR  78 -12.752   8.470  -4.092
  656    H    MET  79           H        MET  79 -14.357   5.173  -1.887
  657    HA   MET  79           HA       MET  79 -12.087   4.729  -0.075
  658    HB2  MET  79           HB2      MET  79 -14.298   3.822   0.818
  659    HB3  MET  79           HB3      MET  79 -14.269   2.692  -0.530
  660    HG2  MET  79           HG2      MET  79 -12.125   1.813   0.266
  661    HG3  MET  79           HG3      MET  79 -12.184   2.930   1.628
  662    HE1  MET  79           HE1      MET  79 -14.946  -0.697   1.002
  663    HE2  MET  79           HE2      MET  79 -15.016   0.711  -0.063
  664    HE3  MET  79           HE3      MET  79 -13.556  -0.284  -0.009
  665    H    GLU  80           H        GLU  80 -10.434   4.243  -1.279
  666    HA   GLU  80           HA       GLU  80 -10.730   3.338  -4.000
  667    HB2  GLU  80           HB2      GLU  80  -8.956   4.976  -3.019
  668    HB3  GLU  80           HB3      GLU  80  -8.133   3.518  -2.486
  669    HG2  GLU  80           HG2      GLU  80  -7.918   2.737  -4.743
  670    HG3  GLU  80           HG3      GLU  80  -8.873   4.091  -5.344
  671    H    TYR  81           H        TYR  81 -10.805   1.184  -4.586
  672    HA   TYR  81           HA       TYR  81  -9.703  -0.756  -2.714
  673    HB2  TYR  81           HB2      TYR  81 -11.956  -1.126  -3.870
  674    HB3  TYR  81           HB3      TYR  81 -11.052  -1.322  -5.367
  675    HD1  TYR  81           HD1      TYR  81 -11.566  -2.772  -1.982
  676    HD2  TYR  81           HD2      TYR  81  -9.977  -3.367  -5.884
  677    HE1  TYR  81           HE1      TYR  81 -11.218  -5.156  -1.471
  678    HE2  TYR  81           HE2      TYR  81  -9.635  -5.746  -5.388
  679    HH   TYR  81           HH       TYR  81 -11.026  -7.293  -2.743
  680    H    ARG  82           H        ARG  82  -7.582  -0.901  -2.886
  681    HA   ARG  82           HA       ARG  82  -6.437  -0.899  -5.579
  682    HB2  ARG  82           HB2      ARG  82  -4.577   0.532  -4.923
  683    HB3  ARG  82           HB3      ARG  82  -6.106   1.375  -4.745
  684    HG2  ARG  82           HG2      ARG  82  -6.035   1.170  -2.379
  685    HG3  ARG  82           HG3      ARG  82  -4.656   0.069  -2.458
  686    HD2  ARG  82           HD2      ARG  82  -4.650   2.965  -3.321
  687    HD3  ARG  82           HD3      ARG  82  -3.991   2.348  -1.807
  688    HE   ARG  82           HE       ARG  82  -2.795   0.990  -3.971
  689   HH11  ARG  82          HH11      ARG  82  -2.805   4.164  -2.474
  690   HH12  ARG  82          HH12      ARG  82  -1.177   4.537  -2.962
  691   HH21  ARG  82          HH21      ARG  82  -0.691   1.503  -4.659
  692   HH22  ARG  82          HH22      ARG  82   0.022   3.036  -4.226
  693    H    LYS  83           H        LYS  83  -4.388  -1.854  -5.754
  694    HA   LYS  83           HA       LYS  83  -4.186  -4.275  -4.347
  695    HB2  LYS  83           HB2      LYS  83  -3.352  -3.799  -6.667
  696    HB3  LYS  83           HB3      LYS  83  -2.045  -2.866  -5.956
  697    HG2  LYS  83           HG2      LYS  83  -1.067  -4.790  -4.999
  698    HG3  LYS  83           HG3      LYS  83  -2.499  -5.771  -5.338
  699    HD2  LYS  83           HD2      LYS  83  -2.106  -5.543  -7.729
  700    HD3  LYS  83           HD3      LYS  83  -0.707  -4.513  -7.415
  701    HE2  LYS  83           HE2      LYS  83   0.408  -6.360  -6.283
  702    HE3  LYS  83           HE3      LYS  83  -0.997  -7.392  -6.563
  703    HZ1  LYS  83           HZ1      LYS  83   0.754  -7.789  -8.189
  704    HZ2  LYS  83           HZ2      LYS  83   0.689  -6.168  -8.685
  705    HZ3  LYS  83           HZ3      LYS  83  -0.640  -7.186  -8.944
  706    H    LYS  84           H        LYS  84  -3.149  -4.810  -2.535
  707    HA   LYS  84           HA       LYS  84  -2.406  -2.986  -0.600
  708    HB2  LYS  84           HB2      LYS  84  -1.570  -5.850  -1.030
  709    HB3  LYS  84           HB3      LYS  84  -1.080  -4.932   0.385
  710    HG2  LYS  84           HG2      LYS  84  -3.933  -5.460  -0.409
  711    HG3  LYS  84           HG3      LYS  84  -3.021  -6.403   0.770
  712    HD2  LYS  84           HD2      LYS  84  -2.612  -4.079   1.886
  713    HD3  LYS  84           HD3      LYS  84  -4.034  -3.599   0.955
  714    HE2  LYS  84           HE2      LYS  84  -4.782  -4.300   3.109
  715    HE3  LYS  84           HE3      LYS  84  -5.240  -5.548   1.950
  716    HZ1  LYS  84           HZ1      LYS  84  -3.313  -5.649   4.131
  717    HZ2  LYS  84           HZ2      LYS  84  -2.873  -6.464   2.712
  718    HZ3  LYS  84           HZ3      LYS  84  -4.315  -6.873   3.509
  719    H    GLN  85           H        GLN  85  -0.514  -4.438  -3.158
  720    HA   GLN  85           HA       GLN  85   1.882  -3.075  -2.218
  721    HB2  GLN  85           HB2      GLN  85   2.534  -4.627  -4.438
  722    HB3  GLN  85           HB3      GLN  85   2.859  -5.014  -2.755
  723    HG2  GLN  85           HG2      GLN  85   0.562  -6.054  -2.710
  724    HG3  GLN  85           HG3      GLN  85   0.566  -5.913  -4.463
  725   HE21  GLN  85          HE21      GLN  85   2.039  -7.421  -1.697
  726   HE22  GLN  85          HE22      GLN  85   2.805  -8.703  -2.564
  727    H    ARG  86           H        ARG  86   3.103  -1.867  -3.699
  728    HA   ARG  86           HA       ARG  86   1.667  -0.981  -6.097
  729    HB2  ARG  86           HB2      ARG  86   2.946   1.305  -5.175
  730    HB3  ARG  86           HB3      ARG  86   1.223   0.971  -5.097
  731    HG2  ARG  86           HG2      ARG  86   1.756   1.575  -2.926
  732    HG3  ARG  86           HG3      ARG  86   1.750  -0.187  -2.866
  733    HD2  ARG  86           HD2      ARG  86   3.666   0.539  -1.674
  734    HD3  ARG  86           HD3      ARG  86   4.241  -0.100  -3.214
  735    HE   ARG  86           HE       ARG  86   4.788   2.062  -3.891
  736   HH11  ARG  86          HH11      ARG  86   3.358   2.018  -0.704
  737   HH12  ARG  86          HH12      ARG  86   3.786   3.653  -0.337
  738   HH21  ARG  86          HH21      ARG  86   5.384   4.230  -3.400
  739   HH22  ARG  86          HH22      ARG  86   4.901   4.919  -1.881
  740    HA   PRO  87           HA       PRO  87   5.394  -1.590  -8.242
  741    HB2  PRO  87           HB2      PRO  87   5.032   0.909  -9.749
  742    HB3  PRO  87           HB3      PRO  87   5.009  -0.760 -10.321
  743    HG2  PRO  87           HG2      PRO  87   2.770   0.720 -10.179
  744    HG3  PRO  87           HG3      PRO  87   2.764  -1.025  -9.871
  745    HD2  PRO  87           HD2      PRO  87   2.703   1.246  -7.921
  746    HD3  PRO  87           HD3      PRO  87   1.815  -0.292  -7.889
  747    H    LEU  88           H        LEU  88   7.169  -1.345  -7.058
  748    HA   LEU  88           HA       LEU  88   8.020   1.362  -6.313
  749    HB2  LEU  88           HB2      LEU  88   8.443  -1.307  -5.028
  750    HB3  LEU  88           HB3      LEU  88   9.536   0.025  -4.692
  751    HG   LEU  88           HG       LEU  88   6.556   0.028  -4.211
  752   HD11  LEU  88          HD11      LEU  88   7.184   0.115  -1.846
  753   HD12  LEU  88          HD12      LEU  88   7.752  -1.365  -2.619
  754   HD13  LEU  88          HD13      LEU  88   8.883  -0.051  -2.295
  755   HD21  LEU  88          HD21      LEU  88   6.984   2.196  -3.134
  756   HD22  LEU  88          HD22      LEU  88   8.663   2.115  -3.678
  757   HD23  LEU  88          HD23      LEU  88   7.359   2.219  -4.860
  758    H    LYS  89           H        LYS  89   9.810   2.195  -7.127
  759    HA   LYS  89           HA       LYS  89  11.469   0.544  -8.856
  760    HB2  LYS  89           HB2      LYS  89  11.015   3.459  -8.528
  761    HB3  LYS  89           HB3      LYS  89  12.629   2.970  -9.021
  762    HG2  LYS  89           HG2      LYS  89  11.278   3.484 -10.956
  763    HG3  LYS  89           HG3      LYS  89  11.675   1.767 -10.932
  764    HD2  LYS  89           HD2      LYS  89   9.396   1.908 -11.543
  765    HD3  LYS  89           HD3      LYS  89   9.418   1.392  -9.857
  766    HE2  LYS  89           HE2      LYS  89   9.007   3.718  -9.162
  767    HE3  LYS  89           HE3      LYS  89   8.933   4.195 -10.859
  768    HZ1  LYS  89           HZ1      LYS  89   7.050   2.477  -9.360
  769    HZ2  LYS  89           HZ2      LYS  89   7.098   2.472 -11.052
  770    HZ3  LYS  89           HZ3      LYS  89   6.718   3.899 -10.221
  771    H    ILE  90           H        ILE  90  13.119  -0.465  -8.023
  772    HA   ILE  90           HA       ILE  90  14.428   0.637  -5.619
  773    HB   ILE  90           HB       ILE  90  14.062  -2.295  -6.271
  774   HG12  ILE  90          HG12      ILE  90  11.920  -1.230  -5.656
  775   HG13  ILE  90          HG13      ILE  90  12.458  -2.381  -4.438
  776   HG21  ILE  90          HG21      ILE  90  14.863  -2.623  -3.943
  777   HG22  ILE  90          HG22      ILE  90  16.070  -1.930  -5.026
  778   HG23  ILE  90          HG23      ILE  90  15.226  -0.899  -3.870
  779   HD11  ILE  90          HD11      ILE  90  11.536  -0.382  -3.423
  780   HD12  ILE  90          HD12      ILE  90  13.253  -0.543  -3.052
  781   HD13  ILE  90          HD13      ILE  90  12.721   0.610  -4.275
  782    H    ARG  91           H        ARG  91  16.645   0.877  -5.778
  783    HA   ARG  91           HA       ARG  91  17.963  -0.418  -8.065
  784    HB2  ARG  91           HB2      ARG  91  18.010   2.119  -7.847
  785    HB3  ARG  91           HB3      ARG  91  19.005   1.886  -6.418
  786    HG2  ARG  91           HG2      ARG  91  20.691   0.750  -7.778
  787    HG3  ARG  91           HG3      ARG  91  19.699   1.017  -9.214
  788    HD2  ARG  91           HD2      ARG  91  20.881   3.153  -7.440
  789    HD3  ARG  91           HD3      ARG  91  21.462   2.696  -9.040
  790    HE   ARG  91           HE       ARG  91  19.085   3.412  -9.756
  791   HH11  ARG  91          HH11      ARG  91  21.044   4.934  -7.274
  792   HH12  ARG  91          HH12      ARG  91  20.241   6.470  -7.403
  793   HH21  ARG  91          HH21      ARG  91  18.038   5.430  -9.934
  794   HH22  ARG  91          HH22      ARG  91  18.516   6.746  -8.905
  795    H    MET  92           H        MET  92  19.235  -2.077  -7.615
  796    HA   MET  92           HA       MET  92  19.727  -2.843  -4.889
  797    HB2  MET  92           HB2      MET  92  19.818  -4.068  -7.559
  798    HB3  MET  92           HB3      MET  92  21.023  -4.681  -6.437
  799    HG2  MET  92           HG2      MET  92  18.785  -5.873  -6.595
  800    HG3  MET  92           HG3      MET  92  19.427  -5.533  -4.993
  801    HE1  MET  92           HE1      MET  92  17.606  -3.286  -7.633
  802    HE2  MET  92           HE2      MET  92  16.662  -4.774  -7.634
  803    HE3  MET  92           HE3      MET  92  15.957  -3.281  -7.007
  804    H    LEU  93           H        LEU  93  21.944  -3.963  -4.525
  805    HA   LEU  93           HA       LEU  93  23.705  -1.891  -3.945
  806    HB2  LEU  93           HB2      LEU  93  24.380  -4.828  -4.153
  807    HB3  LEU  93           HB3      LEU  93  25.334  -3.619  -3.328
  808    HG   LEU  93           HG       LEU  93  24.286  -4.712  -1.597
  809   HD11  LEU  93          HD11      LEU  93  23.960  -2.346  -1.336
  810   HD12  LEU  93          HD12      LEU  93  22.458  -2.419  -2.261
  811   HD13  LEU  93          HD13      LEU  93  22.568  -3.218  -0.691
  812   HD21  LEU  93          HD21      LEU  93  22.041  -5.524  -1.555
  813   HD22  LEU  93          HD22      LEU  93  21.664  -4.715  -3.074
  814   HD23  LEU  93          HD23      LEU  93  22.801  -6.061  -3.052
  815    H    ASP  94           H        ASP  94  23.764  -4.259  -6.550
  816    HA   ASP  94           HA       ASP  94  26.362  -3.489  -7.474
  817    HB2  ASP  94           HB2      ASP  94  26.014  -5.071  -9.255
  818    HB3  ASP  94           HB3      ASP  94  25.405  -5.776  -7.762
  819    H    GLY  95           H        GLY  95  23.374  -2.045  -7.698
  820    HA2  GLY  95           HA2      GLY  95  23.158   0.112  -8.664
  821    HA3  GLY  95           HA3      GLY  95  24.406  -0.308  -9.829
  822    H    THR  96           H        THR  96  21.933  -2.619  -9.231
  823    HA   THR  96           HA       THR  96  20.863  -2.075 -11.904
  824    HB   THR  96           HB       THR  96  20.732  -4.580 -10.210
  825    HG1  THR  96           HG1      THR  96  22.651  -4.769 -11.119
  826   HG21  THR  96          HG21      THR  96  18.701  -4.351 -11.559
  827   HG22  THR  96          HG22      THR  96  19.723  -5.654 -12.169
  828   HG23  THR  96          HG23      THR  96  19.683  -4.100 -13.003
  829    H    VAL  97           H        VAL  97  18.725  -1.599 -12.213
  830    HA   VAL  97           HA       VAL  97  17.206  -1.217  -9.723
  831    HB   VAL  97           HB       VAL  97  17.792   0.928 -10.634
  832   HG11  VAL  97          HG11      VAL  97  16.479   0.052 -13.195
  833   HG12  VAL  97          HG12      VAL  97  17.106   1.664 -12.849
  834   HG13  VAL  97          HG13      VAL  97  18.208   0.290 -12.938
  835   HG21  VAL  97          HG21      VAL  97  14.894   0.317 -11.190
  836   HG22  VAL  97          HG22      VAL  97  15.586   0.753  -9.628
  837   HG23  VAL  97          HG23      VAL  97  15.579   1.923 -10.948
  838    H    LYS  98           H        LYS  98  15.211  -1.899  -9.585
  839    HA   LYS  98           HA       LYS  98  13.856  -3.014 -11.919
  840    HB2  LYS  98           HB2      LYS  98  13.435  -5.168 -11.032
  841    HB3  LYS  98           HB3      LYS  98  15.164  -4.899 -10.878
  842    HG2  LYS  98           HG2      LYS  98  15.014  -4.588  -8.554
  843    HG3  LYS  98           HG3      LYS  98  13.257  -4.409  -8.615
  844    HD2  LYS  98           HD2      LYS  98  14.722  -6.927  -9.377
  845    HD3  LYS  98           HD3      LYS  98  14.050  -6.630  -7.774
  846    HE2  LYS  98           HE2      LYS  98  12.404  -6.515 -10.302
  847    HE3  LYS  98           HE3      LYS  98  12.594  -7.983  -9.329
  848    HZ1  LYS  98           HZ1      LYS  98  10.597  -6.904  -8.732
  849    HZ2  LYS  98           HZ2      LYS  98  11.388  -5.424  -8.504
  850    HZ3  LYS  98           HZ3      LYS  98  11.692  -6.712  -7.454
  851    H    THR  99           H        THR  99  11.571  -3.574 -11.476
  852    HA   THR  99           HA       THR  99  10.513  -1.932  -9.285
  853    HB   THR  99           HB       THR  99   9.240  -2.826 -11.879
  854    HG1  THR  99           HG1      THR  99  10.770  -0.942 -11.772
  855   HG21  THR  99          HG21      THR  99   8.040  -1.200  -9.641
  856   HG22  THR  99          HG22      THR  99   7.625  -2.865 -10.046
  857   HG23  THR  99          HG23      THR  99   7.274  -1.566 -11.188
  858    H    ILE 100           H        ILE 100   9.570  -3.014  -7.605
  859    HA   ILE 100           HA       ILE 100   8.402  -5.639  -8.201
  860    HB   ILE 100           HB       ILE 100  10.562  -5.915  -7.007
  861   HG12  ILE 100          HG12      ILE 100   8.369  -7.349  -6.635
  862   HG13  ILE 100          HG13      ILE 100   9.841  -7.668  -5.729
  863   HG21  ILE 100          HG21      ILE 100  10.646  -3.893  -5.730
  864   HG22  ILE 100          HG22      ILE 100   9.237  -4.387  -4.788
  865   HG23  ILE 100          HG23      ILE 100  10.749  -5.286  -4.648
  866   HD11  ILE 100          HD11      ILE 100   7.899  -7.748  -4.299
  867   HD12  ILE 100          HD12      ILE 100   8.944  -6.401  -3.846
  868   HD13  ILE 100          HD13      ILE 100   7.465  -6.102  -4.761
  869    H    MET 101           H        MET 101   6.442  -6.056  -7.127
  870    HA   MET 101           HA       MET 101   5.187  -3.684  -5.996
  871    HB2  MET 101           HB2      MET 101   4.031  -6.402  -6.602
  872    HB3  MET 101           HB3      MET 101   3.117  -4.970  -6.147
  873    HG2  MET 101           HG2      MET 101   4.401  -3.979  -8.257
  874    HG3  MET 101           HG3      MET 101   4.383  -5.681  -8.720
  875    HE1  MET 101           HE1      MET 101   0.632  -3.189  -7.794
  876    HE2  MET 101           HE2      MET 101   1.822  -3.667  -6.580
  877    HE3  MET 101           HE3      MET 101   2.266  -2.524  -7.849
  878    H    VAL 102           H        VAL 102   5.453  -3.294  -4.001
  879    HA   VAL 102           HA       VAL 102   5.306  -5.513  -2.067
  880    HB   VAL 102           HB       VAL 102   6.698  -3.186  -1.024
  881   HG11  VAL 102          HG11      VAL 102   8.329  -4.975  -0.409
  882   HG12  VAL 102          HG12      VAL 102   6.677  -5.276   0.127
  883   HG13  VAL 102          HG13      VAL 102   7.316  -6.121  -1.281
  884   HG21  VAL 102          HG21      VAL 102   8.788  -3.509  -2.272
  885   HG22  VAL 102          HG22      VAL 102   7.964  -4.634  -3.351
  886   HG23  VAL 102          HG23      VAL 102   7.486  -2.937  -3.317
  887    H    ASP 103           H        ASP 103   4.036  -5.300  -0.358
  888    HA   ASP 103           HA       ASP 103   1.805  -3.656  -0.546
  889    HB2  ASP 103           HB2      ASP 103   2.787  -5.040   1.955
  890    HB3  ASP 103           HB3      ASP 103   1.134  -4.565   1.586
  891    H    ASP 104           H        ASP 104   1.287  -1.729   0.167
  892    HA   ASP 104           HA       ASP 104   3.268  -0.089   1.515
  893    HB2  ASP 104           HB2      ASP 104   1.984   0.838  -0.358
  894    HB3  ASP 104           HB3      ASP 104   0.478   0.526   0.495
  895    H    SER 105           H        SER 105   0.805  -2.165   2.367
  896    HA   SER 105           HA       SER 105  -0.097  -0.730   4.713
  897    HB2  SER 105           HB2      SER 105  -1.467  -2.858   5.030
  898    HB3  SER 105           HB3      SER 105  -1.791  -1.925   3.569
  899    HG   SER 105           HG       SER 105  -0.511  -4.403   3.868
  900    H    LYS 106           H        LYS 106   2.714  -2.178   4.235
  901    HA   LYS 106           HA       LYS 106   2.803  -3.157   6.997
  902    HB2  LYS 106           HB2      LYS 106   4.557  -4.830   6.115
  903    HB3  LYS 106           HB3      LYS 106   2.852  -5.180   5.873
  904    HG2  LYS 106           HG2      LYS 106   3.409  -5.549   3.758
  905    HG3  LYS 106           HG3      LYS 106   3.486  -3.798   3.607
  906    HD2  LYS 106           HD2      LYS 106   5.845  -3.794   3.953
  907    HD3  LYS 106           HD3      LYS 106   5.837  -5.502   4.404
  908    HE2  LYS 106           HE2      LYS 106   5.084  -4.419   1.692
  909    HE3  LYS 106           HE3      LYS 106   6.652  -5.113   2.103
  910    HZ1  LYS 106           HZ1      LYS 106   5.170  -6.713   1.004
  911    HZ2  LYS 106           HZ2      LYS 106   4.059  -6.565   2.274
  912    HZ3  LYS 106           HZ3      LYS 106   5.596  -7.214   2.566
  913    H    THR 107           H        THR 107   5.393  -3.652   7.371
  914    HA   THR 107           HA       THR 107   6.498  -0.962   7.205
  915    HB   THR 107           HB       THR 107   8.218  -2.078   8.837
  916    HG1  THR 107           HG1      THR 107   7.573  -4.208   8.687
  917   HG21  THR 107          HG21      THR 107   5.354  -1.540   9.631
  918   HG22  THR 107          HG22      THR 107   6.624  -0.329   9.458
  919   HG23  THR 107          HG23      THR 107   6.741  -1.555  10.722
  920    H    VAL 108           H        VAL 108   9.102  -1.175   7.398
  921    HA   VAL 108           HA       VAL 108   9.892  -1.453   4.725
  922    HB   VAL 108           HB       VAL 108  11.709  -1.358   7.115
  923   HG11  VAL 108          HG11      VAL 108  13.234  -0.189   5.600
  924   HG12  VAL 108          HG12      VAL 108  12.844  -1.811   5.027
  925   HG13  VAL 108          HG13      VAL 108  12.079  -0.406   4.284
  926   HG21  VAL 108          HG21      VAL 108  11.605   1.092   6.921
  927   HG22  VAL 108          HG22      VAL 108  10.341   0.924   5.705
  928   HG23  VAL 108          HG23      VAL 108  10.050   0.384   7.358
  929    H    THR 109           H        THR 109  10.900  -3.317   7.550
  930    HA   THR 109           HA       THR 109  12.698  -5.041   6.522
  931    HB   THR 109           HB       THR 109  10.572  -5.836   8.505
  932    HG1  THR 109           HG1      THR 109  12.096  -4.960  10.025
  933   HG21  THR 109          HG21      THR 109  13.425  -6.771   8.141
  934   HG22  THR 109          HG22      THR 109  11.979  -7.699   7.742
  935   HG23  THR 109          HG23      THR 109  12.325  -7.283   9.421
  936    H    ASP 110           H        ASP 110   9.175  -5.761   6.591
  937    HA   ASP 110           HA       ASP 110   9.370  -8.222   5.249
