*HEADER    METAL BINDING PROTEIN                   29-MAY-07   2JQ6              
*TITLE     STRUCTURE OF EH-DOMAIN OF EHD1                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: EH DOMAIN-CONTAINING PROTEIN 1;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: EH DOMAIN, SEQUENCE DATABASE RESIDUES 401-534;             
*COMPND   5 SYNONYM: TESTILIN, HPAST1;                                           
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: EHD1, PAST, PAST1;                                             
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PGEX 6P-2                                  
*KEYWDS    EH DOMAIN, EHD-1, METAL BINDING PROTEIN                               
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    F.P.KIEKEN, M.JOVIC, S.CAPLAN, P.L.SORGEN                             
*REVDAT   1   15-APR-08 2JQ6    0                                                


 ASSI {    1}
   (( segid "    " and resid 90   and name HE1 ))
   (( segid "    " and resid 91   and name HA  ))
      3.500     1.500     1.500 peak     1 spectrum    1 weight  0.11000E+01 volume  0.17375E-02 ppm1     10.362 ppm2      3.851 CV     1
 ASSI {    1}
   (( segid "    " and resid 90   and name HE1 ))
   (( segid "    " and resid 94   and name HB2 ))
      4.800     2.900     1.200 peak     1 spectrum    1 weight  0.11000E+01 volume  0.21622E-03 ppm1     10.359 ppm2      2.230 CV     1
 ASSI {    2}
   (( segid "    " and resid 90   and name HE1 ))
   (( segid "    " and resid 94   and name HB1 ))
      3.700     1.700     1.700 peak     2 spectrum    1 weight  0.11000E+01 volume  0.51714E-03 ppm1     10.358 ppm2      1.217 CV     1
 ASSI {    3}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 45   and name HG2%)
      3.400     1.400     1.400 peak     3 spectrum    1 weight  0.11000E+01 volume  0.79166E-03 ppm1      9.190 ppm2      0.806 CV     1
 ASSI {    4}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      2.500     0.800     0.800 peak     4 spectrum    1 weight  0.11000E+01 volume  0.28185E-02 ppm1      8.318 ppm2      4.521 CV     1
 ASSI {    5}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.200     1.300     1.300 peak     5 spectrum    1 weight  0.11000E+01 volume  0.11257E-02 ppm1      8.320 ppm2      3.480 CV     1
 ASSI {    6}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 105  and name HG2 ))
      4.100     2.100     1.900 peak     6 spectrum    1 weight  0.11000E+01 volume  0.43662E-03 ppm1      8.318 ppm2      2.925 CV     1
 ASSI {    7}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      4.100     2.100     1.900 peak     7 spectrum    1 weight  0.11000E+01 volume  0.16526E-02 ppm1      8.318 ppm2      2.262 CV     1
 ASSI {    8}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      2.800     0.900     0.900 peak     8 spectrum    1 weight  0.11000E+01 volume  0.22114E-02 ppm1      8.317 ppm2      1.789 CV     1
 ASSI {    9}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      2.400     0.700     0.700 peak     9 spectrum    1 weight  0.11000E+01 volume  0.67044E-02 ppm1      8.317 ppm2      1.046 CV     1
 ASSI {   10}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      4.800     2.900     1.200 peak    10 spectrum    1 weight  0.11000E+01 volume  0.63041E-03 ppm1      8.317 ppm2      0.059 CV     1
 ASSI {   11}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      2.400     0.700     0.700 peak    11 spectrum    1 weight  0.11000E+01 volume  0.49363E-02 ppm1      8.170 ppm2      4.686 CV     1
 ASSI {   12}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      3.200     1.300     1.300 peak    12 spectrum    1 weight  0.11000E+01 volume  0.14309E-02 ppm1      8.171 ppm2      4.096 CV     1
 ASSI {   13}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HB2 ))
      4.200     2.200     1.800 peak    13 spectrum    1 weight  0.11000E+01 volume  0.17338E-02 ppm1      8.169 ppm2      3.124 CV     1
 ASSI {   14}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HG1 ))
      3.800     1.900     1.900 peak    14 spectrum    1 weight  0.11000E+01 volume  0.86132E-03 ppm1      8.169 ppm2      2.105 CV     1
 ASSI {   15}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HB1 ))
      3.100     1.200     1.200 peak    15 spectrum    1 weight  0.11000E+01 volume  0.26866E-02 ppm1      8.169 ppm2      1.847 CV     1
 ASSI {   16}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
      3.000     3.000     3.000 peak    16 spectrum    1 weight  0.11000E+01 volume  0.14413E-02 ppm1      8.441 ppm2      4.059 CV     1
 ASSI {   17}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB1 ))
      4.400     2.400     1.600 peak    17 spectrum    1 weight  0.11000E+01 volume  0.30423E-03 ppm1      8.441 ppm2      1.749 CV     1
 ASSI {   18}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      2.200     0.600     0.600 peak    18 spectrum    1 weight  0.11000E+01 volume  0.77634E-02 ppm1      8.494 ppm2      4.131 CV     1
 ASSI {   19}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HB1 ))
      2.300     0.700     0.700 peak    19 spectrum    1 weight  0.11000E+01 volume  0.77571E-02 ppm1      8.495 ppm2      2.009 CV     1
 ASSI {   21}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      4.000     2.000     2.000 peak    21 spectrum    1 weight  0.11000E+01 volume  0.48549E-03 ppm1      9.079 ppm2      4.494 CV     1
 ASSI {   22}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      2.500     0.800     0.800 peak    22 spectrum    1 weight  0.11000E+01 volume  0.29889E-02 ppm1      9.079 ppm2      3.072 CV     1
 ASSI {   23}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HB  ))
      3.000     1.100     1.100 peak    23 spectrum    1 weight  0.11000E+01 volume  0.10660E-02 ppm1      9.079 ppm2      2.387 CV     1
 ASSI {   24}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 56   and name HG2%)
      3.700     1.700     1.700 peak    24 spectrum    1 weight  0.11000E+01 volume  0.12387E-02 ppm1      9.079 ppm2      1.083 CV     1
 ASSI {   25}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      2.600     0.800     0.800 peak    25 spectrum    1 weight  0.11000E+01 volume  0.38131E-02 ppm1      8.200 ppm2      4.048 CV     1
 ASSI {   26}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HB  ))
      3.100     1.200     1.200 peak    26 spectrum    1 weight  0.11000E+01 volume  0.15336E-02 ppm1      8.199 ppm2      1.999 CV     1
 ASSI {   27}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 14   and name HG2%)
      3.300     1.400     1.400 peak    27 spectrum    1 weight  0.11000E+01 volume  0.15030E-02 ppm1      8.200 ppm2      0.883 CV     1
 ASSI {   28}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      3.300     1.400     1.400 peak    28 spectrum    1 weight  0.11000E+01 volume  0.51324E-03 ppm1      8.081 ppm2      3.757 CV     1
 ASSI {   29}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      4.200     2.200     1.800 peak    29 spectrum    1 weight  0.11000E+01 volume  0.81006E-03 ppm1      8.082 ppm2      3.168 CV     1
 ASSI {   30}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HB1 ))
      2.700     0.900     0.900 peak    30 spectrum    1 weight  0.11000E+01 volume  0.12146E-02 ppm1      8.082 ppm2      3.021 CV     1
 ASSI {   31}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 107  and name HB% )
      2.400     0.700     0.700 peak    31 spectrum    1 weight  0.11000E+01 volume  0.39441E-02 ppm1      8.081 ppm2      1.815 CV     1
 ASSI {   32}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      6.000     4.700     0.000 peak    32 spectrum    1 weight  0.11000E+01 volume  0.12109E-03 ppm1      8.081 ppm2      0.483 CV     1
 ASSI {   34}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 109  and name HB% )
      5.500     3.700     0.500 peak    34 spectrum    1 weight  0.11000E+01 volume  0.19997E-03 ppm1      8.077 ppm2      1.195 CV     1
 ASSI {   35}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      2.900     1.000     1.000 peak    35 spectrum    1 weight  0.11000E+01 volume  0.16797E-02 ppm1      8.834 ppm2      4.247 CV     1
 ASSI {   36}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      4.800     2.900     1.200 peak    36 spectrum    1 weight  0.11000E+01 volume  0.19334E-03 ppm1      8.831 ppm2      3.522 CV     1
 ASSI {   37}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
      5.100     3.200     0.900 peak    37 spectrum    1 weight  0.11000E+01 volume  0.67666E-03 ppm1      8.825 ppm2      1.982 CV     1
 ASSI {   38}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      3.500     1.500     1.500 peak    38 spectrum    1 weight  0.11000E+01 volume  0.90618E-03 ppm1      8.196 ppm2      4.273 CV     1
 ASSI {   39}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HA2 ))
      2.600     0.800     0.800 peak    39 spectrum    1 weight  0.11000E+01 volume  0.29226E-02 ppm1      8.196 ppm2      3.872 CV     1
 ASSI {   40}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      3.100     1.200     1.200 peak    40 spectrum    1 weight  0.11000E+01 volume  0.18837E-02 ppm1      8.196 ppm2      1.327 CV     1
 ASSI {   41}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      3.300     1.300     1.300 peak    41 spectrum    1 weight  0.11000E+01 volume  0.86951E-03 ppm1      8.131 ppm2      4.389 CV     1
 ASSI {   42}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HB1 ))
      3.800     1.800     1.800 peak    42 spectrum    1 weight  0.11000E+01 volume  0.55482E-03 ppm1      8.132 ppm2      1.579 CV     1
 ASSI {   43}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 106  and name HE% )
      6.000     6.000     0.000 peak    43 spectrum    1 weight  0.11000E+01 volume  0.37871E-04 ppm1      7.352 ppm2      5.984 CV     1
 ASSI {   44}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      3.000     1.200     1.200 peak    44 spectrum    1 weight  0.11000E+01 volume  0.14002E-02 ppm1      7.349 ppm2      4.454 CV     1
 ASSI {   45}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      2.600     0.900     0.900 peak    45 spectrum    1 weight  0.11000E+01 volume  0.29349E-02 ppm1      7.351 ppm2      4.097 CV     1
 ASSI {   46}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HA2 ))
      2.900     1.100     1.100 peak    46 spectrum    1 weight  0.11000E+01 volume  0.52085E-02 ppm1      7.350 ppm2      3.939 CV     1
 ASSI {   47}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 58   and name HB2 ))
      4.700     2.800     1.300 peak    47 spectrum    1 weight  0.11000E+01 volume  0.54499E-03 ppm1      7.350 ppm2      3.417 CV     1
 ASSI {   48}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      3.500     1.500     1.500 peak    48 spectrum    1 weight  0.11000E+01 volume  0.52456E-03 ppm1      7.349 ppm2      3.084 CV     1
 ASSI {   49}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HG  ))
      2.200     0.600     0.600 peak    49 spectrum    1 weight  0.11000E+01 volume  0.74257E-02 ppm1      7.350 ppm2      1.574 CV     1
 ASSI {   50}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 60   and name HD2%)
      3.600     1.600     1.600 peak    50 spectrum    1 weight  0.11000E+01 volume  0.23255E-02 ppm1      7.348 ppm2      0.696 CV     1
 ASSI {   51}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
      4.400     2.400     1.600 peak    51 spectrum    1 weight  0.11000E+01 volume  0.98948E-03 ppm1      7.347 ppm2      0.468 CV     1
 ASSI {   52}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      5.400     3.700     0.600 peak    52 spectrum    1 weight  0.11000E+01 volume  0.14641E-03 ppm1      7.347 ppm2     -0.041 CV     1
 ASSI {   53}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HB  ))
      3.400     1.400     1.400 peak    53 spectrum    1 weight  0.11000E+01 volume  0.78496E-03 ppm1      7.191 ppm2      1.952 CV     1
 ASSI {   55}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HB2 ))
      3.000     1.200     1.200 peak    55 spectrum    1 weight  0.11000E+01 volume  0.44448E-02 ppm1      8.959 ppm2      2.072 CV     1
 ASSI {   56}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HA1 ))
      4.200     2.200     1.800 peak    56 spectrum    1 weight  0.11000E+01 volume  0.53540E-03 ppm1      8.150 ppm2      3.899 CV     1
 ASSI {   57}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 18   and name HB% )
      3.800     1.800     1.800 peak    57 spectrum    1 weight  0.11000E+01 volume  0.52181E-03 ppm1      8.148 ppm2      1.212 CV     1
 ASSI {   59}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      2.700     0.900     0.900 peak    59 spectrum    1 weight  0.11000E+01 volume  0.39124E-02 ppm1      7.055 ppm2      3.925 CV     1
 ASSI {   60}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