  938    HB2  ASP 110           HB2      ASP 110   7.355  -7.396   6.489
  939    HB3  ASP 110           HB3      ASP 110   7.039  -6.288   5.157
  940    H    MET 111           H        MET 111   8.976  -4.936   4.064
  941    HA   MET 111           HA       MET 111   8.670  -5.531   1.332
  942    HB2  MET 111           HB2      MET 111   8.098  -3.347   1.966
  943    HB3  MET 111           HB3      MET 111   9.597  -3.110   2.849
  944    HG2  MET 111           HG2      MET 111  10.834  -2.943   0.786
  945    HG3  MET 111           HG3      MET 111   9.389  -3.311  -0.147
  946    HE1  MET 111           HE1      MET 111   9.711   0.470   2.450
  947    HE2  MET 111           HE2      MET 111   9.047  -1.054   3.044
  948    HE3  MET 111           HE3      MET 111  10.755  -0.945   2.606
  949    H    LEU 112           H        LEU 112  11.571  -4.773   3.245
  950    HA   LEU 112           HA       LEU 112  13.405  -4.903   1.107
  951    HB2  LEU 112           HB2      LEU 112  13.668  -4.066   3.586
  952    HB3  LEU 112           HB3      LEU 112  14.177  -5.719   3.882
  953    HG   LEU 112           HG       LEU 112  15.920  -5.398   2.073
  954   HD11  LEU 112          HD11      LEU 112  15.065  -2.526   2.406
  955   HD12  LEU 112          HD12      LEU 112  16.498  -3.072   1.531
  956   HD13  LEU 112          HD13      LEU 112  14.890  -3.508   0.950
  957   HD21  LEU 112          HD21      LEU 112  16.062  -3.603   4.493
  958   HD22  LEU 112          HD22      LEU 112  16.485  -5.314   4.443
  959   HD23  LEU 112          HD23      LEU 112  17.434  -4.145   3.526
  960    H    MET 113           H        MET 113  12.225  -7.312   3.386
  961    HA   MET 113           HA       MET 113  13.749  -9.529   2.663
  962    HB2  MET 113           HB2      MET 113  12.190  -9.475   4.572
  963    HB3  MET 113           HB3      MET 113  10.829  -9.405   3.461
  964    HG2  MET 113           HG2      MET 113  11.598 -11.629   2.560
  965    HG3  MET 113           HG3      MET 113  12.717 -11.696   3.920
  966    HE1  MET 113           HE1      MET 113  11.926 -11.747   6.479
  967    HE2  MET 113           HE2      MET 113  10.987 -10.278   6.209
  968    HE3  MET 113           HE3      MET 113  10.234 -11.678   6.974
  969    H    THR 114           H        THR 114  10.929  -8.107   1.202
  970    HA   THR 114           HA       THR 114  10.431 -10.262  -0.612
  971    HB   THR 114           HB       THR 114   9.330  -7.457  -0.476
  972    HG1  THR 114           HG1      THR 114   8.744  -8.658   1.331
  973   HG21  THR 114          HG21      THR 114   9.036  -8.340  -2.721
  974   HG22  THR 114          HG22      THR 114   7.486  -8.343  -1.877
  975   HG23  THR 114          HG23      THR 114   8.387  -9.847  -2.070
  976    H    ILE 115           H        ILE 115  12.067  -7.109  -0.819
  977    HA   ILE 115           HA       ILE 115  12.161  -7.042  -3.663
  978    HB   ILE 115           HB       ILE 115  13.919  -5.598  -1.671
  979   HG12  ILE 115          HG12      ILE 115  11.428  -4.609  -3.077
  980   HG13  ILE 115          HG13      ILE 115  11.459  -5.186  -1.413
  981   HG21  ILE 115          HG21      ILE 115  13.367  -5.040  -4.585
  982   HG22  ILE 115          HG22      ILE 115  14.311  -4.013  -3.505
  983   HG23  ILE 115          HG23      ILE 115  14.882  -5.633  -3.903
  984   HD11  ILE 115          HD11      ILE 115  13.004  -3.393  -0.821
  985   HD12  ILE 115          HD12      ILE 115  12.972  -2.817  -2.488
  986   HD13  ILE 115          HD13      ILE 115  11.507  -2.763  -1.509
  987    H    CYS 116           H        CYS 116  14.524  -7.908  -1.165
  988    HA   CYS 116           HA       CYS 116  16.658  -8.407  -2.942
  989    HB2  CYS 116           HB2      CYS 116  17.697  -9.545  -0.992
  990    HB3  CYS 116           HB3      CYS 116  17.063  -7.950  -0.597
  991    HG   CYS 116           HG       CYS 116  14.972  -8.764   0.884
  992    H    ALA 117           H        ALA 117  13.971 -10.325  -1.874
  993    HA   ALA 117           HA       ALA 117  14.974 -12.885  -2.535
  994    HB1  ALA 117           HB1      ALA 117  13.054 -12.561  -1.056
  995    HB2  ALA 117           HB2      ALA 117  12.117 -11.926  -2.408
  996    HB3  ALA 117           HB3      ALA 117  12.646 -13.608  -2.416
  997    H    ARG 118           H        ARG 118  13.539 -10.314  -4.403
  998    HA   ARG 118           HA       ARG 118  12.779 -11.827  -6.668
  999    HB2  ARG 118           HB2      ARG 118  13.737  -8.961  -6.687
 1000    HB3  ARG 118           HB3      ARG 118  12.715  -9.744  -7.882
 1001    HG2  ARG 118           HG2      ARG 118  11.992  -9.044  -5.049
 1002    HG3  ARG 118           HG3      ARG 118  11.382  -8.302  -6.532
 1003    HD2  ARG 118           HD2      ARG 118  10.982 -11.197  -5.799
 1004    HD3  ARG 118           HD3      ARG 118   9.820  -9.919  -5.453
 1005    HE   ARG 118           HE       ARG 118  10.522  -9.982  -8.219
 1006   HH11  ARG 118          HH11      ARG 118   8.599 -11.642  -5.796
 1007   HH12  ARG 118          HH12      ARG 118   7.381 -12.145  -6.935
 1008   HH21  ARG 118          HH21      ARG 118   8.908 -10.640  -9.710
 1009   HH22  ARG 118          HH22      ARG 118   7.550 -11.561  -9.146
 1010    H    ILE 119           H        ILE 119  15.771 -10.178  -5.766
 1011    HA   ILE 119           HA       ILE 119  17.110 -10.686  -8.232
 1012    HB   ILE 119           HB       ILE 119  18.560 -10.195  -5.654
 1013   HG12  ILE 119          HG12      ILE 119  16.620  -8.669  -5.659
 1014   HG13  ILE 119          HG13      ILE 119  18.145  -7.804  -5.821
 1015   HG21  ILE 119          HG21      ILE 119  18.979  -9.221  -8.475
 1016   HG22  ILE 119          HG22      ILE 119  20.028  -8.876  -7.100
 1017   HG23  ILE 119          HG23      ILE 119  19.856 -10.532  -7.685
 1018   HD11  ILE 119          HD11      ILE 119  17.756  -7.579  -8.221
 1019   HD12  ILE 119          HD12      ILE 119  16.226  -8.441  -8.051
 1020   HD13  ILE 119          HD13      ILE 119  16.445  -6.871  -7.277
 1021    H    GLY 120           H        GLY 120  17.154 -12.121  -5.006
 1022    HA2  GLY 120           HA2      GLY 120  17.438 -14.599  -4.978
 1023    HA3  GLY 120           HA3      GLY 120  18.772 -14.333  -6.092
 1024    H    ILE 121           H        ILE 121  18.365 -11.992  -3.644
 1025    HA   ILE 121           HA       ILE 121  20.838 -12.768  -2.361
 1026    HB   ILE 121           HB       ILE 121  18.928 -10.562  -1.578
 1027   HG12  ILE 121          HG12      ILE 121  21.351 -10.363  -3.377
 1028   HG13  ILE 121          HG13      ILE 121  19.684 -10.347  -3.944
 1029   HG21  ILE 121          HG21      ILE 121  20.526 -11.149   0.151
 1030   HG22  ILE 121          HG22      ILE 121  21.853 -10.966  -0.996
 1031   HG23  ILE 121          HG23      ILE 121  20.898  -9.561  -0.523
 1032   HD11  ILE 121          HD11      ILE 121  20.957  -8.304  -2.132
 1033   HD12  ILE 121          HD12      ILE 121  20.597  -8.102  -3.847
 1034   HD13  ILE 121          HD13      ILE 121  19.283  -8.287  -2.686
 1035    H    THR 122           H        THR 122  20.992 -13.874  -0.439
 1036    HA   THR 122           HA       THR 122  18.514 -15.009   0.545
 1037    HB   THR 122           HB       THR 122  20.533 -16.438   0.135
 1038    HG1  THR 122           HG1      THR 122  18.735 -16.816   1.787
 1039   HG21  THR 122          HG21      THR 122  22.293 -16.498   1.838
 1040   HG22  THR 122          HG22      THR 122  21.582 -15.088   2.623
 1041   HG23  THR 122          HG23      THR 122  22.259 -14.946   1.000
 1042    H    ASN 123           H        ASN 123  20.871 -12.652   1.546
 1043    HA   ASN 123           HA       ASN 123  19.682 -12.488   4.213
 1044    HB2  ASN 123           HB2      ASN 123  22.037 -11.040   2.998
 1045    HB3  ASN 123           HB3      ASN 123  21.416 -10.722   4.613
 1046   HD21  ASN 123          HD21      ASN 123  23.997 -11.417   4.215
 1047   HD22  ASN 123          HD22      ASN 123  24.287 -13.020   4.824
 1048    H    HIS 124           H        HIS 124  18.653 -10.676   4.993
 1049    HA   HIS 124           HA       HIS 124  18.310  -8.410   3.173
 1050    HB2  HIS 124           HB2      HIS 124  15.948  -8.339   3.349
 1051    HB3  HIS 124           HB3      HIS 124  16.340 -10.004   2.946
 1052    HD1  HIS 124           HD1      HIS 124  14.464  -7.990   5.284
 1053    HD2  HIS 124           HD2      HIS 124  16.247 -11.743   5.361
 1054    HE1  HIS 124           HE1      HIS 124  13.344  -9.227   7.147
 1055    HE2  HIS 124           HE2      HIS 124  14.547 -11.441   7.293
 1056    H    ASP 125           H        ASP 125  19.077  -9.584   6.162
 1057    HA   ASP 125           HA       ASP 125  17.967  -7.404   7.696
 1058    HB2  ASP 125           HB2      ASP 125  19.499  -9.902   8.353
 1059    HB3  ASP 125           HB3      ASP 125  19.288  -8.632   9.541
 1060    H    GLU 126           H        GLU 126  20.953  -8.375   6.196
 1061    HA   GLU 126           HA       GLU 126  22.593  -6.549   7.667
 1062    HB2  GLU 126           HB2      GLU 126  24.360  -7.102   6.074
 1063    HB3  GLU 126           HB3      GLU 126  23.585  -8.551   6.696
 1064    HG2  GLU 126           HG2      GLU 126  22.455  -8.936   4.669
 1065    HG3  GLU 126           HG3      GLU 126  22.827  -7.324   4.069
 1066    H    TYR 127           H        TYR 127  20.171  -5.857   5.747
 1067    HA   TYR 127           HA       TYR 127  21.508  -3.592   4.423
 1068    HB2  TYR 127           HB2      TYR 127  19.023  -5.055   3.521
 1069    HB3  TYR 127           HB3      TYR 127  19.769  -3.688   2.703
 1070    HD1  TYR 127           HD1      TYR 127  22.216  -4.018   1.933
 1071    HD2  TYR 127           HD2      TYR 127  19.595  -7.209   2.917
 1072    HE1  TYR 127           HE1      TYR 127  23.617  -5.555   0.636
 1073    HE2  TYR 127           HE2      TYR 127  20.982  -8.762   1.630
 1074    HH   TYR 127           HH       TYR 127  22.601  -8.677  -0.238
 1075    H    SER 128           H        SER 128  20.465  -1.607   4.418
 1076    HA   SER 128           HA       SER 128  17.975  -1.414   5.982
 1077    HB2  SER 128           HB2      SER 128  20.043   0.738   5.426
 1078    HB3  SER 128           HB3      SER 128  18.567   0.947   6.368
 1079    HG   SER 128           HG       SER 128  20.837   0.309   7.330
 1080    H    LEU 129           H        LEU 129  16.995   0.983   5.049
 1081    HA   LEU 129           HA       LEU 129  17.056   0.672   2.128
 1082    HB2  LEU 129           HB2      LEU 129  14.953  -0.240   3.475
 1083    HB3  LEU 129           HB3      LEU 129  14.489   1.450   3.432
 1084    HG   LEU 129           HG       LEU 129  15.201  -0.014   0.901
 1085   HD11  LEU 129          HD11      LEU 129  12.822  -0.494   0.596
 1086   HD12  LEU 129          HD12      LEU 129  13.482  -1.342   1.994
 1087   HD13  LEU 129          HD13      LEU 129  12.495   0.100   2.224
 1088   HD21  LEU 129          HD21      LEU 129  13.407   2.341   1.479
 1089   HD22  LEU 129          HD22      LEU 129  15.033   2.423   0.802
 1090   HD23  LEU 129          HD23      LEU 129  13.736   1.651  -0.111
 1091    H    VAL 130           H        VAL 130  16.826   2.593   0.961
 1092    HA   VAL 130           HA       VAL 130  16.518   5.059   2.498
 1093    HB   VAL 130           HB       VAL 130  18.861   4.995   2.463
 1094   HG11  VAL 130          HG11      VAL 130  20.196   4.442   0.485
 1095   HG12  VAL 130          HG12      VAL 130  19.165   3.109   1.007
 1096   HG13  VAL 130          HG13      VAL 130  18.708   4.081  -0.390
 1097   HG21  VAL 130          HG21      VAL 130  18.073   7.141   1.659
 1098   HG22  VAL 130          HG22      VAL 130  19.595   6.713   0.873
 1099   HG23  VAL 130          HG23      VAL 130  18.071   6.541   0.001
 1100    H    ARG 131           H        ARG 131  14.937   6.158   1.592
 1101    HA   ARG 131           HA       ARG 131  14.276   5.588  -1.222
 1102    HB2  ARG 131           HB2      ARG 131  12.454   7.057   0.639
 1103    HB3  ARG 131           HB3      ARG 131  12.053   6.051  -0.743
 1104    HG2  ARG 131           HG2      ARG 131  12.758   4.070   0.586
 1105    HG3  ARG 131           HG3      ARG 131  12.942   5.144   1.977
 1106    HD2  ARG 131           HD2      ARG 131  10.782   4.304   2.224
 1107    HD3  ARG 131           HD3      ARG 131  10.538   5.880   1.465
 1108    HE   ARG 131           HE       ARG 131  10.492   4.483  -0.690
 1109   HH11  ARG 131          HH11      ARG 131   9.129   3.551   2.383
 1110   HH12  ARG 131          HH12      ARG 131   8.080   2.351   1.705
 1111   HH21  ARG 131          HH21      ARG 131   9.105   2.898  -1.603
 1112   HH22  ARG 131          HH22      ARG 131   8.070   1.972  -0.565
 1113    H    GLU 132           H        GLU 132  15.447   7.090  -2.372
 1114    HA   GLU 132           HA       GLU 132  15.412   9.846  -1.680
 1115    HB2  GLU 132           HB2      GLU 132  16.038   8.473  -4.306
 1116    HB3  GLU 132           HB3      GLU 132  16.266  10.191  -4.007
 1117    HG2  GLU 132           HG2      GLU 132  17.830   9.591  -2.169
 1118    HG3  GLU 132           HG3      GLU 132  17.679   7.905  -2.662
 1119    H    LEU 133           H        LEU 133  13.518  10.871  -1.558
 1120    HA   LEU 133           HA       LEU 133  11.451  10.200  -3.506
 1121    HB2  LEU 133           HB2      LEU 133  11.129  11.965  -1.094
 1122    HB3  LEU 133           HB3      LEU 133   9.868  11.251  -2.065
 1123    HG   LEU 133           HG       LEU 133  11.700   9.825  -0.145
 1124   HD11  LEU 133          HD11      LEU 133   9.589   9.263   0.981
 1125   HD12  LEU 133          HD12      LEU 133   9.842  11.008   0.890
 1126   HD13  LEU 133          HD13      LEU 133   8.709  10.224  -0.212
 1127   HD21  LEU 133          HD21      LEU 133  10.492   7.782  -0.743
 1128   HD22  LEU 133          HD22      LEU 133   9.643   8.660  -2.016
 1129   HD23  LEU 133          HD23      LEU 133  11.389   8.433  -2.115
 1130    H    MET 134           H        MET 134   9.952  12.217  -3.778
 1131    HA   MET 134           HA       MET 134  11.600  14.318  -5.019
 1132    HB2  MET 134           HB2      MET 134   9.473  14.858  -6.239
 1133    HB3  MET 134           HB3      MET 134  10.086  13.240  -6.557
 1134    HG2  MET 134           HG2      MET 134   7.828  12.874  -6.255
 1135    HG3  MET 134           HG3      MET 134   8.506  12.504  -4.672
 1136    HE1  MET 134           HE1      MET 134   5.096  14.005  -3.618
 1137    HE2  MET 134           HE2      MET 134   5.435  12.927  -4.971
 1138    HE3  MET 134           HE3      MET 134   6.241  12.678  -3.421
 1139    H    GLU 135           H        GLU 135  10.172  13.707  -2.230
 1140    HA   GLU 135           HA       GLU 135   8.317  15.530  -1.525
 1141    HB2  GLU 135           HB2      GLU 135  10.510  14.162  -0.091
 1142    HB3  GLU 135           HB3      GLU 135   9.769  15.526   0.735
 1143    HG2  GLU 135           HG2      GLU 135   8.209  13.220  -0.396
 1144    HG3  GLU 135           HG3      GLU 135   8.794  13.294   1.268
 1145    H    GLU 136           H        GLU 136   8.196  17.626  -1.838
 1146    HA   GLU 136           HA       GLU 136  10.460  19.375  -1.831
 1147    HB2  GLU 136           HB2      GLU 136   8.762  21.148  -2.002
 1148    HB3  GLU 136           HB3      GLU 136   8.456  19.847  -3.146
 1149    HG2  GLU 136           HG2      GLU 136   6.755  18.930  -1.649
 1150    HG3  GLU 136           HG3      GLU 136   7.043  20.257  -0.523
 1151    H    LYS 137           H        LYS 137   8.341  18.056   0.496
 1152    HA   LYS 137           HA       LYS 137   8.804  20.060   2.522
 1153    HB2  LYS 137           HB2      LYS 137   7.503  17.340   2.762
 1154    HB3  LYS 137           HB3      LYS 137   7.376  18.673   3.905
 1155    HG2  LYS 137           HG2      LYS 137   6.051  19.946   2.438
 1156    HG3  LYS 137           HG3      LYS 137   6.440  18.906   1.066
 1157    HD2  LYS 137           HD2      LYS 137   5.214  17.073   2.108
 1158    HD3  LYS 137           HD3      LYS 137   4.838  18.107   3.489
 1159    HE2  LYS 137           HE2      LYS 137   3.615  19.621   2.048
 1160    HE3  LYS 137           HE3      LYS 137   4.028  18.649   0.638
 1161    HZ1  LYS 137           HZ1      LYS 137   2.388  17.736   2.940
 1162    HZ2  LYS 137           HZ2      LYS 137   2.780  16.811   1.578
 1163    HZ3  LYS 137           HZ3      LYS 137   1.793  18.176   1.416
 1164    H    LYS 138           H        LYS 138   9.220  16.521   2.615
 1165    HA   LYS 138           HA       LYS 138  11.268  16.556   4.540
 1166    HB2  LYS 138           HB2      LYS 138  10.832  14.413   2.461
 1167    HB3  LYS 138           HB3      LYS 138  11.567  14.230   4.048
 1168    HG2  LYS 138           HG2      LYS 138   9.415  14.783   5.084
 1169    HG3  LYS 138           HG3      LYS 138   8.692  14.882   3.479
 1170    HD2  LYS 138           HD2      LYS 138   9.352  12.528   3.090
 1171    HD3  LYS 138           HD3      LYS 138   9.920  12.454   4.764
 1172    HE2  LYS 138           HE2      LYS 138   7.745  11.593   4.848
 1173    HE3  LYS 138           HE3      LYS 138   7.607  13.267   5.402
 1174    HZ1  LYS 138           HZ1      LYS 138   6.980  13.840   3.056
 1175    HZ2  LYS 138           HZ2      LYS 138   5.845  12.918   3.913
 1176    HZ3  LYS 138           HZ3      LYS 138   6.836  12.173   2.766
 1177    H    ASP 169           H        ASP 169  11.531  15.782   1.069
 1178    HA   ASP 169           HA       ASP 169  13.305  15.693  -0.348
 1179    HB2  ASP 169           HB2      ASP 169  13.167  18.169  -0.005
 1180    HB3  ASP 169           HB3      ASP 169  14.340  18.020   1.298
 1181    H    GLU 170           H        GLU 170  13.292  13.975   1.779
 1182    HA   GLU 170           HA       GLU 170  16.029  13.894   2.790
 1183    HB2  GLU 170           HB2      GLU 170  13.603  12.264   3.562
 1184    HB3  GLU 170           HB3      GLU 170  15.185  12.146   4.313
 1185    HG2  GLU 170           HG2      GLU 170  14.993  14.450   5.090
 1186    HG3  GLU 170           HG3      GLU 170  13.403  14.569   4.335
 1187    H    LEU 171           H        LEU 171  17.256  12.007   2.679
 1188    HA   LEU 171           HA       LEU 171  17.000  10.332   0.390
 1189    HB2  LEU 171           HB2      LEU 171  18.613   9.892   2.911
 1190    HB3  LEU 171           HB3      LEU 171  18.836   9.059   1.384
 1191    HG   LEU 171           HG       LEU 171  19.289  11.991   1.871
 1192   HD11  LEU 171          HD11      LEU 171  21.650  11.440   1.507
 1193   HD12  LEU 171          HD12      LEU 171  20.992  10.601   2.911
 1194   HD13  LEU 171          HD13      LEU 171  21.228   9.732   1.396
 1195   HD21  LEU 171          HD21      LEU 171  19.680  10.288  -0.583
 1196   HD22  LEU 171          HD22      LEU 171  18.493  11.581  -0.375
 1197   HD23  LEU 171          HD23      LEU 171  20.217  11.961  -0.412
 1198    H    ASN 172           H        ASN 172  15.565  10.439   3.407
 1199    HA   ASN 172           HA       ASN 172  14.352   9.031   4.704
 1200    HB2  ASN 172           HB2      ASN 172  13.622   8.078   1.938
 1201    HB3  ASN 172           HB3      ASN 172  12.824   7.489   3.384
 1202   HD21  ASN 172          HD21      ASN 172  13.081   9.979   1.109
 1203   HD22  ASN 172          HD22      ASN 172  11.886  11.038   1.777
 1204    H    TRP 173           H        TRP 173  16.351   8.071   5.573
 1205    HA   TRP 173           HA       TRP 173  17.124   5.503   4.477
 1206    HB2  TRP 173           HB2      TRP 173  18.164   7.337   6.605
 1207    HB3  TRP 173           HB3      TRP 173  18.587   5.628   6.678
 1208    HD1  TRP 173           HD1      TRP 173  19.200   8.805   4.650
 1209    HE1  TRP 173           HE1      TRP 173  21.239   8.439   3.140
 1210    HE3  TRP 173           HE3      TRP 173  19.894   3.803   5.435
 1211    HZ2  TRP 173           HZ2      TRP 173  22.926   6.307   2.369
 1212    HZ3  TRP 173           HZ3      TRP 173  21.744   2.676   4.270
 1213    HH2  TRP 173           HH2      TRP 173  23.227   3.903   2.769
 1214    H    LEU 174           H        LEU 174  15.493   4.103   4.843
 1215    HA   LEU 174           HA       LEU 174  13.643   4.354   6.934
 1216    HB2  LEU 174           HB2      LEU 174  14.245   1.941   5.239
 1217    HB3  LEU 174           HB3      LEU 174  12.828   2.153   6.245
 1218    HG   LEU 174           HG       LEU 174  13.513   3.508   3.662
 1219   HD11  LEU 174          HD11      LEU 174  11.156   2.784   3.191
 1220   HD12  LEU 174          HD12      LEU 174  12.306   1.475   3.459
 1221   HD13  LEU 174          HD13      LEU 174  11.186   1.935   4.739
 1222   HD21  LEU 174          HD21      LEU 174  12.891   5.362   5.018
 1223   HD22  LEU 174          HD22      LEU 174  11.469   4.936   4.063
 1224   HD23  LEU 174          HD23      LEU 174  11.572   4.461   5.761
 1225    H    ASP 175           H        ASP 175  13.666   3.805   8.894
 1226    HA   ASP 175           HA       ASP 175  15.903   2.568  10.179
 1227    HB2  ASP 175           HB2      ASP 175  14.755   4.337  11.304
 1228    HB3  ASP 175           HB3      ASP 175  13.200   3.540  11.110
 1229    H    HIS 176           H        HIS 176  13.058   1.396   8.782
 1230    HA   HIS 176           HA       HIS 176  12.280  -0.731   8.489
 1231    HB2  HIS 176           HB2      HIS 176  14.333  -1.451  10.559
 1232    HB3  HIS 176           HB3      HIS 176  13.106  -2.607  10.057
 1233    HD1  HIS 176           HD1      HIS 176  13.353  -3.666   7.761
 1234    HD2  HIS 176           HD2      HIS 176  16.303  -0.879   8.626
 1235    HE1  HIS 176           HE1      HIS 176  15.043  -3.884   5.913
 1236    HE2  HIS 176           HE2      HIS 176  16.968  -2.441   6.672
 1237    H    GLY 177           H        GLY 177  11.741   1.343  10.820
 1238    HA2  GLY 177           HA2      GLY 177   9.799  -0.399  12.222
 1239    HA3  GLY 177           HA3      GLY 177  10.566   1.000  12.964
 1240    H    ARG 178           H        ARG 178  10.305   2.442  10.383
 1241    HA   ARG 178           HA       ARG 178   7.732   3.614  10.857
 1242    HB2  ARG 178           HB2      ARG 178   9.610   5.049  10.336
 1243    HB3  ARG 178           HB3      ARG 178   9.923   4.170   8.845
 1244    HG2  ARG 178           HG2      ARG 178   8.860   6.090   8.124
 1245    HG3  ARG 178           HG3      ARG 178   7.565   4.895   8.168
 1246    HD2  ARG 178           HD2      ARG 178   6.557   6.678   9.209
 1247    HD3  ARG 178           HD3      ARG 178   7.208   5.797  10.591
 1248    HE   ARG 178           HE       ARG 178   9.083   7.706   9.646
 1249   HH11  ARG 178          HH11      ARG 178   6.183   7.351  11.559
 1250   HH12  ARG 178          HH12      ARG 178   6.351   8.887  12.358
 1251   HH21  ARG 178          HH21      ARG 178   9.327   9.734  10.674
 1252   HH22  ARG 178          HH22      ARG 178   8.156  10.238  11.857
 1253    H    THR 179           H        THR 179   5.882   3.267   9.701
 1254    HA   THR 179           HA       THR 179   5.945   1.317   7.558
 1255    HB   THR 179           HB       THR 179   4.069   1.282   9.149
 1256    HG1  THR 179           HG1      THR 179   3.680   0.432   7.095
 1257   HG21  THR 179          HG21      THR 179   3.290   3.915   7.899
 1258   HG22  THR 179          HG22      THR 179   3.830   3.677   9.561
 1259   HG23  THR 179          HG23      THR 179   2.302   2.979   9.021
 1260    H    LEU 180           H        LEU 180   4.603   1.889   5.549
 1261    HA   LEU 180           HA       LEU 180   6.293   3.886   4.347
 1262    HB2  LEU 180           HB2      LEU 180   4.278   2.162   2.942
 1263    HB3  LEU 180           HB3      LEU 180   5.779   2.825   2.312
 1264    HG   LEU 180           HG       LEU 180   5.538   0.643   4.389
 1265   HD11  LEU 180          HD11      LEU 180   6.642  -0.730   2.634
 1266   HD12  LEU 180          HD12      LEU 180   4.984  -0.241   2.266
 1267   HD13  LEU 180          HD13      LEU 180   6.339   0.586   1.498
 1268   HD21  LEU 180          HD21      LEU 180   7.963   0.453   4.209
 1269   HD22  LEU 180          HD22      LEU 180   7.997   1.851   3.136
 1270   HD23  LEU 180          HD23      LEU 180   7.481   2.039   4.812
 1271    H    ARG 181           H        ARG 181   2.869   3.436   4.956
 1272    HA   ARG 181           HA       ARG 181   1.945   5.604   3.390
 1273    HB2  ARG 181           HB2      ARG 181   0.477   3.801   4.159
 1274    HB3  ARG 181           HB3      ARG 181   0.724   4.291   5.826
 1275    HG2  ARG 181           HG2      ARG 181  -1.454   4.980   4.810
 1276    HG3  ARG 181           HG3      ARG 181  -0.507   6.289   5.517
 1277    HD2  ARG 181           HD2      ARG 181  -1.585   6.744   3.268
 1278    HD3  ARG 181           HD3      ARG 181   0.132   7.111   3.415
 1279    HE   ARG 181           HE       ARG 181  -0.245   4.483   2.417
 1280   HH11  ARG 181          HH11      ARG 181  -0.498   7.841   1.470
 1281   HH12  ARG 181          HH12      ARG 181  -0.088   7.538  -0.197
 1282   HH21  ARG 181          HH21      ARG 181   0.283   4.066   0.261
 1283   HH22  ARG 181          HH22      ARG 181   0.337   5.371  -0.896
 1284    H    GLU 182           H        GLU 182   3.421   5.386   6.491
 1285    HA   GLU 182           HA       GLU 182   2.581   8.006   7.408
 1286    HB2  GLU 182           HB2      GLU 182   3.005   6.095   8.949
 1287    HB3  GLU 182           HB3      GLU 182   4.691   6.092   8.465
 1288    HG2  GLU 182           HG2      GLU 182   4.564   7.152  10.557
 1289    HG3  GLU 182           HG3      GLU 182   4.862   8.416   9.364
 1290    H    GLN 183           H        GLN 183   4.899   6.797   5.279
 1291    HA   GLN 183           HA       GLN 183   6.707   9.071   5.624
 1292    HB2  GLN 183           HB2      GLN 183   6.841   6.901   3.530
 1293    HB3  GLN 183           HB3      GLN 183   8.131   7.983   4.049
 1294    HG2  GLN 183           HG2      GLN 183   8.437   6.863   6.049
 1295    HG3  GLN 183           HG3      GLN 183   6.855   6.093   5.972
 1296   HE21  GLN 183          HE21      GLN 183   9.405   4.895   6.407
 1297   HE22  GLN 183          HE22      GLN 183   9.615   3.718   5.158
 1298    H    GLY 184           H        GLY 184   4.121   7.898   3.653
 1299    HA2  GLY 184           HA2      GLY 184   2.862   8.995   2.062
 1300    HA3  GLY 184           HA3      GLY 184   3.868  10.417   2.302
 1301    H    VAL 185           H        VAL 185   5.580   7.528   1.693
 1302    HA   VAL 185           HA       VAL 185   6.766   8.468  -0.650
 1303    HB   VAL 185           HB       VAL 185   7.621   6.164  -0.936
 1304   HG11  VAL 185          HG11      VAL 185   8.736   7.732   0.563
 1305   HG12  VAL 185          HG12      VAL 185   7.705   7.202   1.894
 1306   HG13  VAL 185          HG13      VAL 185   8.859   6.081   1.170
 1307   HG21  VAL 185          HG21      VAL 185   5.632   4.934  -0.205
 1308   HG22  VAL 185          HG22      VAL 185   7.057   4.446   0.712
 1309   HG23  VAL 185          HG23      VAL 185   5.868   5.527   1.440
 1310    H    GLU 186           H        GLU 186   6.296   8.326  -2.739
 1311    HA   GLU 186           HA       GLU 186   3.717   7.249  -3.518
 1312    HB2  GLU 186           HB2      GLU 186   5.714   9.004  -4.960
 1313    HB3  GLU 186           HB3      GLU 186   4.194   8.463  -5.656
 1314    HG2  GLU 186           HG2      GLU 186   4.263   9.981  -3.079
 1315    HG3  GLU 186           HG3      GLU 186   4.317  10.808  -4.634
 1316    H    GLU 187           H        GLU 187   3.805   6.354  -5.890
 1317    HA   GLU 187           HA       GLU 187   5.439   3.994  -5.738
 1318    HB2  GLU 187           HB2      GLU 187   3.454   5.003  -7.759
 1319    HB3  GLU 187           HB3      GLU 187   4.319   3.488  -7.953
 1320    HG2  GLU 187           HG2      GLU 187   2.275   2.847  -7.069
 1321    HG3  GLU 187           HG3      GLU 187   3.344   2.861  -5.671
 1322    H    HIS 188           H        HIS 188   5.510   7.023  -7.430
 1323    HA   HIS 188           HA       HIS 188   7.341   6.146  -9.469
 1324    HB2  HIS 188           HB2      HIS 188   7.388   8.522 -10.147
 1325    HB3  HIS 188           HB3      HIS 188   5.754   7.890 -10.007
 1326    HD1  HIS 188           HD1      HIS 188   4.178   9.326  -8.765
 1327    HD2  HIS 188           HD2      HIS 188   8.125  10.103  -7.701
 1328    HE1  HIS 188           HE1      HIS 188   4.089  11.303  -7.219
 1329    HE2  HIS 188           HE2      HIS 188   6.499  11.927  -6.851
 1330    H    GLU 189           H        GLU 189   7.904   6.535  -6.331
 1331    HA   GLU 189           HA       GLU 189  10.245   8.242  -6.454
 1332    HB2  GLU 189           HB2      GLU 189   9.140   6.613  -4.163
 1333    HB3  GLU 189           HB3      GLU 189  10.389   7.844  -4.054
 1334    HG2  GLU 189           HG2      GLU 189   7.592   8.394  -4.994
 1335    HG3  GLU 189           HG3      GLU 189   8.126   8.564  -3.322
 1336    H    THR 190           H        THR 190  12.280   7.516  -6.823
 1337    HA   THR 190           HA       THR 190  12.831   4.724  -6.975
 1338    HB   THR 190           HB       THR 190  14.813   7.008  -6.965
 1339    HG1  THR 190           HG1      THR 190  13.001   6.091  -8.873
 1340   HG21  THR 190          HG21      THR 190  15.829   4.804  -6.629
 1341   HG22  THR 190          HG22      THR 190  16.227   5.443  -8.225
 1342   HG23  THR 190          HG23      THR 190  14.992   4.194  -8.059
 1343    H    LEU 191           H        LEU 191  13.326   3.415  -5.374
 1344    HA   LEU 191           HA       LEU 191  14.433   4.567  -2.891
 1345    HB2  LEU 191           HB2      LEU 191  13.122   1.865  -3.003
 1346    HB3  LEU 191           HB3      LEU 191  13.396   2.886  -1.612
 1347    HG   LEU 191           HG       LEU 191  11.116   3.007  -1.855
 1348   HD11  LEU 191          HD11      LEU 191  12.057   5.294  -3.566
 1349   HD12  LEU 191          HD12      LEU 191  10.504   5.187  -2.736
 1350   HD13  LEU 191          HD13      LEU 191  12.000   5.269  -1.804
 1351   HD21  LEU 191          HD21      LEU 191   9.927   3.167  -3.985
 1352   HD22  LEU 191          HD22      LEU 191  11.469   3.107  -4.839
 1353   HD23  LEU 191          HD23      LEU 191  10.934   1.723  -3.886
 1354    H    LEU 192           H        LEU 192  16.338   3.639  -2.084
 1355    HA   LEU 192           HA       LEU 192  17.605   1.760  -3.963
 1356    HB2  LEU 192           HB2      LEU 192  19.202   3.386  -2.054
 1357    HB3  LEU 192           HB3      LEU 192  19.592   2.869  -3.681
 1358    HG   LEU 192           HG       LEU 192  17.540   5.002  -3.132
 1359   HD11  LEU 192          HD11      LEU 192  19.260   6.653  -3.567
 1360   HD12  LEU 192          HD12      LEU 192  19.671   5.687  -2.149
 1361   HD13  LEU 192          HD13      LEU 192  20.476   5.379  -3.688
 1362   HD21  LEU 192          HD21      LEU 192  17.474   3.939  -5.335
 1363   HD22  LEU 192          HD22      LEU 192  17.984   5.625  -5.442
 1364   HD23  LEU 192          HD23      LEU 192  19.176   4.330  -5.576
 1365    H    LEU 193           H        LEU 193  18.189  -0.194  -3.186
 1366    HA   LEU 193           HA       LEU 193  17.999  -0.732  -0.352
 1367    HB2  LEU 193           HB2      LEU 193  17.241  -2.331  -2.126
 1368    HB3  LEU 193           HB3      LEU 193  18.911  -2.523  -2.614
 1369    HG   LEU 193           HG       LEU 193  18.125  -3.144   0.211
 1370   HD11  LEU 193          HD11      LEU 193  17.647  -5.437  -0.444
 1371   HD12  LEU 193          HD12      LEU 193  16.511  -4.325  -1.207
 1372   HD13  LEU 193          HD13      LEU 193  17.843  -5.006  -2.142
 1373   HD21  LEU 193          HD21      LEU 193  20.496  -3.110  -0.411
 1374   HD22  LEU 193          HD22      LEU 193  19.959  -4.737   0.014
 1375   HD23  LEU 193          HD23      LEU 193  20.176  -4.295  -1.680
 1376    H    ARG 194           H        ARG 194  19.689  -0.685   1.041
 1377    HA   ARG 194           HA       ARG 194  22.383  -0.439  -0.116
 1378    HB2  ARG 194           HB2      ARG 194  21.118   1.214   2.059
 1379    HB3  ARG 194           HB3      ARG 194  22.860   1.107   1.859
 1380    HG2  ARG 194           HG2      ARG 194  20.898   2.138  -0.176
 1381    HG3  ARG 194           HG3      ARG 194  21.983   3.107   0.820
 1382    HD2  ARG 194           HD2      ARG 194  22.733   1.147  -1.337
 1383    HD3  ARG 194           HD3      ARG 194  22.941   2.900  -1.358
 1384    HE   ARG 194           HE       ARG 194  24.429   2.282   0.745
 1385   HH11  ARG 194          HH11      ARG 194  24.230   0.679  -2.375
 1386   HH12  ARG 194          HH12      ARG 194  25.894   0.186  -2.365
 1387   HH21  ARG 194          HH21      ARG 194  26.618   1.607   0.772
 1388   HH22  ARG 194          HH22      ARG 194  27.250   0.677  -0.561
 1389    H    ARG 195           H        ARG 195  24.069  -1.282   1.054
 1390    HA   ARG 195           HA       ARG 195  23.352  -3.359   2.941
 1391    HB2  ARG 195           HB2      ARG 195  25.019  -3.672   1.068
 1392    HB3  ARG 195           HB3      ARG 195  26.101  -2.599   1.944
 1393    HG2  ARG 195           HG2      ARG 195  26.094  -4.139   3.838
 1394    HG3  ARG 195           HG3      ARG 195  25.020  -5.219   2.949
 1395    HD2  ARG 195           HD2      ARG 195  26.784  -5.335   1.164
 1396    HD3  ARG 195           HD3      ARG 195  27.855  -4.471   2.269
 1397    HE   ARG 195           HE       ARG 195  26.700  -6.757   3.511
 1398   HH11  ARG 195          HH11      ARG 195  29.193  -5.808   1.231
 1399   HH12  ARG 195          HH12      ARG 195  30.180  -7.205   1.547
 1400   HH21  ARG 195          HH21      ARG 195  27.975  -8.577   3.907
 1401   HH22  ARG 195          HH22      ARG 195  29.488  -8.784   3.083
 1402    H    LYS 196           H        LYS 196  23.298  -2.986   5.058
 1403    HA   LYS 196           HA       LYS 196  24.453  -0.533   6.095
 1404    HB2  LYS 196           HB2      LYS 196  22.207  -1.033   6.810
 1405    HB3  LYS 196           HB3      LYS 196  22.686  -2.633   7.359
 1406    HG2  LYS 196           HG2      LYS 196  24.014  -1.672   9.134
 1407    HG3  LYS 196           HG3      LYS 196  23.673  -0.045   8.545
 1408    HD2  LYS 196           HD2      LYS 196  22.289  -0.660  10.491
 1409    HD3  LYS 196           HD3      LYS 196  21.323  -0.314   9.056
 1410    HE2  LYS 196           HE2      LYS 196  21.052  -2.687   8.635
 1411    HE3  LYS 196           HE3      LYS 196  22.095  -3.072  10.003
 1412    HZ1  LYS 196           HZ1      LYS 196  19.705  -3.269  10.505
 1413    HZ2  LYS 196           HZ2      LYS 196  19.518  -1.606  10.220
 1414    HZ3  LYS 196           HZ3      LYS 196  20.494  -2.146  11.501
 1415    H    PHE 197           H        PHE 197  24.690  -4.032   6.704
 1416    HA   PHE 197           HA       PHE 197  26.951  -3.547   8.477
 1417    HB2  PHE 197           HB2      PHE 197  25.647  -6.167   7.725
 1418    HB3  PHE 197           HB3      PHE 197  26.906  -5.944   8.934
 1419    HD1  PHE 197           HD1      PHE 197  26.039  -3.639  10.417
 1420    HD2  PHE 197           HD2      PHE 197  23.724  -6.830   8.822
 1421    HE1  PHE 197           HE1      PHE 197  24.330  -3.245  12.140
 1422    HE2  PHE 197           HE2      PHE 197  22.001  -6.439  10.535
 1423    HZ   PHE 197           HZ       PHE 197  22.293  -4.732  12.208
 1424    H    PHE 198           H        PHE 198  28.993  -4.109   8.071
 1425    HA   PHE 198           HA       PHE 198  29.586  -5.371   5.480
 1426    HB2  PHE 198           HB2      PHE 198  31.029  -3.033   6.749
 1427    HB3  PHE 198           HB3      PHE 198  31.682  -3.972   5.410
 1428    HD1  PHE 198           HD1      PHE 198  30.539  -3.932   3.206
 1429    HD2  PHE 198           HD2      PHE 198  29.378  -1.376   6.405
 1430    HE1  PHE 198           HE1      PHE 198  29.341  -2.492   1.614
 1431    HE2  PHE 198           HE2      PHE 198  28.174   0.068   4.817
 1432    HZ   PHE 198           HZ       PHE 198  28.154  -0.498   2.411
 1433    H    TYR 199           H        TYR 199  29.376  -7.153   7.103
 1434    HA   TYR 199           HA       TYR 199  31.393  -7.448   9.092
 1435    HB2  TYR 199           HB2      TYR 199  30.479  -9.807   9.232
 1436    HB3  TYR 199           HB3      TYR 199  29.331  -8.513   9.538
 1437    HD1  TYR 199           HD1      TYR 199  30.358 -11.121   7.142
 1438    HD2  TYR 199           HD2      TYR 199  27.438  -8.162   8.081
 1439    HE1  TYR 199           HE1      TYR 199  28.870 -12.048   5.424
 1440    HE2  TYR 199           HE2      TYR 199  25.946  -9.092   6.367
 1441    HH   TYR 199           HH       TYR 199  26.638 -12.099   4.745
 1442    H    SER 200           H        SER 200  31.153  -8.237   5.755
 1443    HA   SER 200           HA       SER 200  32.475  -9.317   4.280
 1444    HB2  SER 200           HB2      SER 200  34.002  -7.487   5.063
 1445    HB3  SER 200           HB3      SER 200  34.714  -8.636   6.192
 1446    HG   SER 200           HG       SER 200  34.568  -9.578   3.619
 1447    H    ASP 201           H        ASP 201  31.304 -11.253   5.086
 1448    HA   ASP 201           HA       ASP 201  31.320 -13.498   5.299
 1449    HB2  ASP 201           HB2      ASP 201  33.294 -13.490   3.901
 1450    HB3  ASP 201           HB3      ASP 201  34.317 -13.151   5.289
 1451    H    GLN 202           H        GLN 202  32.754 -11.531   7.691
 1452    HA   GLN 202           HA       GLN 202  33.225 -13.566   9.636
 1453    HB2  GLN 202           HB2      GLN 202  34.305 -11.294   9.624
 1454    HB3  GLN 202           HB3      GLN 202  32.760 -10.622  10.123
 1455    HG2  GLN 202           HG2      GLN 202  34.061 -10.843  12.075
 1456    HG3  GLN 202           HG3      GLN 202  32.861 -12.135  12.124
 1457   HE21  GLN 202          HE21      GLN 202  33.528 -14.271  11.821
 1458   HE22  GLN 202          HE22      GLN 202  35.191 -14.742  11.942
  Start of MODEL   20
    1    H1   GLY  -5           H1       GLY  -5 -30.736 -11.110  -8.112
    2    H2   GLY  -5           H2       GLY  -5 -30.181 -11.884  -6.704
    3    H3   GLY  -5           H3       GLY  -5 -29.195 -10.759  -7.499
    4    HA2  GLY  -5           HA2      GLY  -5 -30.721  -8.976  -6.978
    5    HA3  GLY  -5           HA3      GLY  -5 -31.778 -10.135  -6.182
    6    H    ILE  -4           H        ILE  -4 -30.354  -7.742  -5.136
    7    HA   ILE  -4           HA       ILE  -4 -28.847  -9.115  -3.004
    8    HB   ILE  -4           HB       ILE  -4 -27.522  -7.018  -2.730
    9   HG12  ILE  -4          HG12      ILE  -4 -28.713  -6.292  -5.417
   10   HG13  ILE  -4          HG13      ILE  -4 -29.106  -5.505  -3.893
   11   HG21  ILE  -4          HG21      ILE  -4 -27.284  -8.391  -5.402
   12   HG22  ILE  -4          HG22      ILE  -4 -26.019  -7.450  -4.613
   13   HG23  ILE  -4          HG23      ILE  -4 -26.592  -8.946  -3.877
   14   HD11  ILE  -4          HD11      ILE  -4 -26.785  -4.758  -3.694
   15   HD12  ILE  -4          HD12      ILE  -4 -26.412  -5.533  -5.234
   16   HD13  ILE  -4          HD13      ILE  -4 -27.541  -4.180  -5.178
   17    H    ASP  -3           H        ASP  -3 -29.148  -8.390  -0.910
   18    HA   ASP  -3           HA       ASP  -3 -31.291  -6.402  -0.556
   19    HB2  ASP  -3           HB2      ASP  -3 -31.948  -7.504   1.488
   20    HB3  ASP  -3           HB3      ASP  -3 -31.906  -8.700   0.201
   21    HA   PRO  -2           HA       PRO  -2 -28.017  -4.136   1.400
   22    HB2  PRO  -2           HB2      PRO  -2 -29.836  -1.966   1.843
   23    HB3  PRO  -2           HB3      PRO  -2 -28.607  -2.114   0.586
   24    HG2  PRO  -2           HG2      PRO  -2 -31.332  -2.112   0.131
   25    HG3  PRO  -2           HG3      PRO  -2 -30.120  -2.779  -0.976
   26    HD2  PRO  -2           HD2      PRO  -2 -31.886  -4.192   0.979
   27    HD3  PRO  -2           HD3      PRO  -2 -31.371  -4.693  -0.646
   28    H    PHE  -1           H        PHE  -1 -27.525  -3.246   3.459
   29    HA   PHE  -1           HA       PHE  -1 -29.060  -4.282   5.655
   30    HB2  PHE  -1           HB2      PHE  -1 -26.521  -4.217   5.544
   31    HB3  PHE  -1           HB3      PHE  -1 -26.647  -2.478   5.791
   32    HD1  PHE  -1           HD1      PHE  -1 -28.525  -5.296   7.331
   33    HD2  PHE  -1           HD2      PHE  -1 -25.851  -2.045   7.885
   34    HE1  PHE  -1           HE1      PHE  -1 -28.619  -5.647   9.768
   35    HE2  PHE  -1           HE2      PHE  -1 -25.936  -2.380  10.325
   36    HZ   PHE  -1           HZ       PHE  -1 -27.330  -4.231  11.261
   37    H    THR   0           H        THR   0 -30.882  -2.970   4.775
   38    HA   THR   0           HA       THR   0 -32.332  -1.224   4.848
   39    HB   THR   0           HB       THR   0 -32.498  -0.020   7.015
   40    HG1  THR   0           HG1      THR   0 -29.933  -0.926   7.272
   41   HG21  THR   0          HG21      THR   0 -32.992  -1.987   8.389
   42   HG22  THR   0          HG22      THR   0 -32.094  -3.000   7.260
   43   HG23  THR   0          HG23      THR   0 -33.571  -2.193   6.736
   44    H    MET   1           H        MET   1 -31.888   1.380   6.194