      3.300     1.400     1.400 peak    60 spectrum    1 weight  0.11000E+01 volume  0.22517E-02 ppm1      7.056 ppm2      3.169 CV     1
 ASSI {   61}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      5.000     3.100     1.000 peak    61 spectrum    1 weight  0.11000E+01 volume  0.25908E-03 ppm1      7.054 ppm2      2.315 CV     1
 ASSI {   62}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HG2 ))
      3.800     1.800     1.800 peak    62 spectrum    1 weight  0.11000E+01 volume  0.89389E-03 ppm1      7.054 ppm2      1.831 CV     1
 ASSI {   63}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 52   and name HG2%)
      3.800     1.800     1.800 peak    63 spectrum    1 weight  0.11000E+01 volume  0.12056E-02 ppm1      7.056 ppm2      1.100 CV     1
 ASSI {   64}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      3.300     1.400     1.400 peak    64 spectrum    1 weight  0.11000E+01 volume  0.98162E-03 ppm1      8.959 ppm2      3.794 CV     1
 ASSI {   66}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      4.100     2.100     1.900 peak    66 spectrum    1 weight  0.11000E+01 volume  0.33482E-03 ppm1      8.958 ppm2      4.533 CV     1
 ASSI {   67}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      3.000     1.100     1.100 peak    67 spectrum    1 weight  0.11000E+01 volume  0.17193E-02 ppm1      8.958 ppm2      4.072 CV     1
 ASSI {   69}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      2.900     1.100     1.100 peak    69 spectrum    1 weight  0.11000E+01 volume  0.23147E-02 ppm1      8.957 ppm2      1.447 CV     1
 ASSI {   70}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      2.600     0.800     0.800 peak    70 spectrum    1 weight  0.11000E+01 volume  0.39190E-02 ppm1      8.863 ppm2      4.622 CV     1
 ASSI {   71}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HA  ))
      2.900     1.100     1.100 peak    71 spectrum    1 weight  0.11000E+01 volume  0.18272E-02 ppm1      8.862 ppm2      4.158 CV     1
 ASSI {   72}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 127  and name HD1 ))
      5.100     3.200     0.900 peak    72 spectrum    1 weight  0.11000E+01 volume  0.14517E-03 ppm1      8.863 ppm2      3.465 CV     1
 ASSI {   73}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
      3.500     1.600     1.600 peak    73 spectrum    1 weight  0.11000E+01 volume  0.23329E-02 ppm1      8.864 ppm2      2.482 CV     1
 ASSI {   74}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB1 ))
      3.400     1.400     1.400 peak    74 spectrum    1 weight  0.11000E+01 volume  0.26791E-02 ppm1      8.863 ppm2      2.333 CV     1
 ASSI {   75}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HB1 ))
      2.400     0.700     0.700 peak    75 spectrum    1 weight  0.11000E+01 volume  0.69347E-02 ppm1      8.863 ppm2      1.541 CV     1
 ASSI {   76}
   (( segid "    " and resid 126  and name HN  ))
   (  segid "    " and resid 126  and name HD1%)
      3.200     3.200     2.800 peak    76 spectrum    1 weight  0.11000E+01 volume  0.37226E-02 ppm1      8.863 ppm2      0.918 CV     1
 ASSI {   78}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
      2.400     0.700     0.700 peak    78 spectrum    1 weight  0.11000E+01 volume  0.42802E-02 ppm1      8.666 ppm2      4.305 CV     1
 ASSI {   80}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HG  ))
      3.000     1.100     1.100 peak    80 spectrum    1 weight  0.11000E+01 volume  0.34847E-02 ppm1      8.666 ppm2      1.667 CV     1
 ASSI {   81}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 122  and name HD1%)
      3.000     1.100     1.100 peak    81 spectrum    1 weight  0.11000E+01 volume  0.24423E-02 ppm1      8.666 ppm2      0.813 CV     1
 ASSI {   82}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
      2.900     1.100     1.100 peak    82 spectrum    1 weight  0.11000E+01 volume  0.29671E-02 ppm1      8.665 ppm2      1.967 CV     1
 ASSI {   83}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
      3.500     1.600     1.600 peak    83 spectrum    1 weight  0.11000E+01 volume  0.94405E-03 ppm1      8.665 ppm2      1.153 CV     1
 ASSI {   84}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      2.300     0.700     0.700 peak    84 spectrum    1 weight  0.11000E+01 volume  0.73756E-02 ppm1      8.366 ppm2      4.119 CV     1
 ASSI {   86}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
      2.800     1.000     1.000 peak    86 spectrum    1 weight  0.11000E+01 volume  0.55491E-02 ppm1      8.366 ppm2      2.559 CV     1
 ASSI {   87}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
      3.100     1.200     1.200 peak    87 spectrum    1 weight  0.11000E+01 volume  0.15260E-02 ppm1      8.366 ppm2      1.788 CV     1
 ASSI {   88}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HG12))
      5.200     3.400     0.800 peak    88 spectrum    1 weight  0.11000E+01 volume  0.38165E-03 ppm1      8.367 ppm2      1.334 CV     1
 ASSI {   89}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 39   and name HD1%)
      3.900     1.900     1.900 peak    89 spectrum    1 weight  0.11000E+01 volume  0.24058E-02 ppm1      8.366 ppm2      0.821 CV     1
 ASSI {   90}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      2.900     1.000     1.000 peak    90 spectrum    1 weight  0.11000E+01 volume  0.30480E-02 ppm1      8.363 ppm2      4.600 CV     1
 ASSI {   92}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      3.000     1.100     1.100 peak    92 spectrum    1 weight  0.11000E+01 volume  0.11642E-02 ppm1      6.905 ppm2      3.672 CV     1
 ASSI {   94}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      2.200     0.600     0.600 peak    94 spectrum    1 weight  0.11000E+01 volume  0.31262E-02 ppm1      6.905 ppm2      2.130 CV     1
 ASSI {   95}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
      4.400     2.400     1.600 peak    95 spectrum    1 weight  0.11000E+01 volume  0.17637E-02 ppm1      6.906 ppm2      1.893 CV     1
 ASSI {   96}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      5.400     3.600     0.600 peak    96 spectrum    1 weight  0.11000E+01 volume  0.34274E-03 ppm1      6.904 ppm2      1.560 CV     1
 ASSI {  100}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      5.300     3.500     0.700 peak   100 spectrum    1 weight  0.11000E+01 volume  0.24160E-03 ppm1      7.975 ppm2      3.215 CV     1
 ASSI {  101}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      3.400     1.400     1.400 peak   101 spectrum    1 weight  0.11000E+01 volume  0.98456E-03 ppm1      7.976 ppm2      2.836 CV     1
 ASSI {  102}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HG1 ))
      3.900     1.900     1.900 peak   102 spectrum    1 weight  0.11000E+01 volume  0.23559E-02 ppm1      7.974 ppm2      2.503 CV     1
 ASSI {  103}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HB2 ))
      2.900     1.100     1.100 peak   103 spectrum    1 weight  0.11000E+01 volume  0.34810E-02 ppm1      7.975 ppm2      2.059 CV     1
 ASSI {  104}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 107  and name HB% )
      3.700     3.700     2.300 peak   104 spectrum    1 weight  0.11000E+01 volume  0.21134E-02 ppm1      7.973 ppm2      1.781 CV     1
 ASSI {  105}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HA  ))
      3.200     1.300     1.300 peak   105 spectrum    1 weight  0.11000E+01 volume  0.10888E-02 ppm1      7.972 ppm2      4.038 CV     1
 ASSI {  106}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      2.900     1.100     1.100 peak   106 spectrum    1 weight  0.11000E+01 volume  0.14233E-02 ppm1      9.563 ppm2      4.460 CV     1
 ASSI {  107}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      4.000     2.000     2.000 peak   107 spectrum    1 weight  0.11000E+01 volume  0.75938E-03 ppm1      9.564 ppm2      3.953 CV     1
 ASSI {  108}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
      3.500     1.500     1.500 peak   108 spectrum    1 weight  0.11000E+01 volume  0.18690E-02 ppm1      9.563 ppm2      3.163 CV     1
 ASSI {  109}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HB1 ))
      2.400     0.700     0.700 peak   109 spectrum    1 weight  0.11000E+01 volume  0.42099E-02 ppm1      9.563 ppm2      2.824 CV     1
 ASSI {  110}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 51   and name HB1 ))
      4.600     2.600     1.400 peak   110 spectrum    1 weight  0.11000E+01 volume  0.58869E-03 ppm1      9.563 ppm2      1.834 CV     1
 ASSI {  111}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 52   and name HG2%)
      6.000     4.700     0.000 peak   111 spectrum    1 weight  0.11000E+01 volume  0.13723E-03 ppm1      9.560 ppm2      1.109 CV     1
 ASSI {  112}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 112  and name HG  ))
      3.900     1.900     1.900 peak   112 spectrum    1 weight  0.11000E+01 volume  0.13372E-02 ppm1      8.326 ppm2      1.915 CV     1
 ASSI {  113}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      4.200     2.200     1.800 peak   113 spectrum    1 weight  0.11000E+01 volume  0.10136E-02 ppm1      8.324 ppm2      0.501 CV     1
 ASSI {  114}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 46   and name HG1%)
      5.100     5.100     0.900 peak   114 spectrum    1 weight  0.11000E+01 volume  0.33613E-03 ppm1      8.325 ppm2     -0.203 CV     1
 ASSI {  115}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      2.900     1.000     1.000 peak   115 spectrum    1 weight  0.11000E+01 volume  0.23549E-02 ppm1      8.322 ppm2      4.066 CV     1
 ASSI {  116}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HB2 ))
      2.600     0.900     0.900 peak   116 spectrum    1 weight  0.11000E+01 volume  0.24990E-02 ppm1      8.323 ppm2      3.271 CV     1
 ASSI {  117}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HB1 ))
      2.700     0.900     0.900 peak   117 spectrum    1 weight  0.11000E+01 volume  0.21430E-02 ppm1      8.323 ppm2      3.008 CV     1
 ASSI {  118}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 112  and name HD1%)
      4.600     4.600     1.400 peak   118 spectrum    1 weight  0.11000E+01 volume  0.87120E-03 ppm1      8.322 ppm2      0.765 CV     1
 ASSI {  119}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      2.700     0.900     0.900 peak   119 spectrum    1 weight  0.11000E+01 volume  0.37163E-02 ppm1      8.091 ppm2      4.566 CV     1
 ASSI {  120}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
      3.700     1.800     1.800 peak   120 spectrum    1 weight  0.11000E+01 volume  0.12814E-02 ppm1      8.092 ppm2      2.638 CV     1
 ASSI {  121}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      2.500     0.800     0.800 peak   121 spectrum    1 weight  0.11000E+01 volume  0.21316E-02 ppm1      9.181 ppm2      5.816 CV     1
 ASSI {  122}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
      2.500     0.800     0.800 peak   122 spectrum    1 weight  0.11000E+01 volume  0.73548E-03 ppm1      9.182 ppm2      2.504 CV     1
 ASSI {  123}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
      3.400     1.400     1.400 peak   123 spectrum    1 weight  0.11000E+01 volume  0.12259E-02 ppm1      9.182 ppm2      2.233 CV     1
 ASSI {  124}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.600     1.600     1.600 peak   124 spectrum    1 weight  0.11000E+01 volume  0.13813E-02 ppm1      9.182 ppm2      1.575 CV     1
 ASSI {  125}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      4.300     2.300     1.700 peak   125 spectrum    1 weight  0.11000E+01 volume  0.14574E-02 ppm1      9.181 ppm2      0.060 CV     1
 ASSI {  126}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      5.200     3.400     0.800 peak   126 spectrum    1 weight  0.11000E+01 volume  0.33581E-03 ppm1      9.178 ppm2      1.825 CV     1
 ASSI {  127}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      4.200     2.200     1.800 peak   127 spectrum    1 weight  0.11000E+01 volume  0.25009E-03 ppm1      8.726 ppm2      4.970 CV     1
 ASSI {  128}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      2.400     0.700     0.700 peak   128 spectrum    1 weight  0.11000E+01 volume  0.59153E-02 ppm1      8.726 ppm2      4.176 CV     1
 ASSI {  129}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HB  ))
      2.700     0.900     0.900 peak   129 spectrum    1 weight  0.11000E+01 volume  0.32818E-02 ppm1      8.725 ppm2      1.937 CV     1
 ASSI {  130}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
      2.900     1.100     1.100 peak   130 spectrum    1 weight  0.11000E+01 volume  0.17242E-02 ppm1      8.727 ppm2      1.524 CV     1
 ASSI {  131}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
      3.500     1.500     1.500 peak   131 spectrum    1 weight  0.11000E+01 volume  0.16096E-02 ppm1      8.728 ppm2      1.216 CV     1