   45    HA   MET   1           HA       MET   1 -30.146   2.495   4.139
   46    HB2  MET   1           HB2      MET   1 -32.490   3.371   4.493
   47    HB3  MET   1           HB3      MET   1 -31.939   4.012   6.033
   48    HG2  MET   1           HG2      MET   1 -31.956   5.756   4.382
   49    HG3  MET   1           HG3      MET   1 -30.297   5.404   4.854
   50    HE1  MET   1           HE1      MET   1 -28.625   4.065   1.721
   51    HE2  MET   1           HE2      MET   1 -28.432   5.034   3.182
   52    HE3  MET   1           HE3      MET   1 -28.952   3.354   3.301
   53    H    VAL   2           H        VAL   2 -28.888   1.109   6.110
   54    HA   VAL   2           HA       VAL   2 -27.269   3.270   7.216
   55    HB   VAL   2           HB       VAL   2 -26.622   1.836   9.134
   56   HG11  VAL   2          HG11      VAL   2 -29.587   2.357   8.934
   57   HG12  VAL   2          HG12      VAL   2 -28.692   2.071  10.427
   58   HG13  VAL   2          HG13      VAL   2 -28.355   3.505   9.460
   59   HG21  VAL   2          HG21      VAL   2 -28.816   0.015   8.127
   60   HG22  VAL   2          HG22      VAL   2 -27.091  -0.347   8.172
   61   HG23  VAL   2          HG23      VAL   2 -27.988  -0.143   9.676
   62    H    ALA   3           H        ALA   3 -27.416   1.570   4.875
   63    HA   ALA   3           HA       ALA   3 -24.986  -0.027   5.043
   64    HB1  ALA   3           HB1      ALA   3 -26.987   0.180   2.799
   65    HB2  ALA   3           HB2      ALA   3 -25.632  -0.944   2.894
   66    HB3  ALA   3           HB3      ALA   3 -26.968  -1.075   4.038
   67    H    LEU   4           H        LEU   4 -23.590   1.655   5.181
   68    HA   LEU   4           HA       LEU   4 -22.938   3.801   3.965
   69    HB2  LEU   4           HB2      LEU   4 -21.306   1.339   4.305
   70    HB3  LEU   4           HB3      LEU   4 -20.584   2.753   3.564
   71    HG   LEU   4           HG       LEU   4 -20.976   4.050   5.586
   72   HD11  LEU   4          HD11      LEU   4 -22.186   1.550   6.736
   73   HD12  LEU   4          HD12      LEU   4 -21.822   3.030   7.624
   74   HD13  LEU   4          HD13      LEU   4 -23.044   3.045   6.355
   75   HD21  LEU   4          HD21      LEU   4 -19.718   1.387   6.164
   76   HD22  LEU   4          HD22      LEU   4 -18.923   2.765   5.401
   77   HD23  LEU   4          HD23      LEU   4 -19.460   2.873   7.077
   78    H    SER   5           H        SER   5 -23.198   4.631   2.109
   79    HA   SER   5           HA       SER   5 -23.023   3.029  -0.338
   80    HB2  SER   5           HB2      SER   5 -24.025   5.865   0.072
   81    HB3  SER   5           HB3      SER   5 -24.014   5.007  -1.460
   82    HG   SER   5           HG       SER   5 -25.408   4.184   0.870
   83    H    LEU   6           H        LEU   6 -20.971   2.860  -0.983
   84    HA   LEU   6           HA       LEU   6 -19.192   5.155  -0.484
   85    HB2  LEU   6           HB2      LEU   6 -18.371   2.258  -0.674
   86    HB3  LEU   6           HB3      LEU   6 -17.396   3.614  -0.126
   87    HG   LEU   6           HG       LEU   6 -19.771   2.431   1.321
   88   HD11  LEU   6          HD11      LEU   6 -17.792   1.018   1.411
   89   HD12  LEU   6          HD12      LEU   6 -16.830   2.386   1.972
   90   HD13  LEU   6          HD13      LEU   6 -18.126   1.745   2.983
   91   HD21  LEU   6          HD21      LEU   6 -17.952   4.707   2.092
   92   HD22  LEU   6          HD22      LEU   6 -19.671   4.814   1.698
   93   HD23  LEU   6          HD23      LEU   6 -19.148   3.952   3.145
   94    H    LYS   7           H        LYS   7 -17.961   5.894  -2.117
   95    HA   LYS   7           HA       LYS   7 -18.404   4.821  -4.767
   96    HB2  LYS   7           HB2      LYS   7 -16.971   7.207  -3.673
   97    HB3  LYS   7           HB3      LYS   7 -16.598   6.650  -5.299
   98    HG2  LYS   7           HG2      LYS   7 -19.042   6.804  -5.809
   99    HG3  LYS   7           HG3      LYS   7 -19.244   7.593  -4.242
  100    HD2  LYS   7           HD2      LYS   7 -17.897   9.424  -4.882
  101    HD3  LYS   7           HD3      LYS   7 -17.302   8.581  -6.313
  102    HE2  LYS   7           HE2      LYS   7 -18.946  10.247  -6.944
  103    HE3  LYS   7           HE3      LYS   7 -19.556   8.621  -7.262
  104    HZ1  LYS   7           HZ1      LYS   7 -20.929   8.723  -5.345
  105    HZ2  LYS   7           HZ2      LYS   7 -21.187  10.159  -6.207
  106    HZ3  LYS   7           HZ3      LYS   7 -20.218  10.168  -4.815
  107    H    ILE   8           H        ILE   8 -17.370   3.032  -5.292
  108    HA   ILE   8           HA       ILE   8 -14.774   2.431  -4.154
  109    HB   ILE   8           HB       ILE   8 -16.453   0.863  -6.118
  110   HG12  ILE   8          HG12      ILE   8 -17.553   1.065  -3.949
  111   HG13  ILE   8          HG13      ILE   8 -16.972  -0.580  -4.185
  112   HG21  ILE   8          HG21      ILE   8 -14.096   0.324  -6.315
  113   HG22  ILE   8          HG22      ILE   8 -13.993   0.062  -4.574
  114   HG23  ILE   8          HG23      ILE   8 -14.975  -1.013  -5.570
  115   HD11  ILE   8          HD11      ILE   8 -16.581   0.168  -1.916
  116   HD12  ILE   8          HD12      ILE   8 -15.051  -0.098  -2.754
  117   HD13  ILE   8          HD13      ILE   8 -15.651   1.543  -2.511
  118    H    SER   9           H        SER   9 -13.242   3.665  -5.042
  119    HA   SER   9           HA       SER   9 -13.171   4.039  -7.932
  120    HB2  SER   9           HB2      SER   9 -12.737   6.021  -6.607
  121    HB3  SER   9           HB3      SER   9 -11.480   5.190  -5.700
  122    HG   SER   9           HG       SER   9 -10.119   5.616  -7.234
  123    H    ILE  10           H        ILE  10 -12.000   2.750  -9.201
  124    HA   ILE  10           HA       ILE  10  -9.815   1.204  -7.962
  125    HB   ILE  10           HB       ILE  10 -11.601   0.206 -10.191
  126   HG12  ILE  10          HG12      ILE  10 -11.641  -0.623  -7.281
  127   HG13  ILE  10          HG13      ILE  10 -12.791   0.506  -7.989
  128   HG21  ILE  10          HG21      ILE  10  -9.551  -1.187  -8.470
  129   HG22  ILE  10          HG22      ILE  10 -10.562  -1.959  -9.691
  130   HG23  ILE  10          HG23      ILE  10  -9.363  -0.758 -10.170
  131   HD11  ILE  10          HD11      ILE  10 -12.412  -2.364  -8.808
  132   HD12  ILE  10          HD12      ILE  10 -13.720  -1.732  -7.807
  133   HD13  ILE  10          HD13      ILE  10 -13.581  -1.235  -9.494
  134    H    GLY  11           H        GLY  11  -8.292   2.716  -8.647
  135    HA2  GLY  11           HA2      GLY  11  -6.718   3.537 -10.121
  136    HA3  GLY  11           HA3      GLY  11  -7.425   2.518 -11.369
  137    H    ASN  12           H        ASN  12  -9.215   3.287 -12.550
  138    HA   ASN  12           HA       ASN  12  -9.510   6.220 -12.490
  139    HB2  ASN  12           HB2      ASN  12  -8.464   5.495 -14.554
  140    HB3  ASN  12           HB3      ASN  12  -9.723   4.292 -14.814
  141   HD21  ASN  12          HD21      ASN  12 -11.706   4.923 -15.623
  142   HD22  ASN  12          HD22      ASN  12 -11.990   6.509 -16.264
  143    H    VAL  13           H        VAL  13 -11.200   3.182 -13.147
  144    HA   VAL  13           HA       VAL  13 -13.778   4.274 -13.421
  145    HB   VAL  13           HB       VAL  13 -13.139   2.024 -14.221
  146   HG11  VAL  13          HG11      VAL  13 -13.060   0.137 -12.666
  147   HG12  VAL  13          HG12      VAL  13 -11.773   1.301 -12.352
  148   HG13  VAL  13          HG13      VAL  13 -13.195   1.254 -11.308
  149   HG21  VAL  13          HG21      VAL  13 -15.496   2.555 -13.975
  150   HG22  VAL  13          HG22      VAL  13 -15.203   0.859 -13.591
  151   HG23  VAL  13          HG23      VAL  13 -15.458   2.026 -12.293
  152    H    VAL  14           H        VAL  14 -15.535   4.291 -12.000
  153    HA   VAL  14           HA       VAL  14 -14.967   3.809  -9.176
  154    HB   VAL  14           HB       VAL  14 -14.651   6.172  -9.290
  155   HG11  VAL  14          HG11      VAL  14 -16.312   7.715 -10.189
  156   HG12  VAL  14          HG12      VAL  14 -15.698   6.621 -11.428
  157   HG13  VAL  14          HG13      VAL  14 -17.291   6.349 -10.723
  158   HG21  VAL  14          HG21      VAL  14 -16.497   7.020  -7.881
  159   HG22  VAL  14          HG22      VAL  14 -17.413   5.559  -8.248
  160   HG23  VAL  14          HG23      VAL  14 -15.897   5.445  -7.354
  161    H    LYS  15           H        LYS  15 -16.413   2.550  -8.347
  162    HA   LYS  15           HA       LYS  15 -19.037   2.308  -9.669
  163    HB2  LYS  15           HB2      LYS  15 -17.379   0.213  -8.246
  164    HB3  LYS  15           HB3      LYS  15 -19.044  -0.034  -8.750
  165    HG2  LYS  15           HG2      LYS  15 -16.763   0.600 -10.614
  166    HG3  LYS  15           HG3      LYS  15 -17.396  -1.018 -10.300
  167    HD2  LYS  15           HD2      LYS  15 -19.599  -0.293 -11.127
  168    HD3  LYS  15           HD3      LYS  15 -18.929   1.302 -11.476
  169    HE2  LYS  15           HE2      LYS  15 -19.004   0.017 -13.508
  170    HE3  LYS  15           HE3      LYS  15 -17.323   0.239 -13.031
  171    HZ1  LYS  15           HZ1      LYS  15 -18.858  -2.210 -12.367
  172    HZ2  LYS  15           HZ2      LYS  15 -17.178  -1.987 -12.309
  173    HZ3  LYS  15           HZ3      LYS  15 -17.969  -2.050 -13.800
  174    H    THR  16           H        THR  16 -20.859   2.127  -8.321
  175    HA   THR  16           HA       THR  16 -20.378   3.198  -5.629
  176    HB   THR  16           HB       THR  16 -22.977   3.021  -7.174
  177    HG1  THR  16           HG1      THR  16 -21.139   4.563  -7.821
  178   HG21  THR  16          HG21      THR  16 -23.840   4.545  -5.452
  179   HG22  THR  16          HG22      THR  16 -22.301   4.452  -4.597
  180   HG23  THR  16          HG23      THR  16 -23.314   3.017  -4.747
  181    H    MET  17           H        MET  17 -20.495   1.869  -3.937
  182    HA   MET  17           HA       MET  17 -22.103  -0.570  -4.149
  183    HB2  MET  17           HB2      MET  17 -19.182  -0.355  -3.793
  184    HB3  MET  17           HB3      MET  17 -19.984  -1.397  -2.626
  185    HG2  MET  17           HG2      MET  17 -20.475  -1.693  -5.558
  186    HG3  MET  17           HG3      MET  17 -19.075  -2.429  -4.785
  187    HE1  MET  17           HE1      MET  17 -19.195  -4.318  -2.963
  188    HE2  MET  17           HE2      MET  17 -20.187  -3.302  -1.919
  189    HE3  MET  17           HE3      MET  17 -20.692  -4.954  -2.282
  190    H    GLN  18           H        GLN  18 -22.925  -1.309  -2.197
  191    HA   GLN  18           HA       GLN  18 -22.552   0.542   0.054
  192    HB2  GLN  18           HB2      GLN  18 -24.945  -1.047  -0.822
  193    HB3  GLN  18           HB3      GLN  18 -24.809  -0.388   0.806
  194    HG2  GLN  18           HG2      GLN  18 -24.986   1.768   0.110
  195    HG3  GLN  18           HG3      GLN  18 -24.335   1.420  -1.493
  196   HE21  GLN  18          HE21      GLN  18 -25.956   2.416  -2.579
  197   HE22  GLN  18          HE22      GLN  18 -27.555   1.783  -2.673
  198    H    PHE  19           H        PHE  19 -22.175  -0.250   2.083
  199    HA   PHE  19           HA       PHE  19 -21.775  -3.127   2.375
  200    HB2  PHE  19           HB2      PHE  19 -19.808  -0.944   3.146
  201    HB3  PHE  19           HB3      PHE  19 -19.672  -2.629   3.625
  202    HD1  PHE  19           HD1      PHE  19 -19.345  -0.247   0.869
  203    HD2  PHE  19           HD2      PHE  19 -18.944  -4.302   2.084
  204    HE1  PHE  19           HE1      PHE  19 -18.026  -0.714  -1.155
  205    HE2  PHE  19           HE2      PHE  19 -17.625  -4.781   0.058
  206    HZ   PHE  19           HZ       PHE  19 -17.164  -2.984  -1.564
  207    H    GLU  20           H        GLU  20 -21.836  -3.705   4.681
  208    HA   GLU  20           HA       GLU  20 -23.615  -2.061   6.194
  209    HB2  GLU  20           HB2      GLU  20 -21.964  -4.443   7.061
  210    HB3  GLU  20           HB3      GLU  20 -23.240  -3.690   8.007
  211    HG2  GLU  20           HG2      GLU  20 -24.221  -5.581   7.050
  212    HG3  GLU  20           HG3      GLU  20 -24.791  -4.223   6.079
  213    HA   PRO  21           HA       PRO  21 -20.908   0.750   8.263
  214    HB2  PRO  21           HB2      PRO  21 -21.992  -0.022  10.856
  215    HB3  PRO  21           HB3      PRO  21 -22.119   1.516  10.005
  216    HG2  PRO  21           HG2      PRO  21 -24.114  -0.481  10.281
  217    HG3  PRO  21           HG3      PRO  21 -24.211   1.017   9.341
  218    HD2  PRO  21           HD2      PRO  21 -24.100  -1.636   8.357
  219    HD3  PRO  21           HD3      PRO  21 -24.037  -0.128   7.424
  220    H    SER  22           H        SER  22 -21.291  -2.513   9.544
  221    HA   SER  22           HA       SER  22 -18.650  -2.461  10.723
  222    HB2  SER  22           HB2      SER  22 -20.464  -4.844  10.272
  223    HB3  SER  22           HB3      SER  22 -19.085  -4.749  11.368
  224    HG   SER  22           HG       SER  22 -21.627  -3.544  11.574
  225    H    THR  23           H        THR  23 -20.104  -4.684   8.343
  226    HA   THR  23           HA       THR  23 -19.177  -6.102   6.865
  227    HB   THR  23           HB       THR  23 -17.837  -3.554   5.974
  228    HG1  THR  23           HG1      THR  23 -20.334  -4.801   5.372
  229   HG21  THR  23          HG21      THR  23 -18.404  -6.110   4.487
  230   HG22  THR  23          HG22      THR  23 -16.812  -5.531   4.976
  231   HG23  THR  23          HG23      THR  23 -17.748  -4.631   3.783
  232    H    MET  24           H        MET  24 -16.399  -3.963   7.381
  233    HA   MET  24           HA       MET  24 -14.301  -4.361   8.179
  234    HB2  MET  24           HB2      MET  24 -15.512  -6.501   9.286
  235    HB3  MET  24           HB3      MET  24 -14.449  -7.314   8.148
  236    HG2  MET  24           HG2      MET  24 -12.542  -6.564   9.189
  237    HG3  MET  24           HG3      MET  24 -13.376  -5.213   9.967
  238    HE1  MET  24           HE1      MET  24 -12.524  -6.945  13.213
  239    HE2  MET  24           HE2      MET  24 -11.595  -6.350  11.834
  240    HE3  MET  24           HE3      MET  24 -12.949  -5.402  12.463
  241    H    VAL  25           H        VAL  25 -12.485  -4.486   7.069
  242    HA   VAL  25           HA       VAL  25 -12.472  -4.288   4.385
  243    HB   VAL  25           HB       VAL  25 -10.214  -5.221   6.135
  244   HG11  VAL  25          HG11      VAL  25 -10.082  -4.301   3.261
  245   HG12  VAL  25          HG12      VAL  25  -8.700  -4.610   4.312
  246   HG13  VAL  25          HG13      VAL  25  -9.761  -5.937   3.833
  247   HG21  VAL  25          HG21      VAL  25 -10.926  -2.573   4.896
  248   HG22  VAL  25          HG22      VAL  25 -11.127  -3.018   6.591
  249   HG23  VAL  25          HG23      VAL  25  -9.510  -2.896   5.897
  250    H    TYR  26           H        TYR  26 -11.546  -7.327   6.048
  251    HA   TYR  26           HA       TYR  26 -11.052  -8.710   3.658
  252    HB2  TYR  26           HB2      TYR  26 -10.945 -10.735   4.965
  253    HB3  TYR  26           HB3      TYR  26 -10.155  -9.430   5.838
  254    HD1  TYR  26           HD1      TYR  26 -11.438  -8.313   7.739
  255    HD2  TYR  26           HD2      TYR  26 -12.676 -11.964   5.940
  256    HE1  TYR  26           HE1      TYR  26 -12.814  -8.814   9.708
  257    HE2  TYR  26           HE2      TYR  26 -14.057 -12.472   7.908
  258    HH   TYR  26           HH       TYR  26 -14.018 -11.800  10.406
  259    H    ASP  27           H        ASP  27 -14.002  -8.233   5.471
  260    HA   ASP  27           HA       ASP  27 -15.514 -10.198   4.022
  261    HB2  ASP  27           HB2      ASP  27 -16.163  -9.539   6.286
  262    HB3  ASP  27           HB3      ASP  27 -16.408  -7.882   5.753
  263    H    ALA  28           H        ALA  28 -15.124  -6.684   3.890
  264    HA   ALA  28           HA       ALA  28 -16.857  -6.140   1.775
  265    HB1  ALA  28           HB1      ALA  28 -15.540  -4.122   1.421
  266    HB2  ALA  28           HB2      ALA  28 -15.792  -4.409   3.143
  267    HB3  ALA  28           HB3      ALA  28 -14.236  -4.787   2.405
  268    H    CYS  29           H        CYS  29 -13.471  -7.107   1.764
  269    HA   CYS  29           HA       CYS  29 -12.889  -6.849  -0.927
  270    HB2  CYS  29           HB2      CYS  29 -11.198  -7.293   0.778
  271    HB3  CYS  29           HB3      CYS  29 -11.853  -8.905   1.034
  272    HG   CYS  29           HG       CYS  29 -10.302  -7.800  -1.818
  273    H    ARG  30           H        ARG  30 -14.667  -9.425   0.687
  274    HA   ARG  30           HA       ARG  30 -14.388 -11.217  -1.543
  275    HB2  ARG  30           HB2      ARG  30 -15.686 -12.781  -0.330
  276    HB3  ARG  30           HB3      ARG  30 -14.622 -11.994   0.824
  277    HG2  ARG  30           HG2      ARG  30 -16.522 -10.543   1.514
  278    HG3  ARG  30           HG3      ARG  30 -17.557 -11.473   0.421
  279    HD2  ARG  30           HD2      ARG  30 -17.107 -13.503   1.636
  280    HD3  ARG  30           HD3      ARG  30 -15.954 -12.668   2.673
  281    HE   ARG  30           HE       ARG  30 -17.978 -11.303   3.377
  282   HH11  ARG  30          HH11      ARG  30 -18.184 -14.645   2.330
  283   HH12  ARG  30          HH12      ARG  30 -19.568 -15.001   3.333
  284   HH21  ARG  30          HH21      ARG  30 -19.750 -11.775   4.711
  285   HH22  ARG  30          HH22      ARG  30 -20.444 -13.373   4.699
  286    H    MET  31           H        MET  31 -16.824  -8.976  -0.383
  287    HA   MET  31           HA       MET  31 -18.815  -9.862  -2.249
  288    HB2  MET  31           HB2      MET  31 -18.740  -7.302  -0.643
  289    HB3  MET  31           HB3      MET  31 -20.140  -8.011  -1.432
  290    HG2  MET  31           HG2      MET  31 -20.056  -9.924   0.038
  291    HG3  MET  31           HG3      MET  31 -18.603  -9.297   0.806
  292    HE1  MET  31           HE1      MET  31 -19.134  -6.229   1.106
  293    HE2  MET  31           HE2      MET  31 -19.790  -6.229   2.746
  294    HE3  MET  31           HE3      MET  31 -18.461  -7.319   2.325
  295    H    ILE  32           H        ILE  32 -16.508  -7.188  -2.076
  296    HA   ILE  32           HA       ILE  32 -17.581  -5.730  -4.228
  297    HB   ILE  32           HB       ILE  32 -16.045  -4.714  -2.637
  298   HG12  ILE  32          HG12      ILE  32 -14.990  -4.684  -5.469
  299   HG13  ILE  32          HG13      ILE  32 -16.330  -3.717  -4.861
  300   HG21  ILE  32          HG21      ILE  32 -13.905  -6.404  -3.923
  301   HG22  ILE  32          HG22      ILE  32 -13.635  -5.116  -2.748
  302   HG23  ILE  32          HG23      ILE  32 -14.516  -6.569  -2.277
  303   HD11  ILE  32          HD11      ILE  32 -13.475  -3.548  -3.950
  304   HD12  ILE  32          HD12      ILE  32 -14.302  -2.411  -5.016
  305   HD13  ILE  32          HD13      ILE  32 -14.815  -2.579  -3.338
  306    H    ARG  33           H        ARG  33 -14.915  -8.084  -4.160
  307    HA   ARG  33           HA       ARG  33 -14.397  -8.109  -6.913
  308    HB2  ARG  33           HB2      ARG  33 -13.979 -10.133  -4.736
  309    HB3  ARG  33           HB3      ARG  33 -13.606 -10.527  -6.410
  310    HG2  ARG  33           HG2      ARG  33 -12.053  -8.641  -6.507
  311    HG3  ARG  33           HG3      ARG  33 -12.423  -8.254  -4.826
  312    HD2  ARG  33           HD2      ARG  33 -11.361 -10.930  -5.695
  313    HD3  ARG  33           HD3      ARG  33 -10.312  -9.589  -5.234
  314    HE   ARG  33           HE       ARG  33 -11.414  -9.662  -3.032
  315   HH11  ARG  33          HH11      ARG  33 -11.601 -12.506  -5.083
  316   HH12  ARG  33          HH12      ARG  33 -11.821 -13.599  -3.742
  317   HH21  ARG  33          HH21      ARG  33 -11.649 -11.102  -1.288
  318   HH22  ARG  33          HH22      ARG  33 -11.821 -12.804  -1.589
  319    H    GLU  34           H        GLU  34 -16.956  -9.492  -5.095
  320    HA   GLU  34           HA       GLU  34 -17.689 -11.578  -6.884
  321    HB2  GLU  34           HB2      GLU  34 -18.405 -11.477  -4.505
  322    HB3  GLU  34           HB3      GLU  34 -19.433 -10.106  -4.897
  323    HG2  GLU  34           HG2      GLU  34 -20.755 -12.108  -4.773
  324    HG3  GLU  34           HG3      GLU  34 -20.710 -11.528  -6.438
  325    H    ARG  35           H        ARG  35 -19.198  -8.408  -6.276
  326    HA   ARG  35           HA       ARG  35 -20.717  -8.596  -8.723
  327    HB2  ARG  35           HB2      ARG  35 -21.327  -6.146  -8.019
  328    HB3  ARG  35           HB3      ARG  35 -21.990  -7.521  -7.149
  329    HG2  ARG  35           HG2      ARG  35 -19.468  -6.672  -6.026
  330    HG3  ARG  35           HG3      ARG  35 -20.645  -5.358  -6.067
  331    HD2  ARG  35           HD2      ARG  35 -21.504  -8.045  -5.101
  332    HD3  ARG  35           HD3      ARG  35 -20.540  -7.025  -4.034
  333    HE   ARG  35           HE       ARG  35 -22.739  -5.585  -5.138
  334   HH11  ARG  35          HH11      ARG  35 -22.035  -8.070  -2.766
  335   HH12  ARG  35          HH12      ARG  35 -23.237  -7.505  -1.635
  336   HH21  ARG  35          HH21      ARG  35 -24.301  -4.843  -3.668
  337   HH22  ARG  35          HH22      ARG  35 -24.504  -5.642  -2.137
  338    H    ILE  36           H        ILE  36 -17.916  -6.718  -7.619
  339    HA   ILE  36           HA       ILE  36 -17.820  -5.384 -10.240
  340    HB   ILE  36           HB       ILE  36 -16.218  -4.705  -7.770
  341   HG12  ILE  36          HG12      ILE  36 -18.742  -3.399  -8.811
  342   HG13  ILE  36          HG13      ILE  36 -18.650  -4.430  -7.386
  343   HG21  ILE  36          HG21      ILE  36 -15.215  -3.938  -9.848
  344   HG22  ILE  36          HG22      ILE  36 -16.735  -3.174 -10.316
  345   HG23  ILE  36          HG23      ILE  36 -15.839  -2.572  -8.923
  346   HD11  ILE  36          HD11      ILE  36 -17.253  -1.790  -7.747
  347   HD12  ILE  36          HD12      ILE  36 -18.697  -2.083  -6.777
  348   HD13  ILE  36          HD13      ILE  36 -17.162  -2.821  -6.318
  349    HA   PRO  37           HA       PRO  37 -14.480  -8.327 -10.971
  350    HB2  PRO  37           HB2      PRO  37 -14.367  -7.999 -13.650
  351    HB3  PRO  37           HB3      PRO  37 -15.603  -8.981 -12.857
  352    HG2  PRO  37           HG2      PRO  37 -15.792  -6.216 -13.956
  353    HG3  PRO  37           HG3      PRO  37 -16.986  -7.525 -13.988
  354    HD2  PRO  37           HD2      PRO  37 -17.040  -5.409 -12.225
  355    HD3  PRO  37           HD3      PRO  37 -17.809  -6.980 -11.931
  356    H    GLU  38           H        GLU  38 -14.600  -4.936 -11.835
  357    HA   GLU  38           HA       GLU  38 -11.974  -4.668 -12.840
  358    HB2  GLU  38           HB2      GLU  38 -13.741  -2.658 -11.437
  359    HB3  GLU  38           HB3      GLU  38 -12.198  -2.251 -12.169
  360    HG2  GLU  38           HG2      GLU  38 -13.908  -1.629 -13.685
  361    HG3  GLU  38           HG3      GLU  38 -13.097  -3.047 -14.347
  362    H    ALA  39           H        ALA  39 -13.244  -4.927  -9.651
  363    HA   ALA  39           HA       ALA  39 -11.236  -3.713  -8.141
  364    HB1  ALA  39           HB1      ALA  39 -13.424  -4.373  -7.260
  365    HB2  ALA  39           HB2      ALA  39 -12.970  -6.070  -7.410
  366    HB3  ALA  39           HB3      ALA  39 -12.108  -5.024  -6.282
  367    H    LEU  40           H        LEU  40 -11.512  -6.963  -9.414
  368    HA   LEU  40           HA       LEU  40  -9.062  -7.820  -8.073
  369    HB2  LEU  40           HB2      LEU  40  -9.734 -10.046  -8.890
  370    HB3  LEU  40           HB3      LEU  40 -10.971  -9.273  -7.910
  371    HG   LEU  40           HG       LEU  40 -11.543  -8.498 -10.524
  372   HD11  LEU  40          HD11      LEU  40 -10.812 -11.401 -10.401
  373   HD12  LEU  40          HD12      LEU  40 -11.712 -10.626 -11.710
  374   HD13  LEU  40          HD13      LEU  40 -10.045 -10.143 -11.377
  375   HD21  LEU  40          HD21      LEU  40 -13.522  -9.886 -10.213
  376   HD22  LEU  40          HD22      LEU  40 -12.760 -10.651  -8.816
  377   HD23  LEU  40          HD23      LEU  40 -13.142  -8.929  -8.780
  378    H    ALA  41           H        ALA  41  -8.926  -5.918 -10.253
  379    HA   ALA  41           HA       ALA  41  -8.316  -6.942 -12.736
  380    HB1  ALA  41           HB1      ALA  41  -8.489  -4.551 -12.241
  381    HB2  ALA  41           HB2      ALA  41  -6.952  -4.620 -11.379
  382    HB3  ALA  41           HB3      ALA  41  -7.004  -4.929 -13.115
  383    H    GLY  42           H        GLY  42  -6.458  -7.243  -9.844
  384    HA2  GLY  42           HA2      GLY  42  -4.435  -8.744 -11.379
  385    HA3  GLY  42           HA3      GLY  42  -3.960  -7.680 -10.058
  386    HA   PRO  43           HA       PRO  43  -4.563 -11.805  -8.076
  387    HB2  PRO  43           HB2      PRO  43  -2.505 -10.861  -6.233
  388    HB3  PRO  43           HB3      PRO  43  -2.515 -12.302  -7.251
  389    HG2  PRO  43           HG2      PRO  43  -0.887 -10.186  -7.725
  390    HG3  PRO  43           HG3      PRO  43  -1.505 -11.239  -9.009
  391    HD2  PRO  43           HD2      PRO  43  -2.418  -8.514  -8.186
  392    HD3  PRO  43           HD3      PRO  43  -2.280  -9.215  -9.812
  393    HA   PRO  44           HA       PRO  44  -7.485  -9.607  -5.482
  394    HB2  PRO  44           HB2      PRO  44  -8.344 -11.947  -4.219
  395    HB3  PRO  44           HB3      PRO  44  -9.035 -11.237  -5.679
  396    HG2  PRO  44           HG2      PRO  44  -7.072 -13.461  -5.397
  397    HG3  PRO  44           HG3      PRO  44  -8.387 -13.262  -6.569
  398    HD2  PRO  44           HD2      PRO  44  -5.838 -12.844  -7.258
  399    HD3  PRO  44           HD3      PRO  44  -7.144 -11.827  -7.903
  400    H    ASN  45           H        ASN  45  -5.034 -11.824  -4.295
  401    HA   ASN  45           HA       ASN  45  -5.504 -11.253  -1.524
  402    HB2  ASN  45           HB2      ASN  45  -3.170 -12.557  -2.932
  403    HB3  ASN  45           HB3      ASN  45  -3.285 -12.389  -1.183
  404   HD21  ASN  45          HD21      ASN  45  -4.497 -13.986  -3.997
  405   HD22  ASN  45          HD22      ASN  45  -5.404 -15.205  -3.169
  406    H    ASP  46           H        ASP  46  -3.826  -9.685  -4.055
  407    HA   ASP  46           HA       ASP  46  -2.189  -8.140  -2.182
  408    HB2  ASP  46           HB2      ASP  46  -2.189  -8.318  -5.197
  409    HB3  ASP  46           HB3      ASP  46  -1.236  -7.135  -4.309
  410    H    PHE  47           H        PHE  47  -5.231  -7.959  -2.836
  411    HA   PHE  47           HA       PHE  47  -5.221  -5.065  -3.379
  412    HB2  PHE  47           HB2      PHE  47  -7.169  -7.206  -4.154
  413    HB3  PHE  47           HB3      PHE  47  -7.715  -5.542  -3.975
  414    HD1  PHE  47           HD1      PHE  47  -6.751  -3.775  -5.401
  415    HD2  PHE  47           HD2      PHE  47  -5.908  -7.889  -6.044
  416    HE1  PHE  47           HE1      PHE  47  -5.977  -3.253  -7.674
  417    HE2  PHE  47           HE2      PHE  47  -5.121  -7.374  -8.312
  418    HZ   PHE  47           HZ       PHE  47  -5.157  -5.055  -9.133
  419    H    GLY  48           H        GLY  48  -6.036  -3.726  -1.923
  420    HA2  GLY  48           HA2      GLY  48  -7.774  -4.814   0.190
  421    HA3  GLY  48           HA3      GLY  48  -6.338  -3.903   0.629
  422    H    LEU  49           H        LEU  49  -8.240  -2.735   1.723
  423    HA   LEU  49           HA       LEU  49  -9.603  -0.909  -0.111
  424    HB2  LEU  49           HB2      LEU  49 -10.054  -1.389   2.834
  425    HB3  LEU  49           HB3      LEU  49 -11.034  -0.371   1.799
  426    HG   LEU  49           HG       LEU  49 -10.756  -3.369   1.572
  427   HD11  LEU  49          HD11      LEU  49 -13.046  -1.640   2.492
  428   HD12  LEU  49          HD12      LEU  49 -13.098  -3.390   2.276
  429   HD13  LEU  49          HD13      LEU  49 -12.054  -2.685   3.509
  430   HD21  LEU  49          HD21      LEU  49 -12.493  -1.448   0.028
  431   HD22  LEU  49          HD22      LEU  49 -11.081  -2.299  -0.603
  432   HD23  LEU  49          HD23      LEU  49 -12.509  -3.206  -0.108
  433    H    PHE  50           H        PHE  50  -8.559   0.894  -0.497
  434    HA   PHE  50           HA       PHE  50  -7.186   2.252   1.727
  435    HB2  PHE  50           HB2      PHE  50  -5.749   1.889  -0.187
  436    HB3  PHE  50           HB3      PHE  50  -6.927   2.632  -1.262
  437    HD1  PHE  50           HD1      PHE  50  -4.739   3.354   1.645
  438    HD2  PHE  50           HD2      PHE  50  -6.790   4.930  -1.744
  439    HE1  PHE  50           HE1      PHE  50  -3.637   5.525   1.987
  440    HE2  PHE  50           HE2      PHE  50  -5.687   7.098  -1.402
  441    HZ   PHE  50           HZ       PHE  50  -4.141   7.426   0.393
  442    H    LEU  51           H        LEU  51  -8.067   3.977   2.610
  443    HA   LEU  51           HA       LEU  51 -10.386   5.220   1.335
  444    HB2  LEU  51           HB2      LEU  51 -10.210   4.509   3.827
  445    HB3  LEU  51           HB3      LEU  51  -9.213   5.935   4.020
  446    HG   LEU  51           HG       LEU  51 -11.729   6.054   4.612
  447   HD11  LEU  51          HD11      LEU  51 -10.304   8.004   4.620
  448   HD12  LEU  51          HD12      LEU  51 -10.440   8.142   2.869
  449   HD13  LEU  51          HD13      LEU  51 -11.859   8.395   3.884
  450   HD21  LEU  51          HD21      LEU  51 -11.861   6.375   1.619
  451   HD22  LEU  51          HD22      LEU  51 -12.575   5.066   2.561
  452   HD23  LEU  51          HD23      LEU  51 -13.171   6.716   2.750
  453    H    SER  52           H        SER  52  -9.959   6.842  -0.026
  454    HA   SER  52           HA       SER  52  -7.253   7.701  -0.237
  455    HB2  SER  52           HB2      SER  52  -9.557   8.608  -1.939
  456    HB3  SER  52           HB3      SER  52  -7.848   8.570  -2.378
  457    HG   SER  52           HG       SER  52  -8.391   6.696  -3.197
  458    H    ASP  53           H        ASP  53  -9.932   8.933   1.161
  459    HA   ASP  53           HA       ASP  53 -10.715  10.948   1.877
  460    HB2  ASP  53           HB2      ASP  53  -8.868  10.535   3.452
  461    HB3  ASP  53           HB3      ASP  53  -7.766  11.401   2.391
  462    H    ASP  54           H        ASP  54  -7.659  12.319   0.802
  463    HA   ASP  54           HA       ASP  54  -8.766  13.467  -1.592
  464    HB2  ASP  54           HB2      ASP  54  -9.659  15.056   0.037
  465    HB3  ASP  54           HB3      ASP  54  -8.063  15.257   0.751
  466    H    ASP  55           H        ASP  55  -6.231  13.734   0.852
  467    HA   ASP  55           HA       ASP  55  -4.219  13.817  -1.301
  468    HB2  ASP  55           HB2      ASP  55  -4.236  15.834   0.139
  469    HB3  ASP  55           HB3      ASP  55  -3.991  14.816   1.554
  470    HA   PRO  56           HA       PRO  56  -2.853   9.756  -0.256
  471    HB2  PRO  56           HB2      PRO  56  -0.086  10.337  -0.333
  472    HB3  PRO  56           HB3      PRO  56  -1.081   9.684  -1.635
  473    HG2  PRO  56           HG2      PRO  56  -0.204  12.473  -1.137
  474    HG3  PRO  56           HG3      PRO  56  -0.537  11.651  -2.671
  475    HD2  PRO  56           HD2      PRO  56  -2.230  13.462  -1.651
  476    HD3  PRO  56           HD3      PRO  56  -2.819  12.030  -2.523
  477    H    LYS  57           H        LYS  57  -1.487  12.500   1.575
  478    HA   LYS  57           HA       LYS  57  -0.416  10.745   3.609
  479    HB2  LYS  57           HB2      LYS  57  -0.897  13.715   3.865
  480    HB3  LYS  57           HB3      LYS  57   0.173  12.712   4.839
  481    HG2  LYS  57           HG2      LYS  57   0.558  13.229   1.902
  482    HG3  LYS  57           HG3      LYS  57   1.335  14.150   3.187
  483    HD2  LYS  57           HD2      LYS  57   2.984  12.653   2.996
  484    HD3  LYS  57           HD3      LYS  57   1.914  11.578   3.895
  485    HE2  LYS  57           HE2      LYS  57   2.759  10.442   1.941
  486    HE3  LYS  57           HE3      LYS  57   1.026  10.722   1.762
  487    HZ1  LYS  57           HZ1      LYS  57   3.118  12.460   0.562
  488    HZ2  LYS  57           HZ2      LYS  57   1.453  12.539   0.280
  489    HZ3  LYS  57           HZ3      LYS  57   2.351  11.199  -0.269
  490    H    LYS  58           H        LYS  58  -3.379  12.397   2.990
  491    HA   LYS  58           HA       LYS  58  -4.431  12.071   5.667
  492    HB2  LYS  58           HB2      LYS  58  -5.588  13.075   3.074
  493    HB3  LYS  58           HB3      LYS  58  -6.613  12.766   4.464
  494    HG2  LYS  58           HG2      LYS  58  -6.104  15.089   4.409
  495    HG3  LYS  58           HG3      LYS  58  -5.226  14.375   5.761
  496    HD2  LYS  58           HD2      LYS  58  -3.186  14.336   4.445
  497    HD3  LYS  58           HD3      LYS  58  -4.054  14.968   3.045
  498    HE2  LYS  58           HE2      LYS  58  -2.798  16.722   4.189
  499    HE3  LYS  58           HE3      LYS  58  -4.534  17.022   4.246
  500    HZ1  LYS  58           HZ1      LYS  58  -4.613  16.305   6.500
  501    HZ2  LYS  58           HZ2      LYS  58  -3.339  17.418   6.373
  502    HZ3  LYS  58           HZ3      LYS  58  -3.007  15.757   6.456
  503    H    GLY  59           H        GLY  59  -4.381  10.404   2.654
  504    HA2  GLY  59           HA2      GLY  59  -6.573   8.674   3.035
  505    HA3  GLY  59           HA3      GLY  59  -5.189   8.365   1.995
  506    H    ILE  60           H        ILE  60  -6.569   6.443   3.612
  507    HA   ILE  60           HA       ILE  60  -4.322   5.575   5.286
  508    HB   ILE  60           HB       ILE  60  -5.987   4.735   6.991
  509   HG12  ILE  60          HG12      ILE  60  -7.812   6.721   5.617
  510   HG13  ILE  60          HG13      ILE  60  -7.986   4.972   5.543
  511   HG21  ILE  60          HG21      ILE  60  -6.151   6.885   8.156
  512   HG22  ILE  60          HG22      ILE  60  -4.557   6.646   7.438
  513   HG23  ILE  60          HG23      ILE  60  -5.723   7.720   6.664
  514   HD11  ILE  60          HD11      ILE  60  -8.167   6.642   8.038
  515   HD12  ILE  60          HD12      ILE  60  -9.528   5.977   7.135
  516   HD13  ILE  60          HD13      ILE  60  -8.387   4.895   7.932
  517    H    TRP  61           H        TRP  61  -4.064   3.352   5.426
  518    HA   TRP  61           HA       TRP  61  -5.590   1.787   3.512
  519    HB2  TRP  61           HB2      TRP  61  -3.165   1.178   5.195
  520    HB3  TRP  61           HB3      TRP  61  -4.031  -0.083   4.323
  521    HD1  TRP  61           HD1      TRP  61  -1.413   2.519   3.872
  522    HE1  TRP  61           HE1      TRP  61  -0.661   2.620   1.413
  523    HE3  TRP  61           HE3      TRP  61  -5.080  -0.379   1.819
  524    HZ2  TRP  61           HZ2      TRP  61  -1.519   1.579  -1.069
  525    HZ3  TRP  61           HZ3      TRP  61  -5.040  -0.786  -0.607
  526    HH2  TRP  61           HH2      TRP  61  -3.296   0.174  -2.019
  527    H    LEU  62           H        LEU  62  -7.321   0.713   4.058
  528    HA   LEU  62           HA       LEU  62  -8.097   0.482   6.819
  529    HB2  LEU  62           HB2      LEU  62  -9.435  -0.738   4.405
  530    HB3  LEU  62           HB3      LEU  62 -10.157  -0.414   5.969
  531    HG   LEU  62           HG       LEU  62  -9.256   1.681   3.985
  532   HD11  LEU  62          HD11      LEU  62 -12.014   0.792   4.806
  533   HD12  LEU  62          HD12      LEU  62 -11.638   2.140   3.732
  534   HD13  LEU  62          HD13      LEU  62 -11.244   0.491   3.248
  535   HD21  LEU  62          HD21      LEU  62 -10.355   3.267   5.474
  536   HD22  LEU  62          HD22      LEU  62 -10.688   1.960   6.617
  537   HD23  LEU  62          HD23      LEU  62  -9.024   2.442   6.287
  538    H    GLU  63           H        GLU  63  -7.122  -1.040   8.030
  539    HA   GLU  63           HA       GLU  63  -6.052  -3.441   6.909
  540    HB2  GLU  63           HB2      GLU  63  -5.483  -3.931   9.290
  541    HB3  GLU  63           HB3      GLU  63  -4.905  -2.364   8.737
  542    HG2  GLU  63           HG2      GLU  63  -6.963  -1.362   9.784
  543    HG3  GLU  63           HG3      GLU  63  -7.257  -2.936  10.518
  544    H    ALA  64           H        ALA  64  -6.638  -5.610   7.695
  545    HA   ALA  64           HA       ALA  64  -9.456  -6.000   7.421
  546    HB1  ALA  64           HB1      ALA  64  -8.951  -8.374   7.563
  547    HB2  ALA  64           HB2      ALA  64  -7.821  -7.562   6.479
  548    HB3  ALA  64           HB3      ALA  64  -7.313  -8.009   8.108
  549    H    GLY  65           H        GLY  65  -7.485  -5.361  10.075
  550    HA2  GLY  65           HA2      GLY  65  -9.091  -6.861  11.983
  551    HA3  GLY  65           HA3      GLY  65  -7.643  -5.936  12.339
  552    H    LYS  66           H        LYS  66 -10.023  -4.270  10.479
  553    HA   LYS  66           HA       LYS  66 -11.420  -3.332  12.850
  554    HB2  LYS  66           HB2      LYS  66 -10.730  -1.181  12.854
  555    HB3  LYS  66           HB3      LYS  66  -9.313  -1.825  12.039
  556    HG2  LYS  66           HG2      LYS  66 -11.705  -0.742  10.576
  557    HG3  LYS  66           HG3      LYS  66 -10.332   0.252  11.054
  558    HD2  LYS  66           HD2      LYS  66  -9.119  -0.458   9.330
  559    HD3  LYS  66           HD3      LYS  66  -9.493  -2.148   9.673
  560    HE2  LYS  66           HE2      LYS  66 -10.258  -1.387   7.434
  561    HE3  LYS  66           HE3      LYS  66 -11.548  -2.009   8.456
  562    HZ1  LYS  66           HZ1      LYS  66 -10.940   0.872   8.110
  563    HZ2  LYS  66           HZ2      LYS  66 -12.262   0.205   8.932
  564    HZ3  LYS  66           HZ3      LYS  66 -12.136   0.040   7.251
  565    H    ALA  67           H        ALA  67 -13.307  -1.932  12.249
  566    HA   ALA  67           HA       ALA  67 -14.540  -3.088   9.862
  567    HB1  ALA  67           HB1      ALA  67 -16.640  -2.375  10.823
  568    HB2  ALA  67           HB2      ALA  67 -15.693  -3.253  12.029
  569    HB3  ALA  67           HB3      ALA  67 -15.791  -1.491  12.093
  570    H    LEU  68           H        LEU  68 -16.186  -1.438   8.794
  571    HA   LEU  68           HA       LEU  68 -14.432   0.424   7.536
  572    HB2  LEU  68           HB2      LEU  68 -17.387  -0.037   7.197
  573    HB3  LEU  68           HB3      LEU  68 -16.429   1.021   6.182
  574    HG   LEU  68           HG       LEU  68 -16.038  -1.959   6.463
  575   HD11  LEU  68          HD11      LEU  68 -18.078  -1.404   5.267
  576   HD12  LEU  68          HD12      LEU  68 -17.175  -0.319   4.208
  577   HD13  LEU  68          HD13      LEU  68 -16.860  -2.054   4.168
  578   HD21  LEU  68          HD21      LEU  68 -14.464  -1.705   4.617
  579   HD22  LEU  68          HD22      LEU  68 -14.700   0.043   4.650
  580   HD23  LEU  68          HD23      LEU  68 -13.953  -0.770   6.023
  581    H    ASP  69           H        ASP  69 -17.547   0.967   9.176
  582    HA   ASP  69           HA       ASP  69 -17.357   3.776   9.109
  583    HB2  ASP  69           HB2      ASP  69 -19.501   2.611   9.290
  584    HB3  ASP  69           HB3      ASP  69 -19.052   1.994  10.875
  585    H    TYR  70           H        TYR  70 -15.896   1.487  11.159
  586    HA   TYR  70           HA       TYR  70 -15.582   2.809  13.556
  587    HB2  TYR  70           HB2      TYR  70 -14.710   0.691  13.631
  588    HB3  TYR  70           HB3      TYR  70 -14.007   0.791  12.023
  589    HD1  TYR  70           HD1      TYR  70 -13.508   1.629  15.583
  590    HD2  TYR  70           HD2      TYR  70 -11.769   1.527  11.705
  591    HE1  TYR  70           HE1      TYR  70 -11.287   2.001  16.573
  592    HE2  TYR  70           HE2      TYR  70  -9.549   1.896  12.679
  593    HH   TYR  70           HH       TYR  70  -8.890   1.535  15.944
  594    H    TYR  71           H        TYR  71 -13.991   3.397  10.483
  595    HA   TYR  71           HA       TYR  71 -12.192   5.362  11.590
  596    HB2  TYR  71           HB2      TYR  71 -12.778   4.388   8.822
  597    HB3  TYR  71           HB3      TYR  71 -11.861   5.871   9.064
  598    HD1  TYR  71           HD1      TYR  71  -9.923   5.617  10.863
  599    HD2  TYR  71           HD2      TYR  71 -11.576   2.440   8.579
  600    HE1  TYR  71           HE1      TYR  71  -7.882   4.309  11.215
  601    HE2  TYR  71           HE2      TYR  71  -9.529   1.117   8.920
  602    HH   TYR  71           HH       TYR  71  -7.111   1.566   9.441
  603    H    MET  72           H        MET  72 -12.798   6.867   8.946
  604    HA   MET  72           HA       MET  72 -14.504   8.854  10.268
  605    HB2  MET  72           HB2      MET  72 -12.807   9.320   7.827
  606    HB3  MET  72           HB3      MET  72 -13.356  10.490   9.017
  607    HG2  MET  72           HG2      MET  72 -11.772   9.794  10.596
  608    HG3  MET  72           HG3      MET  72 -11.431   8.303   9.719
  609    HE1  MET  72           HE1      MET  72  -8.875   8.513   9.681
  610    HE2  MET  72           HE2      MET  72  -8.002   9.997   9.300