 ASSI {  132}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      2.700     2.700     3.300 peak   132 spectrum    1 weight  0.11000E+01 volume  0.39922E-02 ppm1      8.727 ppm2      0.929 CV     1
 ASSI {  133}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      4.200     2.300     1.800 peak   133 spectrum    1 weight  0.11000E+01 volume  0.12063E-02 ppm1      8.725 ppm2     -0.045 CV     1
 ASSI {  134}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      2.900     1.100     1.100 peak   134 spectrum    1 weight  0.11000E+01 volume  0.15925E-02 ppm1      8.272 ppm2      4.340 CV     1
 ASSI {  136}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      2.600     0.800     0.800 peak   136 spectrum    1 weight  0.11000E+01 volume  0.41170E-02 ppm1      7.433 ppm2      4.057 CV     1
 ASSI {  137}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HE1 ))
      3.900     1.900     1.900 peak   137 spectrum    1 weight  0.11000E+01 volume  0.56286E-03 ppm1      7.433 ppm2      2.960 CV     1
 ASSI {  140}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HD1 ))
      3.600     1.600     1.600 peak   140 spectrum    1 weight  0.11000E+01 volume  0.42818E-02 ppm1      7.433 ppm2      1.733 CV     1
 ASSI {  141}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HG1 ))
      3.400     1.400     1.400 peak   141 spectrum    1 weight  0.11000E+01 volume  0.14814E-02 ppm1      7.432 ppm2      1.425 CV     1
 ASSI {  143}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      6.000     6.000     0.000 peak   143 spectrum    1 weight  0.11000E+01 volume  0.36038E-04 ppm1      7.434 ppm2      0.757 CV     1
 ASSI {  144}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      3.900     1.900     1.900 peak   144 spectrum    1 weight  0.11000E+01 volume  0.47150E-03 ppm1      8.792 ppm2      4.646 CV     1
 ASSI {  145}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.000     1.200     1.200 peak   145 spectrum    1 weight  0.11000E+01 volume  0.14145E-02 ppm1      8.791 ppm2      4.061 CV     1
 ASSI {  148}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 72   and name HB% )
      2.300     0.600     0.600 peak   148 spectrum    1 weight  0.11000E+01 volume  0.59837E-02 ppm1      8.794 ppm2      1.776 CV     1
 ASSI {  149}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 67   and name HG12))
      4.900     4.900     1.100 peak   149 spectrum    1 weight  0.11000E+01 volume  0.37473E-03 ppm1      8.792 ppm2      1.488 CV     1
 ASSI {  150}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 70   and name HB% )
      3.900     1.900     1.900 peak   150 spectrum    1 weight  0.11000E+01 volume  0.19157E-02 ppm1      8.794 ppm2      1.312 CV     1
 ASSI {  151}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
      3.400     1.400     1.400 peak   151 spectrum    1 weight  0.11000E+01 volume  0.10790E-02 ppm1      8.793 ppm2      0.442 CV     1
 ASSI {  152}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.900     1.900     1.900 peak   152 spectrum    1 weight  0.11000E+01 volume  0.81854E-03 ppm1      8.337 ppm2      4.501 CV     1
 ASSI {  153}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      3.000     1.100     1.100 peak   153 spectrum    1 weight  0.11000E+01 volume  0.19524E-02 ppm1      8.336 ppm2      3.904 CV     1
 ASSI {  154}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA1 ))
      3.000     1.100     1.100 peak   154 spectrum    1 weight  0.11000E+01 volume  0.10631E-02 ppm1      8.335 ppm2      3.562 CV     1
 ASSI {  155}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 70   and name HB% )
      2.500     0.800     0.800 peak   155 spectrum    1 weight  0.11000E+01 volume  0.62082E-02 ppm1      8.335 ppm2      1.302 CV     1
 ASSI {  157}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.600     2.600     3.400 peak   157 spectrum    1 weight  0.11000E+01 volume  0.80178E-02 ppm1      7.489 ppm2      4.062 CV     1
 ASSI {  158}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
      2.600     0.900     0.900 peak   158 spectrum    1 weight  0.11000E+01 volume  0.29218E-02 ppm1      7.487 ppm2      2.284 CV     1
 ASSI {  159}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
      4.100     4.100     1.900 peak   159 spectrum    1 weight  0.11000E+01 volume  0.10208E-02 ppm1      7.485 ppm2      1.454 CV     1
 ASSI {  161}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HG2 ))
      4.300     2.300     1.700 peak   161 spectrum    1 weight  0.11000E+01 volume  0.13553E-02 ppm1      8.720 ppm2      2.896 CV     1
 ASSI {  162}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
      2.400     0.700     0.700 peak   162 spectrum    1 weight  0.11000E+01 volume  0.12190E-02 ppm1      8.719 ppm2      2.485 CV     1
 ASSI {  163}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
      3.200     1.300     1.300 peak   163 spectrum    1 weight  0.11000E+01 volume  0.25206E-02 ppm1      8.721 ppm2      2.220 CV     1
 ASSI {  166}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HG1 ))
      4.900     3.000     1.100 peak   166 spectrum    1 weight  0.11000E+01 volume  0.61779E-03 ppm1      8.440 ppm2      1.848 CV     1
 ASSI {  167}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HA  ))
      2.300     0.700     0.700 peak   167 spectrum    1 weight  0.11000E+01 volume  0.75606E-02 ppm1      8.436 ppm2      4.546 CV     1
 ASSI {  168}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      2.500     0.800     0.800 peak   168 spectrum    1 weight  0.11000E+01 volume  0.30619E-02 ppm1      8.436 ppm2      4.051 CV     1
 ASSI {  169}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HB2 ))
      3.000     3.000     3.000 peak   169 spectrum    1 weight  0.11000E+01 volume  0.40410E-02 ppm1      8.436 ppm2      2.297 CV     1
 ASSI {  170}
   (( segid "    " and resid 124  and name HN  ))
   (  segid "    " and resid 124  and name HB% )
      2.700     0.900     0.900 peak   170 spectrum    1 weight  0.11000E+01 volume  0.74025E-02 ppm1      8.436 ppm2      1.378 CV     1
 ASSI {  171}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      2.800     1.000     1.000 peak   171 spectrum    1 weight  0.11000E+01 volume  0.13288E-02 ppm1      8.142 ppm2      5.105 CV     1
 ASSI {  172}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HA2 ))
      3.200     1.300     1.300 peak   172 spectrum    1 weight  0.11000E+01 volume  0.14873E-02 ppm1      8.141 ppm2      4.310 CV     1
 ASSI {  173}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HA1 ))
      3.600     1.600     1.600 peak   173 spectrum    1 weight  0.11000E+01 volume  0.14215E-02 ppm1      8.138 ppm2      3.812 CV     1
 ASSI {  174}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HG  ))
      2.100     0.600     0.600 peak   174 spectrum    1 weight  0.11000E+01 volume  0.66707E-02 ppm1      8.142 ppm2      1.559 CV     1
 ASSI {  176}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      2.900     1.100     1.100 peak   176 spectrum    1 weight  0.11000E+01 volume  0.16937E-02 ppm1      8.058 ppm2      4.342 CV     1
 ASSI {  178}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 13   and name HG2%)
      3.900     1.900     1.900 peak   178 spectrum    1 weight  0.11000E+01 volume  0.47227E-03 ppm1      8.058 ppm2      0.892 CV     1
 ASSI {  179}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.700     1.700     1.700 peak   179 spectrum    1 weight  0.11000E+01 volume  0.55130E-03 ppm1      7.486 ppm2      4.738 CV     1
 ASSI {  183}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      2.500     0.800     0.800 peak   183 spectrum    1 weight  0.11000E+01 volume  0.44705E-02 ppm1      8.220 ppm2      4.076 CV     1
 ASSI {  184}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 137  and name HD1 ))
      6.000     4.600     0.000 peak   184 spectrum    1 weight  0.11000E+01 volume  0.11536E-03 ppm1      8.220 ppm2      3.145 CV     1
 ASSI {  185}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HB2 ))
      3.100     3.100     2.900 peak   185 spectrum    1 weight  0.11000E+01 volume  0.71371E-02 ppm1      8.221 ppm2      1.689 CV     1
 ASSI {  187}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      3.300     1.300     1.300 peak   187 spectrum    1 weight  0.11000E+01 volume  0.11366E-02 ppm1      7.843 ppm2      3.753 CV     1
 ASSI {  188}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HD1 ))
      3.500     1.500     1.500 peak   188 spectrum    1 weight  0.11000E+01 volume  0.33983E-02 ppm1      7.844 ppm2      1.730 CV     1
 ASSI {  189}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HG1 ))
      3.900     1.900     1.900 peak   189 spectrum    1 weight  0.11000E+01 volume  0.75133E-03 ppm1      7.844 ppm2      1.272 CV     1
 ASSI {  191}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      3.100     1.200     1.200 peak   191 spectrum    1 weight  0.11000E+01 volume  0.13919E-02 ppm1      7.841 ppm2      4.538 CV     1
 ASSI {  192}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HG2 ))
      3.100     1.200     1.200 peak   192 spectrum    1 weight  0.11000E+01 volume  0.17094E-02 ppm1      7.841 ppm2      1.511 CV     1
 ASSI {  193}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      3.200     1.300     1.300 peak   193 spectrum    1 weight  0.11000E+01 volume  0.15552E-02 ppm1      8.627 ppm2      4.047 CV     1
 ASSI {  194}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
      3.000     1.100     1.100 peak   194 spectrum    1 weight  0.11000E+01 volume  0.14661E-02 ppm1      8.627 ppm2      3.637 CV     1
 ASSI {  195}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HB2 ))
      4.100     2.100     1.900 peak   195 spectrum    1 weight  0.11000E+01 volume  0.75832E-03 ppm1      8.627 ppm2      2.569 CV     1
 ASSI {  196}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HB1 ))
      2.700     0.900     0.900 peak   196 spectrum    1 weight  0.11000E+01 volume  0.15248E-02 ppm1      8.627 ppm2      1.788 CV     1
 ASSI {  197}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HG  ))
      5.600     3.900     0.400 peak   197 spectrum    1 weight  0.11000E+01 volume  0.13761E-03 ppm1      8.627 ppm2      1.532 CV     1
 ASSI {  198}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 109  and name HB% )
      2.200     0.600     0.600 peak   198 spectrum    1 weight  0.11000E+01 volume  0.86065E-02 ppm1      8.627 ppm2      1.165 CV     1
 ASSI {  199}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 112  and name HD1%)
      3.900     3.900     2.100 peak   199 spectrum    1 weight  0.11000E+01 volume  0.14590E-02 ppm1      8.628 ppm2      0.839 CV     1
 ASSI {  200}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      3.400     1.400     1.400 peak   200 spectrum    1 weight  0.11000E+01 volume  0.24298E-02 ppm1      8.173 ppm2      4.130 CV     1
 ASSI {  201}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HB1 ))
      2.600     0.900     0.900 peak   201 spectrum    1 weight  0.11000E+01 volume  0.78506E-02 ppm1      8.174 ppm2      2.612 CV     1
 ASSI {  202}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HB  ))
      5.000     3.100     1.000 peak   202 spectrum    1 weight  0.11000E+01 volume  0.17353E-03 ppm1      8.172 ppm2      2.095 CV     1
 ASSI {  203}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
      2.500     2.500     3.500 peak   203 spectrum    1 weight  0.11000E+01 volume  0.18656E-02 ppm1      8.175 ppm2      0.873 CV     1
 ASSI {  205}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      3.100     1.200     1.200 peak   205 spectrum    1 weight  0.11000E+01 volume  0.12892E-02 ppm1      7.495 ppm2      4.477 CV     1
 ASSI {  206}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
      5.500     3.800     0.500 peak   206 spectrum    1 weight  0.11000E+01 volume  0.16504E-03 ppm1      7.498 ppm2      4.161 CV     1
 ASSI {  207}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.500     0.800     0.800 peak   207 spectrum    1 weight  0.11000E+01 volume  0.46336E-02 ppm1      7.496 ppm2      3.923 CV     1
 ASSI {  209}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HG  ))
      2.300     0.600     0.600 peak   209 spectrum    1 weight  0.11000E+01 volume  0.79373E-02 ppm1      7.496 ppm2      1.543 CV     1
 ASSI {  212}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HA  ))
      2.800     1.000     1.000 peak   212 spectrum    1 weight  0.11000E+01 volume  0.32036E-02 ppm1      8.240 ppm2      4.257 CV     1
 ASSI {  213}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HG1 ))
      3.200     1.200     1.200 peak   213 spectrum    1 weight  0.11000E+01 volume  0.26109E-02 ppm1      8.240 ppm2      2.177 CV     1