  611    HE3  MET  72           HE3      MET  72  -9.022   9.918  10.737
  612    H    LEU  73           H        LEU  73 -15.046   6.405   8.241
  613    HA   LEU  73           HA       LEU  73 -16.342   8.021   6.166
  614    HB2  LEU  73           HB2      LEU  73 -16.132   6.018   4.716
  615    HB3  LEU  73           HB3      LEU  73 -14.611   6.741   5.192
  616    HG   LEU  73           HG       LEU  73 -14.581   4.908   7.032
  617   HD11  LEU  73          HD11      LEU  73 -16.870   4.122   6.703
  618   HD12  LEU  73          HD12      LEU  73 -16.473   3.660   5.047
  619   HD13  LEU  73          HD13      LEU  73 -15.694   2.841   6.402
  620   HD21  LEU  73          HD21      LEU  73 -13.017   5.036   5.191
  621   HD22  LEU  73          HD22      LEU  73 -13.501   3.363   5.477
  622   HD23  LEU  73          HD23      LEU  73 -14.188   4.262   4.124
  623    H    ARG  74           H        ARG  74 -18.195   7.383   5.240
  624    HA   ARG  74           HA       ARG  74 -19.834   5.274   6.144
  625    HB2  ARG  74           HB2      ARG  74 -21.670   7.022   6.939
  626    HB3  ARG  74           HB3      ARG  74 -20.515   6.334   8.061
  627    HG2  ARG  74           HG2      ARG  74 -20.709   8.657   8.514
  628    HG3  ARG  74           HG3      ARG  74 -19.126   8.379   7.794
  629    HD2  ARG  74           HD2      ARG  74 -21.061   8.964   5.754
  630    HD3  ARG  74           HD3      ARG  74 -21.085  10.217   6.994
  631    HE   ARG  74           HE       ARG  74 -18.731   9.421   5.391
  632   HH11  ARG  74          HH11      ARG  74 -20.391  11.727   7.475
  633   HH12  ARG  74          HH12      ARG  74 -19.208  12.978   7.224
  634   HH21  ARG  74          HH21      ARG  74 -17.198  11.045   5.071
  635   HH22  ARG  74          HH22      ARG  74 -17.382  12.585   5.862
  636    H    ASN  75           H        ASN  75 -22.303   6.741   5.470
  637    HA   ASN  75           HA       ASN  75 -22.305   6.269   2.713
  638    HB2  ASN  75           HB2      ASN  75 -24.194   7.542   4.627
  639    HB3  ASN  75           HB3      ASN  75 -24.457   7.828   2.909
  640   HD21  ASN  75          HD21      ASN  75 -24.327   5.407   5.424
  641   HD22  ASN  75          HD22      ASN  75 -25.117   4.163   4.517
  642    H    GLY  76           H        GLY  76 -21.215   7.363   1.214
  643    HA2  GLY  76           HA2      GLY  76 -21.578   9.450  -0.105
  644    HA3  GLY  76           HA3      GLY  76 -21.280  10.311   1.393
  645    H    ASP  77           H        ASP  77 -19.096   8.136   1.903
  646    HA   ASP  77           HA       ASP  77 -17.019   9.858   0.862
  647    HB2  ASP  77           HB2      ASP  77 -16.800   7.362   2.557
  648    HB3  ASP  77           HB3      ASP  77 -15.476   8.458   2.179
  649    H    THR  78           H        THR  78 -15.134   9.080  -0.245
  650    HA   THR  78           HA       THR  78 -15.758   6.961  -2.170
  651    HB   THR  78           HB       THR  78 -13.534   9.019  -2.184
  652    HG1  THR  78           HG1      THR  78 -15.505  10.037  -2.538
  653   HG21  THR  78          HG21      THR  78 -12.924   7.015  -3.432
  654   HG22  THR  78          HG22      THR  78 -13.242   8.354  -4.537
  655   HG23  THR  78          HG23      THR  78 -14.447   7.085  -4.319
  656    H    MET  79           H        MET  79 -14.774   5.025  -2.060
  657    HA   MET  79           HA       MET  79 -12.403   4.781  -0.338
  658    HB2  MET  79           HB2      MET  79 -14.545   3.836   0.677
  659    HB3  MET  79           HB3      MET  79 -14.512   2.638  -0.610
  660    HG2  MET  79           HG2      MET  79 -12.280   1.922   0.159
  661    HG3  MET  79           HG3      MET  79 -12.405   3.066   1.493
  662    HE1  MET  79           HE1      MET  79 -13.516  -0.306  -0.019
  663    HE2  MET  79           HE2      MET  79 -14.905  -0.761   0.974
  664    HE3  MET  79           HE3      MET  79 -15.032   0.590  -0.154
  665    H    GLU  80           H        GLU  80 -10.733   4.079  -1.432
  666    HA   GLU  80           HA       GLU  80 -11.120   3.197  -4.175
  667    HB2  GLU  80           HB2      GLU  80  -9.408   4.945  -3.204
  668    HB3  GLU  80           HB3      GLU  80  -8.453   3.517  -2.843
  669    HG2  GLU  80           HG2      GLU  80  -8.286   2.940  -5.133
  670    HG3  GLU  80           HG3      GLU  80  -9.490   4.143  -5.590
  671    H    TYR  81           H        TYR  81 -11.085   1.056  -4.750
  672    HA   TYR  81           HA       TYR  81  -9.831  -0.823  -2.897
  673    HB2  TYR  81           HB2      TYR  81 -12.137  -1.332  -3.797
  674    HB3  TYR  81           HB3      TYR  81 -11.420  -1.448  -5.400
  675    HD1  TYR  81           HD1      TYR  81 -11.476  -3.005  -2.031
  676    HD2  TYR  81           HD2      TYR  81 -10.259  -3.403  -6.085
  677    HE1  TYR  81           HE1      TYR  81 -10.930  -5.373  -1.629
  678    HE2  TYR  81           HE2      TYR  81  -9.714  -5.767  -5.698
  679    HH   TYR  81           HH       TYR  81 -10.737  -7.472  -3.004
  680    H    ARG  82           H        ARG  82  -7.758  -0.982  -3.233
  681    HA   ARG  82           HA       ARG  82  -6.767  -0.963  -5.978
  682    HB2  ARG  82           HB2      ARG  82  -4.945   0.618  -5.343
  683    HB3  ARG  82           HB3      ARG  82  -6.548   1.338  -5.381
  684    HG2  ARG  82           HG2      ARG  82  -6.681   1.188  -2.954
  685    HG3  ARG  82           HG3      ARG  82  -5.078   0.450  -2.911
  686    HD2  ARG  82           HD2      ARG  82  -5.646   3.163  -4.084
  687    HD3  ARG  82           HD3      ARG  82  -5.133   2.906  -2.418
  688    HE   ARG  82           HE       ARG  82  -3.172   1.679  -3.674
  689   HH11  ARG  82          HH11      ARG  82  -4.774   4.629  -4.656
  690   HH12  ARG  82          HH12      ARG  82  -3.307   5.385  -5.221
  691   HH21  ARG  82          HH21      ARG  82  -1.254   2.640  -4.435
  692   HH22  ARG  82          HH22      ARG  82  -1.297   4.258  -5.077
  693    H    LYS  83           H        LYS  83  -4.435  -1.518  -6.059
  694    HA   LYS  83           HA       LYS  83  -4.026  -3.912  -4.610
  695    HB2  LYS  83           HB2      LYS  83  -3.150  -3.376  -6.921
  696    HB3  LYS  83           HB3      LYS  83  -1.958  -2.338  -6.152
  697    HG2  LYS  83           HG2      LYS  83  -0.919  -4.171  -5.077
  698    HG3  LYS  83           HG3      LYS  83  -2.248  -5.256  -5.503
  699    HD2  LYS  83           HD2      LYS  83  -1.670  -5.033  -7.866
  700    HD3  LYS  83           HD3      LYS  83  -0.350  -3.938  -7.443
  701    HE2  LYS  83           HE2      LYS  83   0.751  -5.685  -6.195
  702    HE3  LYS  83           HE3      LYS  83  -0.598  -6.785  -6.485
  703    HZ1  LYS  83           HZ1      LYS  83   1.332  -5.733  -8.476
  704    HZ2  LYS  83           HZ2      LYS  83  -0.099  -6.528  -8.909
  705    HZ3  LYS  83           HZ3      LYS  83   1.088  -7.349  -8.013
  706    H    LYS  84           H        LYS  84  -3.004  -4.273  -2.767
  707    HA   LYS  84           HA       LYS  84  -2.458  -2.291  -0.895
  708    HB2  LYS  84           HB2      LYS  84  -1.540  -5.145  -1.161
  709    HB3  LYS  84           HB3      LYS  84  -1.025  -4.145   0.187
  710    HG2  LYS  84           HG2      LYS  84  -3.911  -4.661  -0.484
  711    HG3  LYS  84           HG3      LYS  84  -2.971  -5.651   0.635
  712    HD2  LYS  84           HD2      LYS  84  -2.433  -3.342   1.750
  713    HD3  LYS  84           HD3      LYS  84  -3.900  -2.827   0.914
  714    HE2  LYS  84           HE2      LYS  84  -5.156  -4.610   2.000
  715    HE3  LYS  84           HE3      LYS  84  -3.693  -5.174   2.796
  716    HZ1  LYS  84           HZ1      LYS  84  -4.983  -2.535   3.217
  717    HZ2  LYS  84           HZ2      LYS  84  -3.565  -3.061   3.974
  718    HZ3  LYS  84           HZ3      LYS  84  -5.037  -3.849   4.284
  719    H    GLN  85           H        GLN  85  -0.544  -3.547  -3.489
  720    HA   GLN  85           HA       GLN  85   1.907  -2.410  -2.397
  721    HB2  GLN  85           HB2      GLN  85   2.025  -3.742  -5.005
  722    HB3  GLN  85           HB3      GLN  85   3.028  -3.969  -3.579
  723    HG2  GLN  85           HG2      GLN  85   1.007  -5.218  -2.620
  724    HG3  GLN  85           HG3      GLN  85   0.439  -5.267  -4.288
  725   HE21  GLN  85          HE21      GLN  85   2.761  -6.434  -2.013
  726   HE22  GLN  85          HE22      GLN  85   3.435  -7.656  -3.030
  727    H    ARG  86           H        ARG  86   3.185  -1.018  -3.633
  728    HA   ARG  86           HA       ARG  86   1.886   0.226  -5.954
  729    HB2  ARG  86           HB2      ARG  86   3.357   2.280  -4.891
  730    HB3  ARG  86           HB3      ARG  86   1.628   2.055  -4.667
  731    HG2  ARG  86           HG2      ARG  86   2.321   2.353  -2.507
  732    HG3  ARG  86           HG3      ARG  86   2.364   0.596  -2.636
  733    HD2  ARG  86           HD2      ARG  86   4.372   1.217  -1.568
  734    HD3  ARG  86           HD3      ARG  86   4.815   0.837  -3.234
  735    HE   ARG  86           HE       ARG  86   5.370   3.041  -3.566
  736   HH11  ARG  86          HH11      ARG  86   3.688   2.695  -0.524
  737   HH12  ARG  86          HH12      ARG  86   3.935   4.337  -0.037
  738   HH21  ARG  86          HH21      ARG  86   5.720   5.232  -2.913
  739   HH22  ARG  86          HH22      ARG  86   5.086   5.781  -1.392
  740    HA   PRO  87           HA       PRO  87   5.521  -0.637  -8.176
  741    HB2  PRO  87           HB2      PRO  87   5.728   1.517  -9.839
  742    HB3  PRO  87           HB3      PRO  87   4.536   0.229 -10.049
  743    HG2  PRO  87           HG2      PRO  87   4.209   2.930  -8.804
  744    HG3  PRO  87           HG3      PRO  87   3.121   2.065  -9.905
  745    HD2  PRO  87           HD2      PRO  87   2.687   2.164  -7.246
  746    HD3  PRO  87           HD3      PRO  87   2.262   0.741  -8.219
  747    H    LEU  88           H        LEU  88   7.294  -0.632  -6.943
  748    HA   LEU  88           HA       LEU  88   8.419   1.952  -6.120
  749    HB2  LEU  88           HB2      LEU  88   8.537  -0.778  -4.899
  750    HB3  LEU  88           HB3      LEU  88   9.786   0.403  -4.542
  751    HG   LEU  88           HG       LEU  88   6.837   0.866  -4.086
  752   HD11  LEU  88          HD11      LEU  88   7.660  -0.883  -2.610
  753   HD12  LEU  88          HD12      LEU  88   9.006   0.148  -2.121
  754   HD13  LEU  88          HD13      LEU  88   7.352   0.605  -1.714
  755   HD21  LEU  88          HD21      LEU  88   9.294   2.418  -3.294
  756   HD22  LEU  88          HD22      LEU  88   8.073   2.907  -4.467
  757   HD23  LEU  88          HD23      LEU  88   7.650   2.776  -2.758
  758    H    LYS  89           H        LYS  89  10.261   2.618  -6.961
  759    HA   LYS  89           HA       LYS  89  11.785   0.796  -8.650
  760    HB2  LYS  89           HB2      LYS  89  11.630   3.765  -8.377
  761    HB3  LYS  89           HB3      LYS  89  13.140   3.068  -8.944
  762    HG2  LYS  89           HG2      LYS  89  11.805   3.692 -10.832
  763    HG3  LYS  89           HG3      LYS  89  11.901   1.934 -10.752
  764    HD2  LYS  89           HD2      LYS  89   9.651   2.506 -11.283
  765    HD3  LYS  89           HD3      LYS  89   9.671   1.957  -9.606
  766    HE2  LYS  89           HE2      LYS  89   9.689   4.281  -8.850
  767    HE3  LYS  89           HE3      LYS  89   9.669   4.827 -10.526
  768    HZ1  LYS  89           HZ1      LYS  89   7.537   3.285  -9.151
  769    HZ2  LYS  89           HZ2      LYS  89   7.520   3.691 -10.796
  770    HZ3  LYS  89           HZ3      LYS  89   7.466   4.912  -9.620
  771    H    ILE  90           H        ILE  90  13.357  -0.300  -7.773
  772    HA   ILE  90           HA       ILE  90  14.696   0.780  -5.378
  773    HB   ILE  90           HB       ILE  90  13.974  -2.123  -5.829
  774   HG12  ILE  90          HG12      ILE  90  11.991  -0.748  -5.315
  775   HG13  ILE  90          HG13      ILE  90  12.369  -1.865  -4.010
  776   HG21  ILE  90          HG21      ILE  90  16.012  -1.945  -4.581
  777   HG22  ILE  90          HG22      ILE  90  15.310  -0.729  -3.510
  778   HG23  ILE  90          HG23      ILE  90  14.718  -2.390  -3.467
  779   HD11  ILE  90          HD11      ILE  90  11.715   0.309  -3.156
  780   HD12  ILE  90          HD12      ILE  90  13.394  -0.045  -2.750
  781   HD13  ILE  90          HD13      ILE  90  13.020   1.072  -4.063
  782    H    ARG  91           H        ARG  91  16.904   0.677  -5.429
  783    HA   ARG  91           HA       ARG  91  18.119  -0.776  -7.665
  784    HB2  ARG  91           HB2      ARG  91  18.494   1.724  -7.464
  785    HB3  ARG  91           HB3      ARG  91  19.366   1.385  -5.975
  786    HG2  ARG  91           HG2      ARG  91  20.955   0.002  -7.218
  787    HG3  ARG  91           HG3      ARG  91  20.105   0.397  -8.714
  788    HD2  ARG  91           HD2      ARG  91  21.445   2.363  -6.860
  789    HD3  ARG  91           HD3      ARG  91  22.078   1.806  -8.410
  790    HE   ARG  91           HE       ARG  91  19.710   2.807  -9.139
  791   HH11  ARG  91          HH11      ARG  91  22.245   4.102  -7.106
  792   HH12  ARG  91          HH12      ARG  91  21.868   5.762  -7.464
  793   HH21  ARG  91          HH21      ARG  91  19.212   4.956  -9.642
  794   HH22  ARG  91          HH22      ARG  91  20.142   6.249  -8.939
  795    H    MET  92           H        MET  92  19.215  -2.541  -7.203
  796    HA   MET  92           HA       MET  92  19.652  -3.359  -4.489
  797    HB2  MET  92           HB2      MET  92  19.798  -4.553  -7.195
  798    HB3  MET  92           HB3      MET  92  20.833  -5.273  -5.972
  799    HG2  MET  92           HG2      MET  92  18.428  -6.157  -6.412
  800    HG3  MET  92           HG3      MET  92  19.082  -6.104  -4.780
  801    HE1  MET  92           HE1      MET  92  15.835  -3.344  -6.515
  802    HE2  MET  92           HE2      MET  92  17.423  -3.531  -7.260
  803    HE3  MET  92           HE3      MET  92  16.311  -4.899  -7.204
  804    H    LEU  93           H        LEU  93  21.868  -4.653  -4.266
  805    HA   LEU  93           HA       LEU  93  23.642  -2.606  -3.576
  806    HB2  LEU  93           HB2      LEU  93  24.185  -5.566  -3.782
  807    HB3  LEU  93           HB3      LEU  93  25.209  -4.407  -2.963
  808    HG   LEU  93           HG       LEU  93  24.049  -5.464  -1.245
  809   HD11  LEU  93          HD11      LEU  93  22.553  -3.780  -0.303
  810   HD12  LEU  93          HD12      LEU  93  24.010  -3.057  -0.988
  811   HD13  LEU  93          HD13      LEU  93  22.483  -2.970  -1.869
  812   HD21  LEU  93          HD21      LEU  93  21.720  -5.997  -1.216
  813   HD22  LEU  93          HD22      LEU  93  21.445  -5.112  -2.715
  814   HD23  LEU  93          HD23      LEU  93  22.403  -6.593  -2.729
  815    H    ASP  94           H        ASP  94  23.602  -4.783  -6.335
  816    HA   ASP  94           HA       ASP  94  26.241  -3.952  -7.195
  817    HB2  ASP  94           HB2      ASP  94  24.195  -5.591  -8.704
  818    HB3  ASP  94           HB3      ASP  94  25.908  -5.444  -9.082
  819    H    GLY  95           H        GLY  95  23.281  -2.554  -7.264
  820    HA2  GLY  95           HA2      GLY  95  22.954  -0.402  -8.241
  821    HA3  GLY  95           HA3      GLY  95  24.063  -0.851  -9.533
  822    H    THR  96           H        THR  96  22.030  -3.374  -8.755
  823    HA   THR  96           HA       THR  96  20.749  -3.273 -11.305
  824    HB   THR  96           HB       THR  96  20.068  -5.158  -9.049
  825    HG1  THR  96           HG1      THR  96  22.306  -5.261 -10.832
  826   HG21  THR  96          HG21      THR  96  19.693  -6.742 -10.888
  827   HG22  THR  96          HG22      THR  96  20.140  -5.494 -12.052
  828   HG23  THR  96          HG23      THR  96  18.691  -5.302 -11.065
  829    H    VAL  97           H        VAL  97  18.858  -2.240 -11.718
  830    HA   VAL  97           HA       VAL  97  17.212  -1.587  -9.370
  831    HB   VAL  97           HB       VAL  97  18.136   0.441 -10.258
  832   HG11  VAL  97          HG11      VAL  97  16.928  -0.309 -12.909
  833   HG12  VAL  97          HG12      VAL  97  17.736   1.214 -12.525
  834   HG13  VAL  97          HG13      VAL  97  18.648  -0.296 -12.513
  835   HG21  VAL  97          HG21      VAL  97  15.233   0.180 -11.026
  836   HG22  VAL  97          HG22      VAL  97  15.863   0.589  -9.431
  837   HG23  VAL  97          HG23      VAL  97  16.095   1.700 -10.782
  838    H    LYS  98           H        LYS  98  15.131  -1.954  -9.385
  839    HA   LYS  98           HA       LYS  98  13.835  -2.960 -11.802
  840    HB2  LYS  98           HB2      LYS  98  12.945  -4.950 -10.801
  841    HB3  LYS  98           HB3      LYS  98  14.691  -4.978 -10.605
  842    HG2  LYS  98           HG2      LYS  98  14.538  -4.485  -8.304
  843    HG3  LYS  98           HG3      LYS  98  12.837  -4.033  -8.441
  844    HD2  LYS  98           HD2      LYS  98  13.891  -6.812  -8.962
  845    HD3  LYS  98           HD3      LYS  98  13.234  -6.288  -7.409
  846    HE2  LYS  98           HE2      LYS  98  11.321  -7.118  -8.271
  847    HE3  LYS  98           HE3      LYS  98  11.230  -5.521  -9.017
  848    HZ1  LYS  98           HZ1      LYS  98  12.274  -6.478 -11.013
  849    HZ2  LYS  98           HZ2      LYS  98  10.796  -7.222 -10.642
  850    HZ3  LYS  98           HZ3      LYS  98  12.255  -8.011 -10.284
  851    H    THR  99           H        THR  99  11.479  -2.983 -11.649
  852    HA   THR  99           HA       THR  99  10.507  -1.175  -9.545
  853    HB   THR  99           HB       THR  99   9.323  -1.709 -12.281
  854    HG1  THR  99           HG1      THR  99  11.353  -0.371 -12.049
  855   HG21  THR  99          HG21      THR  99   7.639  -1.182 -10.583
  856   HG22  THR  99          HG22      THR  99   7.806   0.135 -11.746
  857   HG23  THR  99          HG23      THR  99   8.535   0.275 -10.146
  858    H    ILE 100           H        ILE 100   9.583  -2.365  -7.980
  859    HA   ILE 100           HA       ILE 100   8.024  -4.716  -8.794
  860    HB   ILE 100           HB       ILE 100  10.234  -5.299  -7.768
  861   HG12  ILE 100          HG12      ILE 100   7.930  -6.594  -7.514
  862   HG13  ILE 100          HG13      ILE 100   9.403  -7.160  -6.741
  863   HG21  ILE 100          HG21      ILE 100  10.461  -3.457  -6.220
  864   HG22  ILE 100          HG22      ILE 100   9.073  -4.033  -5.295
  865   HG23  ILE 100          HG23      ILE 100  10.550  -4.994  -5.359
  866   HD11  ILE 100          HD11      ILE 100   7.214  -5.567  -5.427
  867   HD12  ILE 100          HD12      ILE 100   7.508  -7.296  -5.239
  868   HD13  ILE 100          HD13      ILE 100   8.691  -6.131  -4.645
  869    H    MET 101           H        MET 101   6.139  -5.106  -7.591
  870    HA   MET 101           HA       MET 101   5.123  -2.695  -6.325
  871    HB2  MET 101           HB2      MET 101   3.747  -5.294  -7.007
  872    HB3  MET 101           HB3      MET 101   2.951  -3.855  -6.386
  873    HG2  MET 101           HG2      MET 101   4.095  -2.744  -8.469
  874    HG3  MET 101           HG3      MET 101   4.063  -4.397  -9.080
  875    HE1  MET 101           HE1      MET 101   2.048  -1.327  -7.877
  876    HE2  MET 101           HE2      MET 101   0.398  -1.949  -7.798
  877    HE3  MET 101           HE3      MET 101   1.623  -2.543  -6.672
  878    H    VAL 102           H        VAL 102   5.433  -2.399  -4.320
  879    HA   VAL 102           HA       VAL 102   5.311  -4.714  -2.497
  880    HB   VAL 102           HB       VAL 102   6.724  -2.287  -1.568
  881   HG11  VAL 102          HG11      VAL 102   8.223  -4.180  -0.700
  882   HG12  VAL 102          HG12      VAL 102   6.600  -4.022  -0.024
  883   HG13  VAL 102          HG13      VAL 102   6.936  -5.252  -1.238
  884   HG21  VAL 102          HG21      VAL 102   7.908  -4.164  -3.610
  885   HG22  VAL 102          HG22      VAL 102   7.645  -2.427  -3.785
  886   HG23  VAL 102          HG23      VAL 102   8.837  -3.028  -2.631
  887    H    ASP 103           H        ASP 103   4.126  -4.595  -0.714
  888    HA   ASP 103           HA       ASP 103   1.847  -2.995  -0.756
  889    HB2  ASP 103           HB2      ASP 103   2.942  -4.436   1.652
  890    HB3  ASP 103           HB3      ASP 103   1.263  -4.024   1.321
  891    H    ASP 104           H        ASP 104   1.389  -1.084  -0.032
  892    HA   ASP 104           HA       ASP 104   3.347   0.455   1.478
  893    HB2  ASP 104           HB2      ASP 104   2.286   1.477  -0.466