 ASSI {  214}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      2.800     0.900     0.900 peak   214 spectrum    1 weight  0.11000E+01 volume  0.59953E-02 ppm1      8.240 ppm2      1.898 CV     1
 ASSI {  215}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HA1 ))
      3.300     1.300     1.300 peak   215 spectrum    1 weight  0.11000E+01 volume  0.70850E-02 ppm1      8.241 ppm2      3.877 CV     1
 ASSI {  216}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HA2 ))
      2.600     0.800     0.800 peak   216 spectrum    1 weight  0.11000E+01 volume  0.30145E-02 ppm1      8.196 ppm2      3.819 CV     1
 ASSI {  217}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HB1 ))
      3.200     1.300     1.300 peak   217 spectrum    1 weight  0.11000E+01 volume  0.27115E-02 ppm1      8.196 ppm2      2.949 CV     1
 ASSI {  218}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      2.900     1.100     1.100 peak   218 spectrum    1 weight  0.11000E+01 volume  0.15076E-02 ppm1      8.124 ppm2      3.461 CV     1
 ASSI {  219}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      2.200     0.600     0.600 peak   219 spectrum    1 weight  0.11000E+01 volume  0.64751E-02 ppm1      8.125 ppm2      1.916 CV     1
 ASSI {  220}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HG2 ))
      3.400     1.400     1.400 peak   220 spectrum    1 weight  0.11000E+01 volume  0.10621E-02 ppm1      8.124 ppm2      1.655 CV     1
 ASSI {  222}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      2.800     1.000     1.000 peak   222 spectrum    1 weight  0.11000E+01 volume  0.27640E-02 ppm1      7.690 ppm2      4.643 CV     1
 ASSI {  223}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HA2 ))
      3.300     1.400     1.400 peak   223 spectrum    1 weight  0.11000E+01 volume  0.16378E-02 ppm1      7.690 ppm2      4.124 CV     1
 ASSI {  224}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HA1 ))
      3.500     1.600     1.600 peak   224 spectrum    1 weight  0.11000E+01 volume  0.17204E-02 ppm1      7.690 ppm2      3.643 CV     1
 ASSI {  225}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      3.400     1.400     1.400 peak   225 spectrum    1 weight  0.11000E+01 volume  0.38757E-02 ppm1      7.691 ppm2      3.025 CV     1
 ASSI {  226}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      2.300     0.700     0.700 peak   226 spectrum    1 weight  0.11000E+01 volume  0.49893E-02 ppm1      7.691 ppm2      2.869 CV     1
 ASSI {  227}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
      3.700     1.700     1.700 peak   227 spectrum    1 weight  0.11000E+01 volume  0.20704E-02 ppm1      7.693 ppm2      2.122 CV     1
 ASSI {  228}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      3.900     1.900     1.900 peak   228 spectrum    1 weight  0.11000E+01 volume  0.15610E-02 ppm1      7.692 ppm2      0.666 CV     1
 ASSI {  229}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.700     0.900     0.900 peak   229 spectrum    1 weight  0.11000E+01 volume  0.28056E-02 ppm1      7.524 ppm2      3.791 CV     1
 ASSI {  230}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      3.900     1.900     1.900 peak   230 spectrum    1 weight  0.11000E+01 volume  0.44162E-03 ppm1      7.523 ppm2      3.277 CV     1
 ASSI {  231}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HB  ))
      2.100     0.500     0.500 peak   231 spectrum    1 weight  0.11000E+01 volume  0.82524E-02 ppm1      7.523 ppm2      1.892 CV     1
 ASSI {  232}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HG1 ))
      4.200     2.200     1.800 peak   232 spectrum    1 weight  0.11000E+01 volume  0.60295E-03 ppm1      7.523 ppm2      1.185 CV     1
 ASSI {  234}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      2.700     0.900     0.900 peak   234 spectrum    1 weight  0.11000E+01 volume  0.28270E-02 ppm1      8.586 ppm2      3.853 CV     1
 ASSI {  235}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.500     0.800     0.800 peak   235 spectrum    1 weight  0.11000E+01 volume  0.45756E-02 ppm1      8.589 ppm2      3.385 CV     1
 ASSI {  236}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      4.200     2.200     1.800 peak   236 spectrum    1 weight  0.11000E+01 volume  0.13649E-02 ppm1      8.589 ppm2      0.663 CV     1
 ASSI {  237}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      2.400     0.700     0.700 peak   237 spectrum    1 weight  0.11000E+01 volume  0.42311E-02 ppm1      8.488 ppm2      4.624 CV     1
 ASSI {  238}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
      2.900     1.100     1.100 peak   238 spectrum    1 weight  0.11000E+01 volume  0.19361E-02 ppm1      8.490 ppm2      4.291 CV     1
 ASSI {  239}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      4.100     2.100     1.900 peak   239 spectrum    1 weight  0.11000E+01 volume  0.18108E-02 ppm1      8.489 ppm2      3.060 CV     1
 ASSI {  240}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      4.300     2.300     1.700 peak   240 spectrum    1 weight  0.11000E+01 volume  0.21876E-02 ppm1      8.489 ppm2      2.846 CV     1
 ASSI {  241}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      2.400     0.700     0.700 peak   241 spectrum    1 weight  0.11000E+01 volume  0.54056E-02 ppm1      8.489 ppm2      1.879 CV     1
 ASSI {  242}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      4.300     4.300     1.700 peak   242 spectrum    1 weight  0.11000E+01 volume  0.69535E-03 ppm1      8.489 ppm2      0.657 CV     1
 ASSI {  244}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      2.800     1.000     1.000 peak   244 spectrum    1 weight  0.11000E+01 volume  0.21260E-02 ppm1      7.065 ppm2      4.080 CV     1
 ASSI {  245}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 133  and name HA  ))
      4.200     2.200     1.800 peak   245 spectrum    1 weight  0.11000E+01 volume  0.43533E-03 ppm1      7.067 ppm2      3.602 CV     1
 ASSI {  246}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HD1 ))
      4.400     2.400     1.600 peak   246 spectrum    1 weight  0.11000E+01 volume  0.72252E-03 ppm1      7.065 ppm2      3.157 CV     1
 ASSI {  247}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HE1 ))
      3.000     3.000     3.000 peak   247 spectrum    1 weight  0.11000E+01 volume  0.64616E-03 ppm1      7.064 ppm2      2.963 CV     1
 ASSI {  248}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
      3.100     1.200     1.200 peak   248 spectrum    1 weight  0.11000E+01 volume  0.22224E-02 ppm1      7.066 ppm2      1.972 CV     1
 ASSI {  249}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HB2 ))
      2.600     0.900     0.900 peak   249 spectrum    1 weight  0.11000E+01 volume  0.68943E-02 ppm1      7.066 ppm2      1.709 CV     1
 ASSI {  250}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HG1 ))
      2.200     0.600     0.600 peak   250 spectrum    1 weight  0.11000E+01 volume  0.57332E-02 ppm1      7.063 ppm2      1.448 CV     1
 ASSI {  251}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HG1 ))
      5.500     3.800     0.500 peak   251 spectrum    1 weight  0.11000E+01 volume  0.21844E-03 ppm1      7.065 ppm2      1.063 CV     1
 ASSI {  252}
   (( segid "    " and resid 136  and name HN  ))
   (  segid "    " and resid 131  and name HG1%)
      2.700     2.700     3.300 peak   252 spectrum    1 weight  0.11000E+01 volume  0.11872E-02 ppm1      7.066 ppm2      0.808 CV     1
 ASSI {  253}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      2.700     0.900     0.900 peak   253 spectrum    1 weight  0.11000E+01 volume  0.24287E-02 ppm1      8.589 ppm2      1.909 CV     1
 ASSI {  255}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HA1 ))
      3.000     1.100     1.100 peak   255 spectrum    1 weight  0.11000E+01 volume  0.84706E-02 ppm1      7.919 ppm2      3.920 CV     1
 ASSI {  256}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
      3.000     1.100     1.100 peak   256 spectrum    1 weight  0.11000E+01 volume  0.39860E-02 ppm1      7.919 ppm2      1.792 CV     1
 ASSI {  257}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HG12))
      3.100     1.200     1.200 peak   257 spectrum    1 weight  0.11000E+01 volume  0.12105E-02 ppm1      7.919 ppm2      1.340 CV     1
 ASSI {  258}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HG11))
      2.700     0.900     0.900 peak   258 spectrum    1 weight  0.11000E+01 volume  0.26283E-02 ppm1      7.918 ppm2      1.067 CV     1
 ASSI {  259}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      2.500     0.800     0.800 peak   259 spectrum    1 weight  0.11000E+01 volume  0.25651E-02 ppm1      8.700 ppm2      5.103 CV     1
 ASSI {  261}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      3.900     1.900     1.900 peak   261 spectrum    1 weight  0.11000E+01 volume  0.83083E-03 ppm1      8.700 ppm2      0.046 CV     1
 ASSI {  262}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      3.300     1.400     1.400 peak   262 spectrum    1 weight  0.11000E+01 volume  0.56513E-03 ppm1      8.696 ppm2      5.810 CV     1
 ASSI {  263}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      3.600     1.600     1.600 peak   263 spectrum    1 weight  0.11000E+01 volume  0.18053E-02 ppm1      8.697 ppm2      0.846 CV     1
 ASSI {  264}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.300     1.300     1.300 peak   264 spectrum    1 weight  0.11000E+01 volume  0.22478E-02 ppm1      8.483 ppm2      3.972 CV     1
 ASSI {  265}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HG2 ))
      2.000     0.500     0.500 peak   265 spectrum    1 weight  0.11000E+01 volume  0.32245E-02 ppm1      8.483 ppm2      2.962 CV     1
 ASSI {  266}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.200     0.600     0.600 peak   266 spectrum    1 weight  0.11000E+01 volume  0.70118E-02 ppm1      8.483 ppm2      2.185 CV     1
 ASSI {  267}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      4.300     2.400     1.700 peak   267 spectrum    1 weight  0.11000E+01 volume  0.83170E-03 ppm1      8.482 ppm2      1.056 CV     1
 ASSI {  269}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      2.800     1.000     1.000 peak   269 spectrum    1 weight  0.11000E+01 volume  0.21072E-02 ppm1      8.401 ppm2      4.034 CV     1
 ASSI {  270}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HB2 ))
      2.700     0.900     0.900 peak   270 spectrum    1 weight  0.11000E+01 volume  0.15797E-02 ppm1      8.400 ppm2      2.576 CV     1
 ASSI {  272}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HG  ))
      4.700     2.700     1.300 peak   272 spectrum    1 weight  0.11000E+01 volume  0.44019E-03 ppm1      8.401 ppm2      1.530 CV     1
 ASSI {  273}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 108  and name HD1%)
      3.800     1.900     1.900 peak   273 spectrum    1 weight  0.11000E+01 volume  0.27286E-02 ppm1      8.400 ppm2      1.174 CV     1
 ASSI {  274}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      4.400     2.400     1.600 peak   274 spectrum    1 weight  0.11000E+01 volume  0.36884E-03 ppm1      8.402 ppm2      0.496 CV     1
 ASSI {  275}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      3.300     1.400     1.400 peak   275 spectrum    1 weight  0.11000E+01 volume  0.78496E-03 ppm1      8.254 ppm2      4.217 CV     1
 ASSI {  276}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.600     1.600     1.600 peak   276 spectrum    1 weight  0.11000E+01 volume  0.85063E-03 ppm1      8.256 ppm2      3.026 CV     1
 ASSI {  277}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 18   and name HB% )
      5.700     4.000     0.300 peak   277 spectrum    1 weight  0.11000E+01 volume  0.16647E-03 ppm1      8.255 ppm2      1.211 CV     1
 ASSI {  278}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.500     1.600     1.600 peak   278 spectrum    1 weight  0.11000E+01 volume  0.91548E-03 ppm1      8.099 ppm2      4.259 CV     1
 ASSI {  279}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      3.000     1.200     1.200 peak   279 spectrum    1 weight  0.11000E+01 volume  0.13930E-02 ppm1      8.098 ppm2      3.871 CV     1
 ASSI {  280}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      3.400     1.400     1.400 peak   280 spectrum    1 weight  0.11000E+01 volume  0.15997E-02 ppm1      8.100 ppm2      2.131 CV     1
 ASSI {  281}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 88   and name HG2 ))
      3.500     3.500     2.500 peak   281 spectrum    1 weight  0.11000E+01 volume  0.16345E-02 ppm1      8.100 ppm2      1.720 CV     1
 ASSI {  282}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
      3.700     1.700     1.700 peak   282 spectrum    1 weight  0.11000E+01 volume  0.21023E-02 ppm1      8.099 ppm2      1.534 CV     1
 ASSI {  283}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      3.600     1.600     1.600 peak   283 spectrum    1 weight  0.11000E+01 volume  0.28291E-02 ppm1      8.099 ppm2      1.059 CV     1
 ASSI {  284}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      3.200     1.300     1.300 peak   284 spectrum    1 weight  0.11000E+01 volume  0.35533E-02 ppm1      8.100 ppm2      0.779 CV     1
 ASSI {  286}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      2.300     0.700     0.700 peak   286 spectrum    1 weight  0.11000E+01 volume  0.74859E-02 ppm1      7.944 ppm2      4.592 CV     1
 ASSI {  287}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      2.600     0.900     0.900 peak   287 spectrum    1 weight  0.11000E+01 volume  0.42898E-02 ppm1      7.944 ppm2      4.123 CV     1
 ASSI {  288}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
      4.000     2.000     2.000 peak   288 spectrum    1 weight  0.11000E+01 volume  0.21232E-02 ppm1      7.944 ppm2      2.619 CV     1
 ASSI {  289}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HB  ))
      2.500     0.800     0.800 peak   289 spectrum    1 weight  0.11000E+01 volume  0.62853E-02 ppm1      7.944 ppm2      2.087 CV     1
 ASSI {  290}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 42   and name HG2%)
      2.700     0.900     0.900 peak   290 spectrum    1 weight  0.11000E+01 volume  0.10576E-01 ppm1      7.944 ppm2      0.887 CV     1
 ASSI {  291}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 132  and name HB2 ))
      2.800     1.000     1.000 peak   291 spectrum    1 weight  0.11000E+01 volume  0.19054E-02 ppm1      7.847 ppm2      1.776 CV     1
 ASSI {  293}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HA  ))
      3.700     1.700     1.700 peak   293 spectrum    1 weight  0.11000E+01 volume  0.68360E-03 ppm1      7.841 ppm2      4.101 CV     1
 ASSI {  294}
   (( segid "    " and resid 135  and name HN  ))
   (  segid "    " and resid 131  and name HG1%)
      2.700     2.700     3.300 peak   294 spectrum    1 weight  0.11000E+01 volume  0.11877E-02 ppm1      7.840 ppm2      0.787 CV     1
 ASSI {  296}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      3.200     1.200     1.200 peak   296 spectrum    1 weight  0.11000E+01 volume  0.10274E-02 ppm1      7.773 ppm2      3.285 CV     1
 ASSI {  297}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HB  ))
      2.200     0.600     0.600 peak   297 spectrum    1 weight  0.11000E+01 volume  0.55583E-02 ppm1      7.774 ppm2      1.921 CV     1
 ASSI {  298}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      3.900     1.900     1.900 peak   298 spectrum    1 weight  0.11000E+01 volume  0.65218E-03 ppm1      7.773 ppm2      1.143 CV     1
 ASSI {  300}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      3.500     1.600     1.600 peak   300 spectrum    1 weight  0.11000E+01 volume  0.52451E-03 ppm1      9.393 ppm2      4.197 CV     1
 ASSI {  301}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      2.800     1.000     1.000 peak   301 spectrum    1 weight  0.11000E+01 volume  0.14965E-02 ppm1      9.397 ppm2      3.164 CV     1
 ASSI {  302}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HB1 ))
      2.800     1.000     1.000 peak   302 spectrum    1 weight  0.11000E+01 volume  0.16321E-02 ppm1      9.397 ppm2      3.000 CV     1
 ASSI {  303}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
      3.900     1.900     1.900 peak   303 spectrum    1 weight  0.11000E+01 volume  0.19456E-03 ppm1      9.395 ppm2      2.230 CV     1
 ASSI {  304}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      4.100     2.100     1.900 peak   304 spectrum    1 weight  0.11000E+01 volume  0.75259E-03 ppm1      9.395 ppm2      1.812 CV     1
 ASSI {  305}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.400     1.400     1.400 peak   305 spectrum    1 weight  0.11000E+01 volume  0.55814E-03 ppm1      9.396 ppm2      1.568 CV     1
 ASSI {  306}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      5.400     3.700     0.600 peak   306 spectrum    1 weight  0.11000E+01 volume  0.15241E-03 ppm1      9.396 ppm2      0.827 CV     1
 ASSI {  312}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      3.600     1.600     1.600 peak   312 spectrum    1 weight  0.11000E+01 volume  0.64823E-03 ppm1      7.705 ppm2      4.632 CV     1
 ASSI {  314}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 127  and name HB1 ))
      2.900     2.900     3.100 peak   314 spectrum    1 weight  0.11000E+01 volume  0.73177E-03 ppm1      7.700 ppm2      1.954 CV     1
 ASSI {  315}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 130  and name HB1 ))
      3.200     1.300     1.300 peak   315 spectrum    1 weight  0.11000E+01 volume  0.23082E-02 ppm1      7.700 ppm2      1.478 CV     1
 ASSI {  318}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 130  and name HD2%)
      5.000     3.100     1.000 peak   318 spectrum    1 weight  0.11000E+01 volume  0.39612E-03 ppm1      7.702 ppm2      0.635 CV     1
 ASSI {  319}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.600     0.800     0.800 peak   319 spectrum    1 weight  0.11000E+01 volume  0.46046E-02 ppm1      7.578 ppm2      4.062 CV     1
 ASSI {  320}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HA1 ))
      3.400     1.400     1.400 peak   320 spectrum    1 weight  0.11000E+01 volume  0.11296E-02 ppm1      7.579 ppm2      3.551 CV     1
 ASSI {  322}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
      5.600     3.900     0.400 peak   322 spectrum    1 weight  0.11000E+01 volume  0.47739E-03 ppm1      7.580 ppm2      2.293 CV     1
 ASSI {  323}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
      2.200     0.600     0.600 peak   323 spectrum    1 weight  0.11000E+01 volume  0.61769E-02 ppm1      7.579 ppm2      1.747 CV     1
 ASSI {  324}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HG1 ))
      3.000     1.100     1.100 peak   324 spectrum    1 weight  0.11000E+01 volume  0.34579E-02 ppm1      7.579 ppm2      1.346 CV     1
 ASSI {  325}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 99   and name HA2 ))
      5.000     3.200     1.000 peak   325 spectrum    1 weight  0.11000E+01 volume  0.70667E-03 ppm1      8.343 ppm2      4.305 CV     1
 ASSI {  326}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      2.500     0.800     0.800 peak   326 spectrum    1 weight  0.11000E+01 volume  0.33125E-02 ppm1      8.342 ppm2      3.834 CV     1
 ASSI {  327}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HB2 ))
      3.200     1.300     1.300 peak   327 spectrum    1 weight  0.11000E+01 volume  0.16432E-02 ppm1      8.342 ppm2      3.006 CV     1
 ASSI {  328}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HB1 ))
      3.300     1.300     1.300 peak   328 spectrum    1 weight  0.11000E+01 volume  0.19082E-02 ppm1      8.342 ppm2      2.432 CV     1
 ASSI {  329}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      4.000     2.000     2.000 peak   329 spectrum    1 weight  0.11000E+01 volume  0.88305E-03 ppm1      8.344 ppm2      1.967 CV     1
 ASSI {  330}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HG2 ))
      4.300     2.300     1.700 peak   330 spectrum    1 weight  0.11000E+01 volume  0.82100E-03 ppm1      8.341 ppm2      1.351 CV     1
 ASSI {  331}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.000     1.100     1.100 peak   331 spectrum    1 weight  0.11000E+01 volume  0.21907E-02 ppm1      8.339 ppm2      4.620 CV     1
 ASSI {  332}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      4.800     2.800     1.200 peak   332 spectrum    1 weight  0.11000E+01 volume  0.14485E-03 ppm1      8.058 ppm2      4.525 CV     1
 ASSI {  333}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HB1 ))
      4.000     2.000     2.000 peak   333 spectrum    1 weight  0.11000E+01 volume  0.66322E-03 ppm1      8.055 ppm2      2.808 CV     1
 ASSI {  334}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.400     3.400     2.600 peak   334 spectrum    1 weight  0.11000E+01 volume  0.31521E-03 ppm1      8.104 ppm2      3.456 CV     1
 ASSI {  335}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
      3.200     1.200     1.200 peak   335 spectrum    1 weight  0.11000E+01 volume  0.22631E-02 ppm1      8.106 ppm2      1.929 CV     1
 ASSI {  336}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 93   and name HB% )
      2.200     0.600     0.600 peak   336 spectrum    1 weight  0.11000E+01 volume  0.75683E-02 ppm1      8.104 ppm2      1.145 CV     1
 ASSI {  337}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      3.100     1.200     1.200 peak   337 spectrum    1 weight  0.11000E+01 volume  0.11249E-02 ppm1      8.099 ppm2      3.809 CV     1
 ASSI {  338}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 92   and name HD1%)
      2.300     2.300     3.700 peak   338 spectrum    1 weight  0.11000E+01 volume  0.29930E-02 ppm1      8.101 ppm2      0.855 CV     1
 ASSI {  339}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      2.500     0.800     0.800 peak   339 spectrum    1 weight  0.11000E+01 volume  0.28572E-02 ppm1      8.811 ppm2      3.927 CV     1
 ASSI {  340}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 72   and name HB% )
      2.100     2.100     3.900 peak   340 spectrum    1 weight  0.11000E+01 volume  0.81310E-02 ppm1      8.811 ppm2      1.759 CV     1
 ASSI {  341}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      6.000     6.000     0.000 peak   341 spectrum    1 weight  0.11000E+01 volume  0.22161E-04 ppm1      8.811 ppm2      1.071 CV     1
 ASSI {  342}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 116  and name HB1 ))
      4.500     2.600     1.500 peak   342 spectrum    1 weight  0.11000E+01 volume  0.54065E-03 ppm1      7.802 ppm2      1.767 CV     1
 ASSI {  343}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      2.800     1.000     1.000 peak   343 spectrum    1 weight  0.11000E+01 volume  0.32269E-02 ppm1      7.801 ppm2      4.122 CV     1
 ASSI {  344}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      3.500     1.500     1.500 peak   344 spectrum    1 weight  0.11000E+01 volume  0.16098E-02 ppm1      7.799 ppm2      3.723 CV     1
 ASSI {  345}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HG2 ))
      3.800     1.800     1.800 peak   345 spectrum    1 weight  0.11000E+01 volume  0.12792E-02 ppm1      7.801 ppm2      2.521 CV     1
 ASSI {  346}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
      3.000     1.100     1.100 peak   346 spectrum    1 weight  0.11000E+01 volume  0.75355E-02 ppm1      7.801 ppm2      2.150 CV     1
 ASSI {  347}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      3.200     1.300     1.300 peak   347 spectrum    1 weight  0.11000E+01 volume  0.12591E-02 ppm1      7.802 ppm2      1.445 CV     1
 ASSI {  348}
   (( segid "    " and resid 118  and name HN  ))
   (  segid "    " and resid 117  and name HD1%)
      2.500     2.500     3.500 peak   348 spectrum    1 weight  0.11000E+01 volume  0.18329E-02 ppm1      7.802 ppm2      0.882 CV     1
 ASSI {  352}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HG  ))
      3.600     1.600     1.600 peak   352 spectrum    1 weight  0.11000E+01 volume  0.23912E-02 ppm1      7.580 ppm2      1.753 CV     1
 ASSI {  353}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HB1 ))
      3.300     1.300     1.300 peak   353 spectrum    1 weight  0.11000E+01 volume  0.20751E-02 ppm1      7.580 ppm2      1.100 CV     1
 ASSI {  354}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 92   and name HD1%)
      3.000     3.000     3.000 peak   354 spectrum    1 weight  0.11000E+01 volume  0.36491E-02 ppm1      7.578 ppm2      0.809 CV     1
 ASSI {  356}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      2.500     0.800     0.800 peak   356 spectrum    1 weight  0.11000E+01 volume  0.38685E-02 ppm1      7.368 ppm2      3.975 CV     1
 ASSI {  357}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HE2 ))
      5.100     3.200     0.900 peak   357 spectrum    1 weight  0.11000E+01 volume  0.61567E-03 ppm1      7.366 ppm2      2.248 CV     1
 ASSI {  359}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      2.900     1.100     1.100 peak   359 spectrum    1 weight  0.11000E+01 volume  0.57076E-02 ppm1      7.368 ppm2      1.668 CV     1
 ASSI {  360}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HD2 ))
      4.400     2.400     1.600 peak   360 spectrum    1 weight  0.11000E+01 volume  0.84938E-03 ppm1      7.368 ppm2      1.292 CV     1
 ASSI {  361}
   (( segid "    " and resid 74   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      4.100     2.100     1.900 peak   361 spectrum    1 weight  0.11000E+01 volume  0.80852E-03 ppm1      7.367 ppm2      1.065 CV     1
 ASSI {  366}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HG  ))