  894    HB3  ASP 104           HB3      ASP 104   0.691   1.172   0.208
  895    H    SER 105           H        SER 105   0.795  -1.564   2.058
  896    HA   SER 105           HA       SER 105  -0.235  -0.167   4.400
  897    HB2  SER 105           HB2      SER 105  -1.822  -1.139   2.798
  898    HB3  SER 105           HB3      SER 105  -1.106  -2.723   3.035
  899    HG   SER 105           HG       SER 105  -1.744  -1.947   5.430
  900    H    LYS 106           H        LYS 106   2.503  -1.434   4.258
  901    HA   LYS 106           HA       LYS 106   2.298  -2.821   6.790
  902    HB2  LYS 106           HB2      LYS 106   3.774  -4.701   5.955
  903    HB3  LYS 106           HB3      LYS 106   2.098  -4.731   5.431
  904    HG2  LYS 106           HG2      LYS 106   3.112  -5.201   3.461
  905    HG3  LYS 106           HG3      LYS 106   3.094  -3.448   3.354
  906    HD2  LYS 106           HD2      LYS 106   5.374  -3.299   3.909
  907    HD3  LYS 106           HD3      LYS 106   5.424  -4.973   4.475
  908    HE2  LYS 106           HE2      LYS 106   4.947  -4.104   1.624
  909    HE3  LYS 106           HE3      LYS 106   6.479  -4.698   2.264
  910    HZ1  LYS 106           HZ1      LYS 106   3.938  -6.252   2.186
  911    HZ2  LYS 106           HZ2      LYS 106   5.433  -6.821   2.747
  912    HZ3  LYS 106           HZ3      LYS 106   5.233  -6.439   1.109
  913    H    THR 107           H        THR 107   4.597  -3.488   7.528
  914    HA   THR 107           HA       THR 107   6.037  -1.022   7.620
  915    HB   THR 107           HB       THR 107   7.594  -2.377   9.126
  916    HG1  THR 107           HG1      THR 107   5.447  -4.252   9.071
  917   HG21  THR 107          HG21      THR 107   5.826  -0.881   9.946
  918   HG22  THR 107          HG22      THR 107   6.005  -2.303  10.978
  919   HG23  THR 107          HG23      THR 107   4.663  -2.204   9.837
  920    H    VAL 108           H        VAL 108   8.505  -1.123   7.580
  921    HA   VAL 108           HA       VAL 108   9.128  -1.440   4.847
  922    HB   VAL 108           HB       VAL 108  10.841  -0.701   7.195
  923   HG11  VAL 108          HG11      VAL 108  12.256  -1.562   5.405
  924   HG12  VAL 108          HG12      VAL 108  11.477  -0.474   4.257
  925   HG13  VAL 108          HG13      VAL 108  12.452   0.183   5.570
  926   HG21  VAL 108          HG21      VAL 108  10.593   1.578   6.350
  927   HG22  VAL 108          HG22      VAL 108   9.521   0.981   5.083
  928   HG23  VAL 108          HG23      VAL 108   9.041   0.857   6.776
  929    H    THR 109           H        THR 109  10.357  -3.135   7.746
  930    HA   THR 109           HA       THR 109  12.153  -4.857   6.643
  931    HB   THR 109           HB       THR 109  10.087  -5.662   8.698
  932    HG1  THR 109           HG1      THR 109  11.141  -4.384  10.020
  933   HG21  THR 109          HG21      THR 109  12.874  -6.708   8.155
  934   HG22  THR 109          HG22      THR 109  11.369  -7.557   7.801
  935   HG23  THR 109          HG23      THR 109  11.819  -7.220   9.474
  936    H    ASP 110           H        ASP 110   8.616  -5.360   6.690
  937    HA   ASP 110           HA       ASP 110   8.668  -7.839   5.348
  938    HB2  ASP 110           HB2      ASP 110   6.733  -6.801   6.649
  939    HB3  ASP 110           HB3      ASP 110   6.421  -5.826   5.216
  940    H    MET 111           H        MET 111   8.387  -4.499   4.222
  941    HA   MET 111           HA       MET 111   7.985  -5.009   1.499
  942    HB2  MET 111           HB2      MET 111   7.629  -2.805   2.129
  943    HB3  MET 111           HB3      MET 111   9.121  -2.720   3.050
  944    HG2  MET 111           HG2      MET 111  10.415  -2.638   0.995
  945    HG3  MET 111           HG3      MET 111   8.941  -2.794   0.056
  946    HE1  MET 111           HE1      MET 111   8.228  -0.910   3.131
  947    HE2  MET 111           HE2      MET 111   9.995  -0.818   3.174
  948    HE3  MET 111           HE3      MET 111   9.038   0.651   2.962
  949    H    LEU 112           H        LEU 112  10.999  -4.629   3.338
  950    HA   LEU 112           HA       LEU 112  12.743  -4.802   1.138
  951    HB2  LEU 112           HB2      LEU 112  13.154  -4.248   3.698
  952    HB3  LEU 112           HB3      LEU 112  13.549  -5.957   3.766
  953    HG   LEU 112           HG       LEU 112  15.208  -5.548   1.902
  954   HD11  LEU 112          HD11      LEU 112  15.941  -3.206   1.618
  955   HD12  LEU 112          HD12      LEU 112  14.294  -3.480   1.047
  956   HD13  LEU 112          HD13      LEU 112  14.566  -2.683   2.597
  957   HD21  LEU 112          HD21      LEU 112  16.880  -4.540   3.390
  958   HD22  LEU 112          HD22      LEU 112  15.598  -4.095   4.513
  959   HD23  LEU 112          HD23      LEU 112  15.937  -5.796   4.193
  960    H    MET 113           H        MET 113  11.329  -7.245   3.245
  961    HA   MET 113           HA       MET 113  12.584  -9.532   2.257
  962    HB2  MET 113           HB2      MET 113  11.018  -9.421   4.215
  963    HB3  MET 113           HB3      MET 113   9.684  -9.296   3.081
  964    HG2  MET 113           HG2      MET 113  10.441 -11.487   2.108
  965    HG3  MET 113           HG3      MET 113  11.546 -11.621   3.472
  966    HE1  MET 113           HE1      MET 113  10.697 -11.682   6.039
  967    HE2  MET 113           HE2      MET 113   9.731 -10.233   5.767
  968    HE3  MET 113           HE3      MET 113   8.993 -11.662   6.491
  969    H    THR 114           H        THR 114   9.602  -7.948   1.236
  970    HA   THR 114           HA       THR 114   8.861  -9.584  -0.867
  971    HB   THR 114           HB       THR 114   8.572  -6.586  -0.663
  972    HG1  THR 114           HG1      THR 114   7.399  -8.638   0.709
  973   HG21  THR 114          HG21      THR 114   7.016  -8.603  -2.291
  974   HG22  THR 114          HG22      THR 114   8.103  -7.364  -2.924
  975   HG23  THR 114          HG23      THR 114   6.603  -6.897  -2.122
  976    H    ILE 115           H        ILE 115  11.053  -6.749  -0.922
  977    HA   ILE 115           HA       ILE 115  11.340  -6.810  -3.766
  978    HB   ILE 115           HB       ILE 115  13.079  -5.400  -1.737
  979   HG12  ILE 115          HG12      ILE 115  10.698  -4.292  -3.238
  980   HG13  ILE 115          HG13      ILE 115  10.624  -4.859  -1.572
  981   HG21  ILE 115          HG21      ILE 115  13.584  -3.889  -3.617
  982   HG22  ILE 115          HG22      ILE 115  14.098  -5.548  -3.931
  983   HG23  ILE 115          HG23      ILE 115  12.630  -4.922  -4.681
  984   HD11  ILE 115          HD11      ILE 115  12.232  -3.162  -0.912
  985   HD12  ILE 115          HD12      ILE 115  12.340  -2.605  -2.582
  986   HD13  ILE 115          HD13      ILE 115  10.826  -2.440  -1.693
  987    H    CYS 116           H        CYS 116  13.417  -7.703  -1.031
  988    HA   CYS 116           HA       CYS 116  15.666  -8.439  -2.538
  989    HB2  CYS 116           HB2      CYS 116  14.723  -9.277   0.200
  990    HB3  CYS 116           HB3      CYS 116  16.293  -9.727  -0.453
  991    HG   CYS 116           HG       CYS 116  16.258  -6.579  -0.886
  992    H    ALA 117           H        ALA 117  12.788 -10.235  -1.607
  993    HA   ALA 117           HA       ALA 117  13.725 -12.802  -2.346
  994    HB1  ALA 117           HB1      ALA 117  10.895 -11.765  -2.246
  995    HB2  ALA 117           HB2      ALA 117  11.375 -13.460  -2.315
  996    HB3  ALA 117           HB3      ALA 117  11.781 -12.486  -0.902
  997    H    ARG 118           H        ARG 118  12.437 -10.117  -4.145
  998    HA   ARG 118           HA       ARG 118  11.712 -11.516  -6.500
  999    HB2  ARG 118           HB2      ARG 118  12.634  -8.643  -6.249
 1000    HB3  ARG 118           HB3      ARG 118  11.777  -9.347  -7.611
 1001    HG2  ARG 118           HG2      ARG 118  10.681  -9.049  -4.828
 1002    HG3  ARG 118           HG3      ARG 118  10.305  -8.019  -6.201
 1003    HD2  ARG 118           HD2      ARG 118   8.522  -9.458  -6.131
 1004    HD3  ARG 118           HD3      ARG 118   9.570 -10.215  -7.325
 1005    HE   ARG 118           HE       ARG 118  10.200 -11.831  -5.640
 1006   HH11  ARG 118          HH11      ARG 118   7.401  -9.852  -4.965
 1007   HH12  ARG 118          HH12      ARG 118   6.732 -10.942  -3.793
 1008   HH21  ARG 118          HH21      ARG 118   9.329 -13.300  -4.089
 1009   HH22  ARG 118          HH22      ARG 118   7.846 -12.889  -3.268
 1010    H    ILE 119           H        ILE 119  14.714  -9.980  -5.408
 1011    HA   ILE 119           HA       ILE 119  16.107 -10.416  -7.864
 1012    HB   ILE 119           HB       ILE 119  17.686 -10.144  -5.376
 1013   HG12  ILE 119          HG12      ILE 119  15.699  -8.745  -4.862
 1014   HG13  ILE 119          HG13      ILE 119  17.170  -7.796  -5.042
 1015   HG21  ILE 119          HG21      ILE 119  17.685  -8.681  -8.009
 1016   HG22  ILE 119          HG22      ILE 119  18.889  -8.499  -6.733
 1017   HG23  ILE 119          HG23      ILE 119  18.717 -10.042  -7.570
 1018   HD11  ILE 119          HD11      ILE 119  15.013  -8.108  -7.115
 1019   HD12  ILE 119          HD12      ILE 119  15.263  -6.708  -6.071
 1020   HD13  ILE 119          HD13      ILE 119  16.477  -7.137  -7.277
 1021    H    GLY 120           H        GLY 120  15.608 -12.189  -4.917
 1022    HA2  GLY 120           HA2      GLY 120  15.950 -14.599  -4.943
 1023    HA3  GLY 120           HA3      GLY 120  17.379 -14.322  -5.930
 1024    H    ILE 121           H        ILE 121  17.170 -11.942  -3.637
 1025    HA   ILE 121           HA       ILE 121  19.430 -12.860  -2.175
 1026    HB   ILE 121           HB       ILE 121  17.523 -10.589  -1.600
 1027   HG12  ILE 121          HG12      ILE 121  20.274 -10.563  -2.852
 1028   HG13  ILE 121          HG13      ILE 121  18.757 -10.367  -3.724
 1029   HG21  ILE 121          HG21      ILE 121  18.660 -11.288   0.430
 1030   HG22  ILE 121          HG22      ILE 121  20.218 -11.178  -0.390
 1031   HG23  ILE 121          HG23      ILE 121  19.264  -9.722  -0.111
 1032   HD11  ILE 121          HD11      ILE 121  19.836  -8.503  -1.615
 1033   HD12  ILE 121          HD12      ILE 121  19.849  -8.226  -3.356
 1034   HD13  ILE 121          HD13      ILE 121  18.317  -8.304  -2.486
 1035    H    THR 122           H        THR 122  19.384 -14.386  -0.665
 1036    HA   THR 122           HA       THR 122  16.877 -15.166   0.530
 1037    HB   THR 122           HB       THR 122  18.525 -16.857  -0.239
 1038    HG1  THR 122           HG1      THR 122  16.952 -17.100   1.633
 1039   HG21  THR 122          HG21      THR 122  20.154 -15.934   2.131
 1040   HG22  THR 122          HG22      THR 122  20.593 -15.742   0.434
 1041   HG23  THR 122          HG23      THR 122  20.489 -17.354   1.141
 1042    H    ASN 123           H        ASN 123  19.816 -13.506   1.561
 1043    HA   ASN 123           HA       ASN 123  18.658 -13.283   4.258
 1044    HB2  ASN 123           HB2      ASN 123  20.975 -14.237   4.092
 1045    HB3  ASN 123           HB3      ASN 123  21.513 -12.687   3.449
 1046   HD21  ASN 123          HD21      ASN 123  22.925 -12.439   5.184
 1047   HD22  ASN 123          HD22      ASN 123  22.359 -11.985   6.757
 1048    H    HIS 124           H        HIS 124  17.337 -11.576   4.170
 1049    HA   HIS 124           HA       HIS 124  18.305  -9.125   2.871
 1050    HB2  HIS 124           HB2      HIS 124  16.009  -8.364   2.824
 1051    HB3  HIS 124           HB3      HIS 124  16.089  -9.987   2.153
 1052    HD1  HIS 124           HD1      HIS 124  14.629  -8.011   4.945
 1053    HD2  HIS 124           HD2      HIS 124  14.850 -11.987   3.755
 1054    HE1  HIS 124           HE1      HIS 124  12.859  -9.212   6.258
 1055    HE2  HIS 124           HE2      HIS 124  13.205 -11.650   5.724
 1056    H    ASP 125           H        ASP 125  18.453 -10.455   5.801
 1057    HA   ASP 125           HA       ASP 125  17.466  -8.336   7.447
 1058    HB2  ASP 125           HB2      ASP 125  17.594 -10.671   8.248
 1059    HB3  ASP 125           HB3      ASP 125  19.351 -10.594   8.159
 1060    H    GLU 126           H        GLU 126  20.416  -8.951   5.769
 1061    HA   GLU 126           HA       GLU 126  22.091  -7.304   7.400
 1062    HB2  GLU 126           HB2      GLU 126  22.503  -8.062   4.506
 1063    HB3  GLU 126           HB3      GLU 126  23.716  -7.427   5.599
 1064    HG2  GLU 126           HG2      GLU 126  23.321  -9.508   6.996
 1065    HG3  GLU 126           HG3      GLU 126  22.424 -10.125   5.613
 1066    H    TYR 127           H        TYR 127  19.488  -6.395   5.650
 1067    HA   TYR 127           HA       TYR 127  20.832  -4.041   4.508
 1068    HB2  TYR 127           HB2      TYR 127  18.355  -5.424   3.489
 1069    HB3  TYR 127           HB3      TYR 127  19.116  -4.008   2.771
 1070    HD1  TYR 127           HD1      TYR 127  21.732  -4.383   2.300
 1071    HD2  TYR 127           HD2      TYR 127  18.793  -7.442   2.510
 1072    HE1  TYR 127           HE1      TYR 127  23.160  -5.835   0.936
 1073    HE2  TYR 127           HE2      TYR 127  20.207  -8.909   1.154
 1074    HH   TYR 127           HH       TYR 127  22.023  -8.710  -0.489
 1075    H    SER 128           H        SER 128  19.943  -2.067   4.654
 1076    HA   SER 128           HA       SER 128  17.443  -1.759   6.171
 1077    HB2  SER 128           HB2      SER 128  18.337   0.617   6.516
 1078    HB3  SER 128           HB3      SER 128  19.199  -0.659   7.379
 1079    HG   SER 128           HG       SER 128  20.605   0.810   6.297
 1080    H    LEU 129           H        LEU 129  16.490   0.608   5.343
 1081    HA   LEU 129           HA       LEU 129  16.658   0.425   2.403
 1082    HB2  LEU 129           HB2      LEU 129  14.432  -0.170   3.770
 1083    HB3  LEU 129           HB3      LEU 129  14.211   1.564   3.650
 1084    HG   LEU 129           HG       LEU 129  14.753  -0.100   1.202
 1085   HD11  LEU 129          HD11      LEU 129  12.339  -0.239   0.848
 1086   HD12  LEU 129          HD12      LEU 129  12.830  -1.102   2.306
 1087   HD13  LEU 129          HD13      LEU 129  12.064   0.481   2.434
 1088   HD21  LEU 129          HD21      LEU 129  13.334   2.528   1.622
 1089   HD22  LEU 129          HD22      LEU 129  14.966   2.325   0.988
 1090   HD23  LEU 129          HD23      LEU 129  13.584   1.720   0.074
 1091    H    VAL 130           H        VAL 130  16.743   2.373   1.246
 1092    HA   VAL 130           HA       VAL 130  16.749   4.841   2.821
 1093    HB   VAL 130           HB       VAL 130  19.074   4.247   2.826
 1094   HG11  VAL 130          HG11      VAL 130  18.831   3.934  -0.150
 1095   HG12  VAL 130          HG12      VAL 130  20.338   3.879   0.764
 1096   HG13  VAL 130          HG13      VAL 130  19.100   2.653   1.031
 1097   HG21  VAL 130          HG21      VAL 130  18.610   6.337   0.707
 1098   HG22  VAL 130          HG22      VAL 130  18.616   6.608   2.451
 1099   HG23  VAL 130          HG23      VAL 130  20.095   6.109   1.631
 1100    H    ARG 131           H        ARG 131  15.386   6.192   1.868
 1101    HA   ARG 131           HA       ARG 131  14.889   5.830  -1.008
 1102    HB2  ARG 131           HB2      ARG 131  13.162   7.169   1.076
 1103    HB3  ARG 131           HB3      ARG 131  12.753   6.960  -0.625
 1104    HG2  ARG 131           HG2      ARG 131  12.845   4.505  -0.291
 1105    HG3  ARG 131           HG3      ARG 131  13.098   4.790   1.434
 1106    HD2  ARG 131           HD2      ARG 131  10.727   4.331   0.827
 1107    HD3  ARG 131           HD3      ARG 131  10.976   5.881   1.627
 1108    HE   ARG 131           HE       ARG 131  10.872   6.900  -0.622
 1109   HH11  ARG 131          HH11      ARG 131   9.409   3.760  -0.118
 1110   HH12  ARG 131          HH12      ARG 131   8.283   3.938  -1.420
 1111   HH21  ARG 131          HH21      ARG 131   9.388   7.162  -2.326
 1112   HH22  ARG 131          HH22      ARG 131   8.265   5.882  -2.684
 1113    H    GLU 132           H        GLU 132  16.341   7.141  -1.979
 1114    HA   GLU 132           HA       GLU 132  16.661   9.878  -1.262
 1115    HB2  GLU 132           HB2      GLU 132  17.295   8.424  -3.845
 1116    HB3  GLU 132           HB3      GLU 132  17.765  10.081  -3.492
 1117    HG2  GLU 132           HG2      GLU 132  19.073   9.240  -1.563
 1118    HG3  GLU 132           HG3      GLU 132  18.679   7.596  -2.070
 1119    H    LEU 133           H        LEU 133  15.070  11.306  -1.434
 1120    HA   LEU 133           HA       LEU 133  13.045  10.872  -3.510
 1121    HB2  LEU 133           HB2      LEU 133  12.824  12.847  -1.257
 1122    HB3  LEU 133           HB3      LEU 133  11.546  12.204  -2.261
 1123    HG   LEU 133           HG       LEU 133  13.024  10.801  -0.053
 1124   HD11  LEU 133          HD11      LEU 133  10.120  11.464  -0.502
 1125   HD12  LEU 133          HD12      LEU 133  10.765  10.559   0.870
 1126   HD13  LEU 133          HD13      LEU 133  11.210  12.250   0.640
 1127   HD21  LEU 133          HD21      LEU 133  11.051   9.611  -1.998
 1128   HD22  LEU 133          HD22      LEU 133  12.770   9.229  -1.902
 1129   HD23  LEU 133          HD23      LEU 133  11.698   8.815  -0.564
 1130    H    MET 134           H        MET 134  11.954  13.169  -3.925
 1131    HA   MET 134           HA       MET 134  14.069  14.987  -4.872
 1132    HB2  MET 134           HB2      MET 134  12.226  15.552  -6.645
 1133    HB3  MET 134           HB3      MET 134  13.227  14.122  -6.862
 1134    HG2  MET 134           HG2      MET 134  11.445  12.820  -6.870
 1135    HG3  MET 134           HG3      MET 134  10.946  13.432  -5.298
 1136    HE1  MET 134           HE1      MET 134  10.125  16.355  -5.585
 1137    HE2  MET 134           HE2      MET 134   8.447  16.232  -6.116
 1138    HE3  MET 134           HE3      MET 134   9.071  15.121  -4.893
 1139    H    GLU 135           H        GLU 135  12.397  14.845  -2.403
 1140    HA   GLU 135           HA       GLU 135  10.258  16.656  -2.530
 1141    HB2  GLU 135           HB2      GLU 135  11.881  15.508  -0.295
 1142    HB3  GLU 135           HB3      GLU 135  10.638  16.713   0.016
 1143    HG2  GLU 135           HG2      GLU 135   9.067  15.143  -1.238
 1144    HG3  GLU 135           HG3      GLU 135  10.340  13.933  -1.044
 1145    H    GLU 136           H        GLU 136  10.136  18.772  -2.354
 1146    HA   GLU 136           HA       GLU 136  12.417  20.426  -1.812
 1147    HB2  GLU 136           HB2      GLU 136  10.763  22.259  -1.960
 1148    HB3  GLU 136           HB3      GLU 136  10.645  21.154  -3.326
 1149    HG2  GLU 136           HG2      GLU 136   8.718  20.086  -2.362
 1150    HG3  GLU 136           HG3      GLU 136   8.857  21.074  -0.911
 1151    H    LYS 137           H        LYS 137  10.297  18.618   0.026
 1152    HA   LYS 137           HA       LYS 137  10.103  20.403   2.294
 1153    HB2  LYS 137           HB2      LYS 137   9.265  17.507   2.066
 1154    HB3  LYS 137           HB3      LYS 137   8.778  18.647   3.315
 1155    HG2  LYS 137           HG2      LYS 137   7.602  19.982   1.660
 1156    HG3  LYS 137           HG3      LYS 137   8.116  18.873   0.388
 1157    HD2  LYS 137           HD2      LYS 137   6.899  17.054   1.542
 1158    HD3  LYS 137           HD3      LYS 137   6.322  18.230   2.725
 1159    HE2  LYS 137           HE2      LYS 137   5.810  18.324  -0.246
 1160    HE3  LYS 137           HE3      LYS 137   4.655  17.797   0.978
 1161    HZ1  LYS 137           HZ1      LYS 137   4.429  20.156   0.174
 1162    HZ2  LYS 137           HZ2      LYS 137   5.869  20.503   0.996
 1163    HZ3  LYS 137           HZ3      LYS 137   4.512  19.957   1.857
 1164    H    LYS 138           H        LYS 138  11.044  16.962   2.263
 1165    HA   LYS 138           HA       LYS 138  12.958  17.459   4.375
 1166    HB2  LYS 138           HB2      LYS 138  12.323  14.931   2.843
 1167    HB3  LYS 138           HB3      LYS 138  13.406  15.024   4.224
 1168    HG2  LYS 138           HG2      LYS 138  11.504  15.824   5.588
 1169    HG3  LYS 138           HG3      LYS 138  10.462  15.557   4.188
 1170    HD2  LYS 138           HD2      LYS 138  12.193  13.364   5.258
 1171    HD3  LYS 138           HD3      LYS 138  10.627  13.709   5.991
 1172    HE2  LYS 138           HE2      LYS 138  11.142  12.972   3.112
 1173    HE3  LYS 138           HE3      LYS 138  10.437  11.930   4.346
 1174    HZ1  LYS 138           HZ1      LYS 138   9.264  14.342   3.096
 1175    HZ2  LYS 138           HZ2      LYS 138   8.651  13.692   4.540