      2.500     0.800     0.800 peak   366 spectrum    1 weight  0.11000E+01 volume  0.32939E-02 ppm1      8.276 ppm2      1.969 CV     1
 ASSI {  367}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      3.700     1.700     1.700 peak   367 spectrum    1 weight  0.11000E+01 volume  0.18017E-02 ppm1      8.278 ppm2      1.137 CV     1
 ASSI {  371}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
      2.300     0.700     0.700 peak   371 spectrum    1 weight  0.11000E+01 volume  0.42548E-02 ppm1      8.097 ppm2      1.998 CV     1
 ASSI {  372}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.900     1.000     1.000 peak   372 spectrum    1 weight  0.11000E+01 volume  0.27973E-02 ppm1      8.095 ppm2      3.755 CV     1
 ASSI {  375}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      3.500     1.600     1.600 peak   375 spectrum    1 weight  0.11000E+01 volume  0.19651E-02 ppm1      7.487 ppm2      4.197 CV     1
 ASSI {  376}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HA1 ))
      4.000     2.000     2.000 peak   376 spectrum    1 weight  0.11000E+01 volume  0.69203E-03 ppm1      7.489 ppm2      3.747 CV     1
 ASSI {  377}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      2.700     0.900     0.900 peak   377 spectrum    1 weight  0.11000E+01 volume  0.15349E-02 ppm1      7.229 ppm2      3.921 CV     1
 ASSI {  378}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      5.000     3.100     1.000 peak   378 spectrum    1 weight  0.11000E+01 volume  0.32327E-03 ppm1      7.229 ppm2      3.080 CV     1
 ASSI {  379}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HB  ))
      2.300     0.700     0.700 peak   379 spectrum    1 weight  0.11000E+01 volume  0.35672E-02 ppm1      7.228 ppm2      2.395 CV     1
 ASSI {  381}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HG12))
      3.900     1.900     1.900 peak   381 spectrum    1 weight  0.11000E+01 volume  0.15707E-02 ppm1      7.227 ppm2      1.918 CV     1
 ASSI {  382}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HG11))
      2.500     0.800     0.800 peak   382 spectrum    1 weight  0.11000E+01 volume  0.12005E-02 ppm1      7.228 ppm2      1.328 CV     1
 ASSI {  383}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 56   and name HD1%)
      3.500     1.500     1.500 peak   383 spectrum    1 weight  0.11000E+01 volume  0.29653E-02 ppm1      7.228 ppm2      1.073 CV     1
 ASSI {  384}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      3.000     1.100     1.100 peak   384 spectrum    1 weight  0.11000E+01 volume  0.16798E-02 ppm1      7.565 ppm2      4.655 CV     1
 ASSI {  385}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.100     1.200     1.200 peak   385 spectrum    1 weight  0.11000E+01 volume  0.19026E-02 ppm1      7.565 ppm2      2.845 CV     1
 ASSI {  386}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.300     1.400     1.400 peak   386 spectrum    1 weight  0.11000E+01 volume  0.13260E-02 ppm1      7.566 ppm2      2.529 CV     1
 ASSI {  387}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 72   and name HB% )
      4.300     2.300     1.700 peak   387 spectrum    1 weight  0.11000E+01 volume  0.88551E-03 ppm1      7.564 ppm2      1.766 CV     1
 ASSI {  388}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 70   and name HB% )
      2.700     0.900     0.900 peak   388 spectrum    1 weight  0.11000E+01 volume  0.35632E-02 ppm1      7.565 ppm2      1.304 CV     1
 ASSI {  389}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      3.100     1.200     1.200 peak   389 spectrum    1 weight  0.11000E+01 volume  0.61803E-03 ppm1      7.487 ppm2      5.389 CV     1
 ASSI {  390}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      4.500     2.500     1.500 peak   390 spectrum    1 weight  0.11000E+01 volume  0.27236E-03 ppm1      7.491 ppm2      3.099 CV     1
 ASSI {  391}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HD2 ))
      2.400     0.700     0.700 peak   391 spectrum    1 weight  0.11000E+01 volume  0.49459E-02 ppm1      7.489 ppm2      1.712 CV     1
 ASSI {  392}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HG1 ))
      3.600     1.600     1.600 peak   392 spectrum    1 weight  0.11000E+01 volume  0.17966E-02 ppm1      7.485 ppm2      1.265 CV     1
 ASSI {  394}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      2.600     0.900     0.900 peak   394 spectrum    1 weight  0.11000E+01 volume  0.32084E-02 ppm1      8.528 ppm2      3.978 CV     1
 ASSI {  395}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HB  ))
      2.200     0.600     0.600 peak   395 spectrum    1 weight  0.11000E+01 volume  0.46814E-02 ppm1      8.528 ppm2      2.291 CV     1
 ASSI {  397}
   (( segid "    " and resid 77   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      2.500     2.500     3.500 peak   397 spectrum    1 weight  0.11000E+01 volume  0.69858E-02 ppm1      8.528 ppm2      1.045 CV     1
 ASSI {  398}
   (( segid "    " and resid 77   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      3.300     3.300     2.700 peak   398 spectrum    1 weight  0.11000E+01 volume  0.15851E-02 ppm1      8.528 ppm2      0.770 CV     1
 ASSI {  401}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.300     1.300     1.300 peak   401 spectrum    1 weight  0.11000E+01 volume  0.15233E-02 ppm1      7.124 ppm2      3.990 CV     1
 ASSI {  402}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HE2 ))
      6.000     6.000     0.000 peak   402 spectrum    1 weight  0.11000E+01 volume  0.23769E-05 ppm1      7.123 ppm2      2.962 CV     1
 ASSI {  403}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      3.100     1.200     1.200 peak   403 spectrum    1 weight  0.11000E+01 volume  0.21563E-02 ppm1      7.122 ppm2      1.975 CV     1
 ASSI {  404}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HD2 ))
      2.400     2.400     3.600 peak   404 spectrum    1 weight  0.11000E+01 volume  0.25702E-02 ppm1      7.123 ppm2      1.712 CV     1
 ASSI {  405}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      4.700     4.700     1.300 peak   405 spectrum    1 weight  0.11000E+01 volume  0.43700E-03 ppm1      7.123 ppm2      1.068 CV     1
 ASSI {  406}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
      5.400     3.600     0.600 peak   406 spectrum    1 weight  0.11000E+01 volume  0.14492E-03 ppm1      7.126 ppm2      0.476 CV     1
 ASSI {  407}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      2.300     0.600     0.600 peak   407 spectrum    1 weight  0.11000E+01 volume  0.16818E-02 ppm1      9.205 ppm2      5.386 CV     1
 ASSI {  408}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HD2 ))
      3.200     3.200     2.800 peak   408 spectrum    1 weight  0.11000E+01 volume  0.36442E-02 ppm1      9.205 ppm2      1.717 CV     1
 ASSI {  409}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HG11))
      2.300     0.700     0.700 peak   409 spectrum    1 weight  0.11000E+01 volume  0.41913E-02 ppm1      9.203 ppm2      1.452 CV     1
 ASSI {  410}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
      4.700     2.800     1.300 peak   410 spectrum    1 weight  0.11000E+01 volume  0.38190E-03 ppm1      9.202 ppm2      0.446 CV     1
 ASSI {  411}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      3.600     1.600     1.600 peak   411 spectrum    1 weight  0.11000E+01 volume  0.75543E-03 ppm1      9.203 ppm2     -0.039 CV     1
 ASSI {  413}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
      3.600     1.600     1.600 peak   413 spectrum    1 weight  0.11000E+01 volume  0.23804E-02 ppm1      7.289 ppm2      1.780 CV     1
 ASSI {  414}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HG2 ))
      3.300     1.300     1.300 peak   414 spectrum    1 weight  0.11000E+01 volume  0.97623E-03 ppm1      7.286 ppm2      1.349 CV     1
 ASSI {  417}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      3.700     1.700     1.700 peak   417 spectrum    1 weight  0.11000E+01 volume  0.22023E-02 ppm1      7.277 ppm2      2.869 CV     1
 ASSI {  418}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HG2 ))
      2.500     0.800     0.800 peak   418 spectrum    1 weight  0.11000E+01 volume  0.13461E-02 ppm1      7.276 ppm2      2.573 CV     1
 ASSI {  419}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      2.900     1.000     1.000 peak   419 spectrum    1 weight  0.11000E+01 volume  0.95421E-02 ppm1      7.275 ppm2      2.236 CV     1
 ASSI {  424}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      2.700     0.900     0.900 peak   424 spectrum    1 weight  0.11000E+01 volume  0.17503E-02 ppm1      8.530 ppm2      5.578 CV     1
 ASSI {  426}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      3.400     1.400     1.400 peak   426 spectrum    1 weight  0.11000E+01 volume  0.85906E-03 ppm1      8.530 ppm2      2.818 CV     1
 ASSI {  427}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
      3.800     1.800     1.800 peak   427 spectrum    1 weight  0.11000E+01 volume  0.21034E-02 ppm1      8.530 ppm2      2.558 CV     1
 ASSI {  428}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB2 ))
      4.100     2.100     1.900 peak   428 spectrum    1 weight  0.11000E+01 volume  0.10192E-02 ppm1      8.531 ppm2      2.054 CV     1
 ASSI {  429}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB1 ))
      2.700     0.900     0.900 peak   429 spectrum    1 weight  0.11000E+01 volume  0.18837E-02 ppm1      8.531 ppm2      1.684 CV     1
 ASSI {  432}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      3.600     1.600     1.600 peak   432 spectrum    1 weight  0.11000E+01 volume  0.70985E-03 ppm1      8.342 ppm2      4.390 CV     1
 ASSI {  436}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 71   and name HB2 ))
      4.300     2.300     1.700 peak   436 spectrum    1 weight  0.11000E+01 volume  0.17512E-03 ppm1      8.099 ppm2      2.849 CV     1
 ASSI {  437}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      2.600     0.800     0.800 peak   437 spectrum    1 weight  0.11000E+01 volume  0.34604E-02 ppm1      7.478 ppm2      3.878 CV     1
 ASSI {  438}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.500     1.600     1.600 peak   438 spectrum    1 weight  0.11000E+01 volume  0.32360E-02 ppm1      7.478 ppm2      3.402 CV     1
 ASSI {  439}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
      2.100     0.500     0.500 peak   439 spectrum    1 weight  0.11000E+01 volume  0.77485E-02 ppm1      7.478 ppm2      1.963 CV     1
 ASSI {  440}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 92   and name HB1 ))
      5.700     4.000     0.300 peak   440 spectrum    1 weight  0.11000E+01 volume  0.30118E-03 ppm1      7.478 ppm2      1.109 CV     1
 ASSI {  441}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 92   and name HD1%)
      4.600     2.700     1.400 peak   441 spectrum    1 weight  0.11000E+01 volume  0.59866E-03 ppm1      7.482 ppm2      0.849 CV     1
 ASSI {  442}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 88   and name HG2 ))
      2.300     2.300     3.700 peak   442 spectrum    1 weight  0.11000E+01 volume  0.30779E-02 ppm1      7.475 ppm2      1.665 CV     1
 ASSI {  443}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 71   and name HB2 ))
      5.100     3.200     0.900 peak   443 spectrum    1 weight  0.11000E+01 volume  0.25595E-03 ppm1      7.087 ppm2      2.842 CV     1
 ASSI {  445}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HA2 ))
      2.600     0.900     0.900 peak   445 spectrum    1 weight  0.11000E+01 volume  0.23177E-02 ppm1     10.640 ppm2      4.307 CV     1
 ASSI {  446}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HA1 ))
      2.900     1.000     1.000 peak   446 spectrum    1 weight  0.11000E+01 volume  0.40948E-02 ppm1     10.641 ppm2      3.831 CV     1
 ASSI {  447}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      2.800     1.000     1.000 peak   447 spectrum    1 weight  0.11000E+01 volume  0.31891E-02 ppm1      7.910 ppm2      4.518 CV     1
 ASSI {  448}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      4.800     2.900     1.200 peak   448 spectrum    1 weight  0.11000E+01 volume  0.10045E-02 ppm1      7.910 ppm2      3.826 CV     1
 ASSI {  449}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.700     1.700     1.700 peak   449 spectrum    1 weight  0.11000E+01 volume  0.75278E-03 ppm1      7.911 ppm2      3.484 CV     1
 ASSI {  450}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HB2 ))
      2.900     1.000     1.000 peak   450 spectrum    1 weight  0.11000E+01 volume  0.21074E-02 ppm1      7.911 ppm2      3.096 CV     1
 ASSI {  451}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HB1 ))
      3.300     1.300     1.300 peak   451 spectrum    1 weight  0.11000E+01 volume  0.19502E-02 ppm1      7.910 ppm2      2.282 CV     1
 ASSI {  452}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      2.800     1.000     1.000 peak   452 spectrum    1 weight  0.11000E+01 volume  0.26678E-02 ppm1      7.910 ppm2      1.785 CV     1
 ASSI {  453}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HG2 ))
      3.900     1.900     1.900 peak   453 spectrum    1 weight  0.11000E+01 volume  0.18039E-02 ppm1      7.912 ppm2      1.385 CV     1
 ASSI {  454}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      3.200     1.300     1.300 peak   454 spectrum    1 weight  0.11000E+01 volume  0.25189E-02 ppm1      7.908 ppm2      1.065 CV     1
 ASSI {  455}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      3.400     1.500     1.500 peak   455 spectrum    1 weight  0.11000E+01 volume  0.13800E-02 ppm1      7.529 ppm2      4.518 CV     1
 ASSI {  456}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      2.200     0.600     0.600 peak   456 spectrum    1 weight  0.11000E+01 volume  0.57380E-02 ppm1      7.530 ppm2      3.831 CV     1
 ASSI {  457}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB2 ))
      4.200     2.200     1.800 peak   457 spectrum    1 weight  0.11000E+01 volume  0.56951E-03 ppm1      7.529 ppm2      3.078 CV     1
 ASSI {  458}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
      3.700     1.700     1.700 peak   458 spectrum    1 weight  0.11000E+01 volume  0.22050E-02 ppm1      7.530 ppm2      1.972 CV     1
 ASSI {  459}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HD2 ))
      4.200     2.200     1.800 peak   459 spectrum    1 weight  0.11000E+01 volume  0.17079E-02 ppm1      7.529 ppm2      1.791 CV     1
 ASSI {  460}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HG1 ))
      2.600     0.800     0.800 peak   460 spectrum    1 weight  0.11000E+01 volume  0.36220E-02 ppm1      7.530 ppm2      1.354 CV     1
 ASSI {  461}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 113  and name HD1%)
      4.200     2.200     1.800 peak   461 spectrum    1 weight  0.11000E+01 volume  0.67223E-03 ppm1      7.213 ppm2      0.803 CV     1
 ASSI {  462}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      3.300     3.300     2.700 peak   462 spectrum    1 weight  0.11000E+01 volume  0.11477E-02 ppm1      8.117 ppm2      4.277 CV     1
 ASSI {  463}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA1 ))
      4.300     4.300     1.700 peak   463 spectrum    1 weight  0.11000E+01 volume  0.13742E-02 ppm1      8.118 ppm2      3.917 CV     1
 ASSI {  464}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 22   and name HG2%)
      3.800     1.800     1.800 peak   464 spectrum    1 weight  0.11000E+01 volume  0.67555E-03 ppm1      8.118 ppm2      1.168 CV     1
 ASSI {  466}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HD21))
      3.900     1.900     1.900 peak   466 spectrum    1 weight  0.11000E+01 volume  0.12161E-02 ppm1      7.212 ppm2      5.762 CV     1
 ASSI {  467}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      2.800     0.900     0.900 peak   467 spectrum    1 weight  0.11000E+01 volume  0.20416E-02 ppm1      7.212 ppm2      3.780 CV     1
 ASSI {  468}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      6.000     4.800     0.000 peak   468 spectrum    1 weight  0.11000E+01 volume  0.12914E-03 ppm1      7.213 ppm2      3.267 CV     1
 ASSI {  469}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 107  and name HB% )
      3.200     3.200     2.800 peak   469 spectrum    1 weight  0.11000E+01 volume  0.49069E-03 ppm1      7.210 ppm2      1.841 CV     1
 ASSI {  471}
   (( segid "    " and resid 83   and name HD22))
   (( segid "    " and resid 83   and name HB2 ))
      5.600     3.900     0.400 peak   471 spectrum    1 weight  0.11000E+01 volume  0.20052E-03 ppm1      6.984 ppm2      2.835 CV     1
 ASSI {  472}
   (( segid "    " and resid 64   and name HD21))
   (( segid "    " and resid 64   and name HB2 ))
      3.200     1.300     1.300 peak   472 spectrum    1 weight  0.11000E+01 volume  0.74136E-03 ppm1      7.650 ppm2      3.089 CV     1
 ASSI {  473}
   (( segid "    " and resid 64   and name HD21))
   (( segid "    " and resid 64   and name HB1 ))
      3.600     1.600     1.600 peak   473 spectrum    1 weight  0.11000E+01 volume  0.12833E-02 ppm1      7.649 ppm2      2.803 CV     1
 ASSI {  475}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      2.600     0.800     0.800 peak   475 spectrum    1 weight  0.11000E+01 volume  0.42404E-02 ppm1      7.461 ppm2      4.589 CV     1
 ASSI {  476}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      2.800     1.000     1.000 peak   476 spectrum    1 weight  0.11000E+01 volume  0.22016E-02 ppm1      7.461 ppm2      4.058 CV     1
 ASSI {  477}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 123  and name HB2 ))
      2.600     2.600     3.400 peak   477 spectrum    1 weight  0.11000E+01 volume  0.76651E-02 ppm1      7.460 ppm2      2.312 CV     1
 ASSI {  479}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 92   and name HD2%)
      3.100     1.200     1.200 peak   479 spectrum    1 weight  0.11000E+01 volume  0.12158E-02 ppm1      7.464 ppm2      0.680 CV     1
 ASSI {  480}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 123  and name HG1 ))
      4.700     2.800     1.300 peak   480 spectrum    1 weight  0.11000E+01 volume  0.84152E-03 ppm1      7.458 ppm2      1.838 CV     1
 ASSI {  481}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      3.100     1.200     1.200 peak   481 spectrum    1 weight  0.11000E+01 volume  0.12045E-02 ppm1      7.411 ppm2      4.522 CV     1
 ASSI {  482}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      3.800     1.800     1.800 peak   482 spectrum    1 weight  0.11000E+01 volume  0.52524E-03 ppm1      7.409 ppm2      4.077 CV     1
 ASSI {  483}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      3.300     1.300     1.300 peak   483 spectrum    1 weight  0.11000E+01 volume  0.10356E-02 ppm1      7.411 ppm2      3.865 CV     1
 ASSI {  484}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.700     0.900     0.900 peak   484 spectrum    1 weight  0.11000E+01 volume  0.32899E-02 ppm1      7.410 ppm2      2.230 CV     1
 ASSI {  485}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
      3.400     3.400     2.600 peak   485 spectrum    1 weight  0.11000E+01 volume  0.30399E-03 ppm1      7.407 ppm2      1.911 CV     1
 ASSI {  486}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
      2.400     0.700     0.700 peak   486 spectrum    1 weight  0.11000E+01 volume  0.56739E-02 ppm1      7.410 ppm2      1.173 CV     1
 ASSI {  487}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      3.800     3.800     2.200 peak   487 spectrum    1 weight  0.11000E+01 volume  0.10792E-02 ppm1      7.407 ppm2      0.859 CV     1
 ASSI {  488}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      3.900     1.900     1.900 peak   488 spectrum    1 weight  0.11000E+01 volume  0.84812E-03 ppm1      7.411 ppm2      0.057 CV     1
 ASSI {  490}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 52   and name HG2%)
      4.000     2.000     2.000 peak   490 spectrum    1 weight  0.11000E+01 volume  0.19383E-02 ppm1      7.264 ppm2      1.110 CV     1
 ASSI {  491}
   (( segid "    " and resid 64   and name HD22))
   (( segid "    " and resid 64   and name HB1 ))
      4.400     2.400     1.600 peak   491 spectrum    1 weight  0.11000E+01 volume  0.10671E-02 ppm1      6.924 ppm2      2.798 CV     1
 ASSI {  493}
   (( segid "    " and resid 64   and name HD22))
   (( segid "    " and resid 64   and name HB2 ))
      5.200     3.400     0.800 peak   493 spectrum    1 weight  0.11000E+01 volume  0.29731E-03 ppm1      6.922 ppm2      3.092 CV     1
 ASSI {  494}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 134  and name HA  ))
      2.900     1.100     1.100 peak   494 spectrum    1 weight  0.11000E+01 volume  0.26385E-02 ppm1      9.149 ppm2      4.106 CV     1
 ASSI {  495}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 134  and name HB2 ))
      2.900     1.000     1.000 peak   495 spectrum    1 weight  0.11000E+01 volume  0.31108E-02 ppm1      9.151 ppm2      3.879 CV     1
 ASSI {  496}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HA  ))
      4.400     2.400     1.600 peak   496 spectrum    1 weight  0.11000E+01 volume  0.19214E-03 ppm1      9.151 ppm2      3.587 CV     1
 ASSI {  497}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HB2 ))
      3.200     1.300     1.300 peak   497 spectrum    1 weight  0.11000E+01 volume  0.15392E-02 ppm1      9.151 ppm2      2.164 CV     1
 ASSI {  498}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HB1 ))
      3.300     1.400     1.400 peak   498 spectrum    1 weight  0.11000E+01 volume  0.32068E-02 ppm1      9.151 ppm2      1.851 CV     1
 ASSI {  500}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
      2.700     2.700     3.300 peak   500 spectrum    1 weight  0.11000E+01 volume  0.86200E-02 ppm1      7.828 ppm2      4.151 CV     1
 ASSI {  501}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      3.500     1.500     1.500 peak   501 spectrum    1 weight  0.11000E+01 volume  0.31467E-02 ppm1      7.831 ppm2      2.239 CV     1
 ASSI {  502}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HD1 ))
      4.100     4.100     1.900 peak   502 spectrum    1 weight  0.11000E+01 volume  0.26463E-02 ppm1      7.828 ppm2      1.660 CV     1
 ASSI {  503}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HG1 ))
      2.800     1.000     1.000 peak   503 spectrum    1 weight  0.11000E+01 volume  0.32297E-02 ppm1      7.829 ppm2      1.397 CV     1
 ASSI {  504}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
      3.500     3.500     2.500 peak   504 spectrum    1 weight  0.11000E+01 volume  0.27115E-02 ppm1      7.830 ppm2      0.857 CV     1
 ASSI {  506}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HB2 ))
      3.000     1.200     1.200 peak   506 spectrum    1 weight  0.11000E+01 volume  0.12288E-02 ppm1      7.267 ppm2      2.356 CV     1
 ASSI {  507}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HG2 ))
      3.400     1.400     1.400 peak   507 spectrum    1 weight  0.11000E+01 volume  0.96867E-03 ppm1      7.264 ppm2      2.098 CV     1
 ASSI {  509}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HD2 ))
      2.800     2.800     3.200 peak   509 spectrum    1 weight  0.11000E+01 volume  0.10216E-02 ppm1      7.567 ppm2      1.737 CV     1
 ASSI {  510}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      2.400     0.700     0.700 peak   510 spectrum    1 weight  0.11000E+01 volume  0.75774E-02 ppm1      7.565 ppm2      4.068 CV     1
 ASSI {  511}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HB2 ))
      3.300     1.300     1.300 peak   511 spectrum    1 weight  0.11000E+01 volume  0.18774E-02 ppm1      7.566 ppm2      1.977 CV     1
 ASSI {  513}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
      3.500     3.500     2.500 peak   513 spectrum    1 weight  0.11000E+01 volume  0.29253E-02 ppm1      7.563 ppm2      0.828 CV     1
 ASSI {  514}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.000     1.100     1.100 peak   514 spectrum    1 weight  0.11000E+01 volume  0.14999E-02 ppm1      8.403 ppm2      4.490 CV     1
 ASSI {  515}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA2 ))
      3.200     1.300     1.300 peak   515 spectrum    1 weight  0.11000E+01 volume  0.26631E-02 ppm1      8.403 ppm2      3.842 CV     1
 ASSI {  516}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 106  and name HE% )
      5.800     5.800     0.200 peak   516 spectrum    1 weight  0.11000E+01 volume  0.12147E-03 ppm1      8.059 ppm2      6.005 CV     1
 ASSI {  517}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB  ))
      2.400     0.700     0.700 peak   517 spectrum    1 weight  0.11000E+01 volume  0.24515E-02 ppm1      8.060 ppm2      4.524 CV     1
 ASSI {  518}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      3.600     1.600     1.600 peak   518 spectrum    1 weight  0.11000E+01 volume  0.13176E-02 ppm1      8.058 ppm2      3.936 CV     1
 ASSI {  519}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      4.200     2.200     1.800 peak   519 spectrum    1 weight  0.11000E+01 volume  0.28812E-03 ppm1      8.056 ppm2      3.071 CV     1
 ASSI {  520}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 59   and name HG2%)
      3.400     1.500     1.500 peak   520 spectrum    1 weight  0.11000E+01 volume  0.46799E-02 ppm1      8.060 ppm2      1.451 CV     1
 ASSI {  521}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HB2 ))
      3.400     1.400     1.400 peak   521 spectrum    1 weight  0.11000E+01 volume  0.78039E-03 ppm1      7.941 ppm2      2.445 CV     1
 ASSI {  522}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      3.200     1.300     1.300 peak   522 spectrum    1 weight  0.11000E+01 volume  0.13291E-02 ppm1      7.940 ppm2      4.657 CV     1