 1176    HZ3  LYS 138           HZ3      LYS 138   8.642  12.768   3.120
 1177    H    ASP 169           H        ASP 169  13.096  16.084   1.129
 1178    HA   ASP 169           HA       ASP 169  14.809  15.497  -0.196
 1179    HB2  ASP 169           HB2      ASP 169  14.862  17.930  -0.604
 1180    HB3  ASP 169           HB3      ASP 169  15.972  18.131   0.749
 1181    H    GLU 170           H        GLU 170  15.228  13.767   1.139
 1182    HA   GLU 170           HA       GLU 170  17.768  13.919   2.573
 1183    HB2  GLU 170           HB2      GLU 170  15.244  13.808   3.809
 1184    HB3  GLU 170           HB3      GLU 170  15.878  12.171   3.900
 1185    HG2  GLU 170           HG2      GLU 170  17.354  14.619   4.829
 1186    HG3  GLU 170           HG3      GLU 170  16.391  13.570   5.871
 1187    H    LEU 171           H        LEU 171  18.625  11.725   3.010
 1188    HA   LEU 171           HA       LEU 171  18.302   9.962   0.782
 1189    HB2  LEU 171           HB2      LEU 171  19.634   9.366   3.426
 1190    HB3  LEU 171           HB3      LEU 171  19.890   8.535   1.901
 1191    HG   LEU 171           HG       LEU 171  20.720  11.334   2.607
 1192   HD11  LEU 171          HD11      LEU 171  22.974  10.469   2.221
 1193   HD12  LEU 171          HD12      LEU 171  22.152   9.588   3.508
 1194   HD13  LEU 171          HD13      LEU 171  22.304   8.869   1.905
 1195   HD21  LEU 171          HD21      LEU 171  20.925   9.871  -0.022
 1196   HD22  LEU 171          HD22      LEU 171  19.930  11.295   0.313
 1197   HD23  LEU 171          HD23      LEU 171  21.692  11.419   0.346
 1198    H    ASN 172           H        ASN 172  16.912  10.377   3.853
 1199    HA   ASN 172           HA       ASN 172  15.418   9.227   5.117
 1200    HB2  ASN 172           HB2      ASN 172  14.492   8.674   2.311
 1201    HB3  ASN 172           HB3      ASN 172  13.578   8.144   3.714
 1202   HD21  ASN 172          HD21      ASN 172  13.059  10.105   1.569
 1203   HD22  ASN 172          HD22      ASN 172  12.633  11.566   2.385
 1204    H    TRP 173           H        TRP 173  17.027   7.767   5.981
 1205    HA   TRP 173           HA       TRP 173  17.234   5.137   4.777
 1206    HB2  TRP 173           HB2      TRP 173  18.421   6.428   7.235
 1207    HB3  TRP 173           HB3      TRP 173  18.546   4.696   6.954
 1208    HD1  TRP 173           HD1      TRP 173  19.486   7.977   5.082
 1209    HE1  TRP 173           HE1      TRP 173  21.708   7.576   3.869
 1210    HE3  TRP 173           HE3      TRP 173  20.176   3.052   6.266
 1211    HZ2  TRP 173           HZ2      TRP 173  23.521   5.452   3.457
 1212    HZ3  TRP 173           HZ3      TRP 173  22.184   1.911   5.423
 1213    HH2  TRP 173           HH2      TRP 173  23.823   3.087   4.048
 1214    H    LEU 174           H        LEU 174  15.407   3.978   4.982
 1215    HA   LEU 174           HA       LEU 174  13.437   4.548   6.908
 1216    HB2  LEU 174           HB2      LEU 174  13.770   2.146   5.125
 1217    HB3  LEU 174           HB3      LEU 174  12.356   2.459   6.109
 1218    HG   LEU 174           HG       LEU 174  13.303   3.967   3.690
 1219   HD11  LEU 174          HD11      LEU 174  10.972   3.502   2.977
 1220   HD12  LEU 174          HD12      LEU 174  11.938   2.048   3.242
 1221   HD13  LEU 174          HD13      LEU 174  10.757   2.553   4.453
 1222   HD21  LEU 174          HD21      LEU 174  11.208   4.821   5.686
 1223   HD22  LEU 174          HD22      LEU 174  12.724   5.651   5.339
 1224   HD23  LEU 174          HD23      LEU 174  11.466   5.558   4.104
 1225    H    ASP 175           H        ASP 175  13.086   3.884   8.794
 1226    HA   ASP 175           HA       ASP 175  14.994   2.449  10.335
 1227    HB2  ASP 175           HB2      ASP 175  13.207   2.777  12.126
 1228    HB3  ASP 175           HB3      ASP 175  13.822   4.245  11.366
 1229    H    HIS 176           H        HIS 176  12.896   1.255   8.224
 1230    HA   HIS 176           HA       HIS 176  12.236  -0.843   7.758
 1231    HB2  HIS 176           HB2      HIS 176  13.844  -1.341  10.169
 1232    HB3  HIS 176           HB3      HIS 176  12.648  -2.575   9.770
 1233    HD1  HIS 176           HD1      HIS 176  12.824  -3.562   7.306
 1234    HD2  HIS 176           HD2      HIS 176  16.100  -1.424   8.648
 1235    HE1  HIS 176           HE1      HIS 176  14.644  -4.057   5.667
 1236    HE2  HIS 176           HE2      HIS 176  16.709  -3.070   6.739
 1237    H    GLY 177           H        GLY 177  10.742   1.158   9.667
 1238    HA2  GLY 177           HA2      GLY 177   8.686  -0.809  10.464
 1239    HA3  GLY 177           HA3      GLY 177   9.194   0.466  11.560
 1240    H    ARG 178           H        ARG 178   9.039   2.717  10.537
 1241    HA   ARG 178           HA       ARG 178   6.368   3.340  10.379
 1242    HB2  ARG 178           HB2      ARG 178   7.829   5.069  10.959
 1243    HB3  ARG 178           HB3      ARG 178   8.828   4.834   9.532
 1244    HG2  ARG 178           HG2      ARG 178   7.182   5.808   8.122
 1245    HG3  ARG 178           HG3      ARG 178   5.996   5.840   9.432
 1246    HD2  ARG 178           HD2      ARG 178   7.054   8.046   8.960
 1247    HD3  ARG 178           HD3      ARG 178   7.252   7.490  10.620
 1248    HE   ARG 178           HE       ARG 178   9.457   6.723   8.996
 1249   HH11  ARG 178          HH11      ARG 178   8.069   9.447  10.713
 1250   HH12  ARG 178          HH12      ARG 178   9.609  10.225  10.955
 1251   HH21  ARG 178          HH21      ARG 178  11.474   7.759   9.314
 1252   HH22  ARG 178          HH22      ARG 178  11.525   9.281  10.153
 1253    H    THR 179           H        THR 179   4.834   3.341   8.908
 1254    HA   THR 179           HA       THR 179   5.126   2.130   6.406
 1255    HB   THR 179           HB       THR 179   2.990   2.116   7.505
 1256    HG1  THR 179           HG1      THR 179   2.316   1.992   5.497
 1257   HG21  THR 179          HG21      THR 179   2.939   5.106   7.123
 1258   HG22  THR 179          HG22      THR 179   3.105   4.258   8.660
 1259   HG23  THR 179          HG23      THR 179   1.607   4.128   7.739
 1260    H    LEU 180           H        LEU 180   4.399   3.192   4.321
 1261    HA   LEU 180           HA       LEU 180   6.368   5.288   3.874
 1262    HB2  LEU 180           HB2      LEU 180   4.791   3.801   1.792
 1263    HB3  LEU 180           HB3      LEU 180   6.356   4.579   1.622
 1264    HG   LEU 180           HG       LEU 180   5.849   2.139   3.318
 1265   HD11  LEU 180          HD11      LEU 180   7.031   2.366   0.561
 1266   HD12  LEU 180          HD12      LEU 180   7.024   0.910   1.556
 1267   HD13  LEU 180          HD13      LEU 180   5.502   1.600   0.995
 1268   HD21  LEU 180          HD21      LEU 180   8.229   1.988   3.499
 1269   HD22  LEU 180          HD22      LEU 180   8.448   3.356   2.406
 1270   HD23  LEU 180          HD23      LEU 180   7.735   3.604   4.001
 1271    H    ARG 181           H        ARG 181   2.963   4.628   3.215
 1272    HA   ARG 181           HA       ARG 181   2.226   6.918   1.860
 1273    HB2  ARG 181           HB2      ARG 181   0.817   4.930   2.224
 1274    HB3  ARG 181           HB3      ARG 181   0.646   5.359   3.916
 1275    HG2  ARG 181           HG2      ARG 181  -0.199   7.370   1.916
 1276    HG3  ARG 181           HG3      ARG 181  -1.194   5.922   2.097
 1277    HD2  ARG 181           HD2      ARG 181  -0.403   7.845   4.278
 1278    HD3  ARG 181           HD3      ARG 181  -1.999   7.687   3.549
 1279    HE   ARG 181           HE       ARG 181  -1.537   5.201   4.484
 1280   HH11  ARG 181          HH11      ARG 181  -1.414   8.382   5.917
 1281   HH12  ARG 181          HH12      ARG 181  -1.730   7.828   7.533
 1282   HH21  ARG 181          HH21      ARG 181  -1.960   4.439   6.620
 1283   HH22  ARG 181          HH22      ARG 181  -2.026   5.584   7.934
 1284    H    GLU 182           H        GLU 182   3.030   6.530   5.183
 1285    HA   GLU 182           HA       GLU 182   1.840   9.025   6.062
 1286    HB2  GLU 182           HB2      GLU 182   1.901   7.053   7.519
 1287    HB3  GLU 182           HB3      GLU 182   3.652   7.007   7.421
 1288    HG2  GLU 182           HG2      GLU 182   3.092   7.894   9.515
 1289    HG3  GLU 182           HG3      GLU 182   3.686   9.238   8.539
 1290    H    GLN 183           H        GLN 183   4.940   7.879   4.930
 1291    HA   GLN 183           HA       GLN 183   6.540   9.909   6.148
 1292    HB2  GLN 183           HB2      GLN 183   7.127   8.133   3.785
 1293    HB3  GLN 183           HB3      GLN 183   8.312   9.118   4.626
 1294    HG2  GLN 183           HG2      GLN 183   8.041   7.815   6.625
 1295    HG3  GLN 183           HG3      GLN 183   6.750   6.874   5.870
 1296   HE21  GLN 183          HE21      GLN 183   7.842   4.930   6.052
 1297   HE22  GLN 183          HE22      GLN 183   9.229   4.572   5.078
 1298    H    GLY 184           H        GLY 184   4.755   9.669   3.183
 1299    HA2  GLY 184           HA2      GLY 184   4.287  11.564   1.792
 1300    HA3  GLY 184           HA3      GLY 184   5.779  12.304   2.364
 1301    H    VAL 185           H        VAL 185   6.361   9.125   1.868
 1302    HA   VAL 185           HA       VAL 185   7.838   9.667  -0.548
 1303    HB   VAL 185           HB       VAL 185   8.767   7.403  -0.233
 1304   HG11  VAL 185          HG11      VAL 185   9.991   7.884   1.837
 1305   HG12  VAL 185          HG12      VAL 185   9.854   9.312   0.811
 1306   HG13  VAL 185          HG13      VAL 185   8.820   9.143   2.229
 1307   HG21  VAL 185          HG21      VAL 185   8.259   6.166   1.817
 1308   HG22  VAL 185          HG22      VAL 185   7.010   7.349   2.213
 1309   HG23  VAL 185          HG23      VAL 185   6.839   6.331   0.784
 1310    H    GLU 186           H        GLU 186   7.391   8.927  -2.541
 1311    HA   GLU 186           HA       GLU 186   4.724   7.697  -2.836
 1312    HB2  GLU 186           HB2      GLU 186   6.061   9.695  -4.664
 1313    HB3  GLU 186           HB3      GLU 186   4.414   9.094  -4.791
 1314    HG2  GLU 186           HG2      GLU 186   5.452  10.690  -2.464
 1315    HG3  GLU 186           HG3      GLU 186   4.623  11.385  -3.854
 1316    H    GLU 187           H        GLU 187   5.226   7.810  -5.820
 1317    HA   GLU 187           HA       GLU 187   7.039   5.494  -5.971
 1318    HB2  GLU 187           HB2      GLU 187   4.578   6.019  -7.648
 1319    HB3  GLU 187           HB3      GLU 187   5.680   4.669  -7.858
 1320    HG2  GLU 187           HG2      GLU 187   4.010   3.672  -6.676
 1321    HG3  GLU 187           HG3      GLU 187   5.071   4.178  -5.362
 1322    H    HIS 188           H        HIS 188   7.450   8.488  -6.432
 1323    HA   HIS 188           HA       HIS 188   8.272   8.277  -9.254
 1324    HB2  HIS 188           HB2      HIS 188   8.228  10.814  -9.260
 1325    HB3  HIS 188           HB3      HIS 188   6.674  10.001  -9.191
 1326    HD1  HIS 188           HD1      HIS 188   5.118  10.801  -7.442
 1327    HD2  HIS 188           HD2      HIS 188   9.060  11.811  -6.593
 1328    HE1  HIS 188           HE1      HIS 188   5.012  12.307  -5.437
 1329    HE2  HIS 188           HE2      HIS 188   7.415  12.668  -4.782
 1330    H    GLU 189           H        GLU 189   9.434   8.471  -6.116
 1331    HA   GLU 189           HA       GLU 189  12.026   9.558  -6.966
 1332    HB2  GLU 189           HB2      GLU 189  11.669   8.529  -4.207
 1333    HB3  GLU 189           HB3      GLU 189  12.497   9.972  -4.766
 1334    HG2  GLU 189           HG2      GLU 189  10.720  10.819  -3.564
 1335    HG3  GLU 189           HG3      GLU 189  10.132  10.884  -5.227
 1336    H    THR 190           H        THR 190  13.942   8.306  -6.918
 1337    HA   THR 190           HA       THR 190  13.549   5.458  -7.108
 1338    HB   THR 190           HB       THR 190  16.141   7.010  -7.295
 1339    HG1  THR 190           HG1      THR 190  14.991   7.762  -8.982
 1340   HG21  THR 190          HG21      THR 190  16.926   5.052  -8.559
 1341   HG22  THR 190          HG22      THR 190  15.382   4.251  -8.275
 1342   HG23  THR 190          HG23      THR 190  16.452   4.607  -6.920
 1343    H    LEU 191           H        LEU 191  13.961   3.985  -5.598
 1344    HA   LEU 191           HA       LEU 191  15.055   4.969  -3.043
 1345    HB2  LEU 191           HB2      LEU 191  13.238   2.586  -3.342
 1346    HB3  LEU 191           HB3      LEU 191  13.660   3.440  -1.875
 1347    HG   LEU 191           HG       LEU 191  11.509   4.152  -2.188
 1348   HD11  LEU 191          HD11      LEU 191  12.902   6.129  -2.046
 1349   HD12  LEU 191          HD12      LEU 191  13.064   6.160  -3.802
 1350   HD13  LEU 191          HD13      LEU 191  11.488   6.429  -3.057
 1351   HD21  LEU 191          HD21      LEU 191  11.980   4.221  -5.159
 1352   HD22  LEU 191          HD22      LEU 191  11.103   2.980  -4.264
 1353   HD23  LEU 191          HD23      LEU 191  10.467   4.623  -4.347
 1354    H    LEU 192           H        LEU 192  16.567   3.656  -1.956
 1355    HA   LEU 192           HA       LEU 192  17.617   1.411  -3.550
 1356    HB2  LEU 192           HB2      LEU 192  19.504   2.829  -1.800
 1357    HB3  LEU 192           HB3      LEU 192  19.714   2.273  -3.449
 1358    HG   LEU 192           HG       LEU 192  18.086   4.728  -2.876
 1359   HD11  LEU 192          HD11      LEU 192  20.226   5.052  -1.748
 1360   HD12  LEU 192          HD12      LEU 192  21.076   4.640  -3.238
 1361   HD13  LEU 192          HD13      LEU 192  20.075   6.092  -3.164
 1362   HD21  LEU 192          HD21      LEU 192  18.002   3.741  -5.120
 1363   HD22  LEU 192          HD22      LEU 192  18.755   5.337  -5.126
 1364   HD23  LEU 192          HD23      LEU 192  19.756   3.887  -5.243
 1365    H    LEU 193           H        LEU 193  18.384  -0.385  -2.286
 1366    HA   LEU 193           HA       LEU 193  17.970  -0.081   0.602
 1367    HB2  LEU 193           HB2      LEU 193  17.928  -2.478   0.786
 1368    HB3  LEU 193           HB3      LEU 193  16.775  -1.965  -0.426
 1369    HG   LEU 193           HG       LEU 193  18.828  -2.503  -2.037
 1370   HD11  LEU 193          HD11      LEU 193  19.917  -4.591  -1.259
 1371   HD12  LEU 193          HD12      LEU 193  20.383  -3.166  -0.326
 1372   HD13  LEU 193          HD13      LEU 193  19.220  -4.314   0.338
 1373   HD21  LEU 193          HD21      LEU 193  16.949  -4.543  -0.864
 1374   HD22  LEU 193          HD22      LEU 193  16.584  -3.437  -2.190
 1375   HD23  LEU 193          HD23      LEU 193  17.803  -4.695  -2.400
 1376    H    ARG 194           H        ARG 194  19.607  -0.741   2.030
 1377    HA   ARG 194           HA       ARG 194  22.294  -0.658   0.835
 1378    HB2  ARG 194           HB2      ARG 194  21.228   0.928   3.168
 1379    HB3  ARG 194           HB3      ARG 194  22.944   0.739   2.847
 1380    HG2  ARG 194           HG2      ARG 194  21.039   1.859   0.821
 1381    HG3  ARG 194           HG3      ARG 194  21.838   2.862   2.032
 1382    HD2  ARG 194           HD2      ARG 194  23.260   1.104   0.035
 1383    HD3  ARG 194           HD3      ARG 194  22.993   2.841  -0.156
 1384    HE   ARG 194           HE       ARG 194  24.494   1.790   2.157
 1385   HH11  ARG 194          HH11      ARG 194  24.355   3.716  -0.764
 1386   HH12  ARG 194          HH12      ARG 194  25.796   4.620  -0.395
 1387   HH21  ARG 194          HH21      ARG 194  26.405   2.962   2.646
 1388   HH22  ARG 194          HH22      ARG 194  26.964   4.194   1.545
 1389    H    ARG 195           H        ARG 195  23.835  -1.887   1.826
 1390    HA   ARG 195           HA       ARG 195  22.890  -3.875   3.679
 1391    HB2  ARG 195           HB2      ARG 195  24.721  -4.068   1.789
 1392    HB3  ARG 195           HB3      ARG 195  25.794  -3.508   3.067
 1393    HG2  ARG 195           HG2      ARG 195  25.188  -5.370   4.459
 1394    HG3  ARG 195           HG3      ARG 195  23.989  -5.903   3.280
 1395    HD2  ARG 195           HD2      ARG 195  25.968  -6.037   1.646
 1396    HD3  ARG 195           HD3      ARG 195  26.979  -5.968   3.091
 1397    HE   ARG 195           HE       ARG 195  25.684  -7.975   3.859
 1398   HH11  ARG 195          HH11      ARG 195  26.144  -7.224   0.474
 1399   HH12  ARG 195          HH12      ARG 195  25.853  -8.848  -0.069
 1400   HH21  ARG 195          HH21      ARG 195  25.250 -10.129   3.154
 1401   HH22  ARG 195          HH22      ARG 195  25.347 -10.496   1.450
 1402    H    LYS 196           H        LYS 196  22.665  -3.454   5.738
 1403    HA   LYS 196           HA       LYS 196  24.173  -1.321   7.014
 1404    HB2  LYS 196           HB2      LYS 196  21.751  -1.499   7.422
 1405    HB3  LYS 196           HB3      LYS 196  21.982  -3.111   8.087
 1406    HG2  LYS 196           HG2      LYS 196  23.293  -2.201   9.909
 1407    HG3  LYS 196           HG3      LYS 196  23.143  -0.580   9.229
 1408    HD2  LYS 196           HD2      LYS 196  20.689  -0.743   9.487
 1409    HD3  LYS 196           HD3      LYS 196  20.902  -2.315  10.261
 1410    HE2  LYS 196           HE2      LYS 196  20.618  -0.504  11.900
 1411    HE3  LYS 196           HE3      LYS 196  22.186  -1.297  12.045
 1412    HZ1  LYS 196           HZ1      LYS 196  22.256   1.176  12.164
 1413    HZ2  LYS 196           HZ2      LYS 196  21.759   1.227  10.543
 1414    HZ3  LYS 196           HZ3      LYS 196  23.241   0.512  10.954
 1415    H    PHE 197           H        PHE 197  23.677  -4.816   7.285
 1416    HA   PHE 197           HA       PHE 197  25.943  -5.005   9.119
 1417    HB2  PHE 197           HB2      PHE 197  24.225  -7.233   8.002
 1418    HB3  PHE 197           HB3      PHE 197  25.417  -7.368   9.291
 1419    HD1  PHE 197           HD1      PHE 197  24.783  -4.994  10.904
 1420    HD2  PHE 197           HD2      PHE 197  22.203  -7.800   9.013
 1421    HE1  PHE 197           HE1      PHE 197  23.046  -4.510  12.573
 1422    HE2  PHE 197           HE2      PHE 197  20.454  -7.314  10.674
 1423    HZ   PHE 197           HZ       PHE 197  20.851  -5.708  12.444
 1424    H    PHE 198           H        PHE 198  27.871  -6.014   8.540
 1425    HA   PHE 198           HA       PHE 198  28.191  -6.205   5.614
 1426    HB2  PHE 198           HB2      PHE 198  30.015  -4.936   7.649
 1427    HB3  PHE 198           HB3      PHE 198  30.522  -5.309   6.004
 1428    HD1  PHE 198           HD1      PHE 198  28.915  -4.372   4.129
 1429    HD2  PHE 198           HD2      PHE 198  29.185  -2.857   8.095
 1430    HE1  PHE 198           HE1      PHE 198  27.983  -2.226   3.369
 1431    HE2  PHE 198           HE2      PHE 198  28.257  -0.711   7.345
 1432    HZ   PHE 198           HZ       PHE 198  27.661  -0.402   4.935
 1433    H    TYR 199           H        TYR 199  27.743  -8.397   7.524
 1434    HA   TYR 199           HA       TYR 199  30.322  -9.718   7.527
 1435    HB2  TYR 199           HB2      TYR 199  29.198 -11.625   8.567
 1436    HB3  TYR 199           HB3      TYR 199  28.879 -10.137   9.439
 1437    HD1  TYR 199           HD1      TYR 199  26.633  -9.145   9.414
 1438    HD2  TYR 199           HD2      TYR 199  27.431 -12.855   7.496
 1439    HE1  TYR 199           HE1      TYR 199  24.219  -9.581   9.268
 1440    HE2  TYR 199           HE2      TYR 199  25.017 -13.298   7.336
 1441    HH   TYR 199           HH       TYR 199  22.663 -10.888   7.935
 1442    H    SER 200           H        SER 200  27.440  -9.579   5.620
 1443    HA   SER 200           HA       SER 200  27.004 -10.264   3.517
 1444    HB2  SER 200           HB2      SER 200  30.007 -10.589   3.384
 1445    HB3  SER 200           HB3      SER 200  28.922 -10.535   1.994
 1446    HG   SER 200           HG       SER 200  30.022  -8.497   3.295
 1447    H    ASP 201           H        ASP 201  26.356 -12.153   5.206
 1448    HA   ASP 201           HA       ASP 201  25.816 -14.348   5.388
 1449    HB2  ASP 201           HB2      ASP 201  25.197 -14.044   3.039
 1450    HB3  ASP 201           HB3      ASP 201  26.837 -14.430   2.542
 1451    H    GLN 202           H        GLN 202  28.748 -13.346   5.706
 1452    HA   GLN 202           HA       GLN 202  30.103 -15.938   5.596
 1453    HB2  GLN 202           HB2      GLN 202  31.287 -14.055   4.590
 1454    HB3  GLN 202           HB3      GLN 202  31.176 -13.157   6.096
 1455    HG2  GLN 202           HG2      GLN 202  32.593 -14.822   7.189
 1456    HG3  GLN 202           HG3      GLN 202  32.713 -15.708   5.669
 1457   HE21  GLN 202          HE21      GLN 202  32.827 -13.280   4.059
 1458   HE22  GLN 202          HE22      GLN 202  34.418 -12.637   4.287