 ASSI {  523}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HD2 ))
      3.300     1.400     1.400 peak   523 spectrum    1 weight  0.11000E+01 volume  0.64732E-03 ppm1      7.937 ppm2      3.874 CV     1
 ASSI {  524}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HD1 ))
      4.100     2.100     1.900 peak   524 spectrum    1 weight  0.11000E+01 volume  0.10797E-02 ppm1      7.938 ppm2      3.408 CV     1
 ASSI {  525}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 129  and name HB1 ))
      3.100     1.200     1.200 peak   525 spectrum    1 weight  0.11000E+01 volume  0.17288E-02 ppm1      7.936 ppm2      3.035 CV     1
 ASSI {  526}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HB1 ))
      3.600     1.600     1.600 peak   526 spectrum    1 weight  0.11000E+01 volume  0.20533E-02 ppm1      7.940 ppm2      2.044 CV     1
 ASSI {  527}
   (( segid "    " and resid 129  and name HN  ))
   (  segid "    " and resid 131  and name HG2%)
      4.100     4.100     1.900 peak   527 spectrum    1 weight  0.11000E+01 volume  0.10480E-02 ppm1      7.937 ppm2      0.937 CV     1
 ASSI {  528}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 106  and name HE% )
      6.000     6.000     0.000 peak   528 spectrum    1 weight  0.11000E+01 volume  0.31216E-04 ppm1      7.885 ppm2      6.010 CV     1
 ASSI {  529}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      4.600     2.600     1.400 peak   529 spectrum    1 weight  0.11000E+01 volume  0.48279E-03 ppm1      7.885 ppm2      4.512 CV     1
 ASSI {  530}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.900     1.100     1.100 peak   530 spectrum    1 weight  0.11000E+01 volume  0.12026E-02 ppm1      7.886 ppm2      3.959 CV     1
 ASSI {  531}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      3.000     1.100     1.100 peak   531 spectrum    1 weight  0.11000E+01 volume  0.19890E-02 ppm1      7.884 ppm2      3.067 CV     1
 ASSI {  532}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      3.600     1.600     1.600 peak   532 spectrum    1 weight  0.11000E+01 volume  0.28979E-02 ppm1      7.884 ppm2      2.896 CV     1
 ASSI {  533}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB2 ))
      2.500     0.800     0.800 peak   533 spectrum    1 weight  0.11000E+01 volume  0.22657E-02 ppm1      7.883 ppm2      3.356 CV     1
 ASSI {  534}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 60   and name HB2 ))
      4.300     2.300     1.700 peak   534 spectrum    1 weight  0.11000E+01 volume  0.65435E-03 ppm1      7.883 ppm2      1.455 CV     1
 ASSI {  535}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.700     0.900     0.900 peak   535 spectrum    1 weight  0.11000E+01 volume  0.31995E-02 ppm1      8.550 ppm2      4.259 CV     1
 ASSI {  536}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HA1 ))
      2.600     0.900     0.900 peak   536 spectrum    1 weight  0.11000E+01 volume  0.33220E-02 ppm1      8.550 ppm2      3.918 CV     1
 ASSI {  538}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HA  ))
      2.900     1.100     1.100 peak   538 spectrum    1 weight  0.11000E+01 volume  0.17337E-02 ppm1      8.498 ppm2      4.255 CV     1
 ASSI {  539}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HA2 ))
      3.200     1.300     1.300 peak   539 spectrum    1 weight  0.11000E+01 volume  0.27498E-02 ppm1      8.498 ppm2      3.879 CV     1
 ASSI {  541}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      3.100     1.200     1.200 peak   541 spectrum    1 weight  0.11000E+01 volume  0.18438E-02 ppm1      8.258 ppm2      1.782 CV     1
 ASSI {  542}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
      2.700     0.900     0.900 peak   542 spectrum    1 weight  0.11000E+01 volume  0.42533E-02 ppm1      8.258 ppm2      1.334 CV     1
 ASSI {  543}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.300     0.700     0.700 peak   543 spectrum    1 weight  0.11000E+01 volume  0.32170E-02 ppm1      8.258 ppm2      4.969 CV     1
 ASSI {  544}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.200     1.300     1.300 peak   544 spectrum    1 weight  0.11000E+01 volume  0.77619E-03 ppm1      8.258 ppm2      4.502 CV     1
 ASSI {  546}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
      5.900     4.400     0.100 peak   546 spectrum    1 weight  0.11000E+01 volume  0.23243E-03 ppm1      8.255 ppm2      0.446 CV     1
 ASSI {  547}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      4.200     2.200     1.800 peak   547 spectrum    1 weight  0.11000E+01 volume  0.85024E-03 ppm1      8.258 ppm2     -0.041 CV     1
 ASSI {  548}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HB1 ))
      5.100     3.200     0.900 peak   548 spectrum    1 weight  0.11000E+01 volume  0.21772E-03 ppm1      7.964 ppm2      2.762 CV     1
 ASSI {  549}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      3.300     1.400     1.400 peak   549 spectrum    1 weight  0.11000E+01 volume  0.89746E-03 ppm1      7.968 ppm2      4.524 CV     1
 ASSI {  550}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HA1 ))
      2.900     1.000     1.000 peak   550 spectrum    1 weight  0.11000E+01 volume  0.22253E-02 ppm1      7.969 ppm2      3.892 CV     1
 ASSI {  551}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      3.100     1.200     1.200 peak   551 spectrum    1 weight  0.11000E+01 volume  0.12546E-02 ppm1      7.837 ppm2      4.445 CV     1
 ASSI {  552}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.200     0.600     0.600 peak   552 spectrum    1 weight  0.11000E+01 volume  0.79551E-02 ppm1      7.836 ppm2      3.942 CV     1
 ASSI {  553}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HD2 ))
      3.800     1.800     1.800 peak   553 spectrum    1 weight  0.11000E+01 volume  0.23172E-02 ppm1      7.837 ppm2      3.425 CV     1
 ASSI {  554}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HD1 ))
      2.700     0.900     0.900 peak   554 spectrum    1 weight  0.11000E+01 volume  0.21304E-02 ppm1      7.837 ppm2      3.085 CV     1
 ASSI {  556}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB2 ))
      3.500     1.500     1.500 peak   556 spectrum    1 weight  0.11000E+01 volume  0.11472E-02 ppm1      7.837 ppm2      1.505 CV     1
 ASSI {  557}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB1 ))
      3.800     1.800     1.800 peak   557 spectrum    1 weight  0.11000E+01 volume  0.13259E-02 ppm1      7.839 ppm2      1.258 CV     1
 ASSI {  558}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 60   and name HD2%)
      6.000     4.500     0.000 peak   558 spectrum    1 weight  0.11000E+01 volume  0.20269E-03 ppm1      7.837 ppm2      0.676 CV     1
 ASSI {  559}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HA2 ))
      2.800     0.900     0.900 peak   559 spectrum    1 weight  0.11000E+01 volume  0.21743E-02 ppm1      8.076 ppm2      3.820 CV     1
 ASSI {  560}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HA1 ))
      3.700     1.700     1.700 peak   560 spectrum    1 weight  0.11000E+01 volume  0.12209E-02 ppm1      8.264 ppm2      3.927 CV     1
 ASSI {  561}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HA1 ))
      2.500     0.800     0.800 peak   561 spectrum    1 weight  0.11000E+01 volume  0.30756E-02 ppm1      8.928 ppm2      3.560 CV     1
 ASSI {  562}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      3.100     1.200     1.200 peak   562 spectrum    1 weight  0.11000E+01 volume  0.34651E-02 ppm1      8.923 ppm2      4.691 CV     1
 ASSI {  563}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HA2 ))
      2.300     0.600     0.600 peak   563 spectrum    1 weight  0.11000E+01 volume  0.42515E-02 ppm1      8.924 ppm2      3.808 CV     1
 ASSI {  564}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      6.000     6.000     0.000 peak   564 spectrum    1 weight  0.11000E+01 volume  0.23248E-04 ppm1      8.920 ppm2      1.787 CV     1
 ASSI {  565}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
      3.800     1.800     1.800 peak   565 spectrum    1 weight  0.11000E+01 volume  0.25529E-02 ppm1      8.923 ppm2      1.319 CV     1
 ASSI {  567}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      4.400     2.400     1.600 peak   567 spectrum    1 weight  0.11000E+01 volume  0.47199E-03 ppm1      8.388 ppm2      1.327 CV     1
 ASSI {  568}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      3.100     1.200     1.200 peak   568 spectrum    1 weight  0.11000E+01 volume  0.13071E-02 ppm1      8.386 ppm2      4.282 CV     1
 ASSI {  569}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HA1 ))
      2.600     0.900     0.900 peak   569 spectrum    1 weight  0.11000E+01 volume  0.34624E-02 ppm1      8.386 ppm2      3.886 CV     1
 ASSI {  570}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HA2 ))
      2.600     0.900     0.900 peak   570 spectrum    1 weight  0.11000E+01 volume  0.73674E-02 ppm1      8.444 ppm2      3.933 CV     1
 ASSI {  571}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      4.100     2.100     1.900 peak   571 spectrum    1 weight  0.11000E+01 volume  0.10089E-03 ppm1      8.441 ppm2      2.823 CV     1
 ASSI {  572}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      4.800     2.900     1.200 peak   572 spectrum    1 weight  0.11000E+01 volume  0.35945E-03 ppm1      8.442 ppm2      2.007 CV     1
 ASSI {  573}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HG2 ))
      3.700     3.700     2.300 peak   573 spectrum    1 weight  0.11000E+01 volume  0.15330E-02 ppm1      8.444 ppm2      1.700 CV     1
 ASSI {  574}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      4.400     4.400     1.600 peak   574 spectrum    1 weight  0.11000E+01 volume  0.10249E-02 ppm1      8.444 ppm2      1.093 CV     1
 ASSI {  575}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
      4.100     2.100     1.900 peak   575 spectrum    1 weight  0.11000E+01 volume  0.11624E-02 ppm1      8.442 ppm2      0.751 CV     1
 ASSI {  577}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      2.600     0.800     0.800 peak   577 spectrum    1 weight  0.11000E+01 volume  0.46488E-02 ppm1      7.852 ppm2      4.130 CV     1
 ASSI {  578}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HA1 ))
      3.100     1.200     1.200 peak   578 spectrum    1 weight  0.11000E+01 volume  0.35648E-02 ppm1      7.852 ppm2      3.628 CV     1
 ASSI {  579}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      5.400     3.600     0.600 peak   579 spectrum    1 weight  0.11000E+01 volume  0.29206E-03 ppm1      7.850 ppm2      2.893 CV     1
 ASSI {  581}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 117  and name HD2%)
      3.400     1.500     1.500 peak   581 spectrum    1 weight  0.11000E+01 volume  0.29586E-03 ppm1      7.853 ppm2      0.926 CV     1
 ASSI {  584}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HA1 ))
      3.200     1.300     1.300 peak   584 spectrum    1 weight  0.11000E+01 volume  0.26438E-02 ppm1      8.843 ppm2      3.737 CV     1
 ASSI {  585}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      5.200     5.200     0.800 peak   585 spectrum    1 weight  0.11000E+01 volume  0.34120E-03 ppm1      8.848 ppm2      0.891 CV     1
 ASSI {  589}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 66   and name HE1 ))
      5.800     4.300     0.200 peak   589 spectrum    1 weight  0.11000E+01 volume  0.29219E-03 ppm1      8.846 ppm2      3.096 CV     1
 ASSI {  590}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      3.100     1.200     1.200 peak   590 spectrum    1 weight  0.11000E+01 volume  0.19645E-02 ppm1      8.843 ppm2      4.402 CV     1
 ASSI {  591}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      3.000     1.100     1.100 peak   591 spectrum    1 weight  0.11000E+01 volume  0.11447E-02 ppm1      8.844 ppm2      7.486 CV     1
 ASSI {  592}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      5.000     3.100     1.000 peak   592 spectrum    1 weight  0.11000E+01 volume  0.63248E-04 ppm1      8.838 ppm2      9.693 CV     1
 ASSI {  593}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HA1 ))
      3.700     1.700     1.700 peak   593 spectrum    1 weight  0.11000E+01 volume  0.36445E-03 ppm1      7.321 ppm2      3.548 CV     1
 ASSI {  594}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HA2 ))
      4.400     2.400     1.600 peak   594 spectrum    1 weight  0.11000E+01 volume  0.34247E-03 ppm1      7.317 ppm2      4.165 CV     1
 ASSI {  596}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      3.800     1.800     1.800 peak   596 spectrum    1 weight  0.11000E+01 volume  0.28493E-03 ppm1      7.327 ppm2      7.573 CV     1
 ASSI {  598}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HG2 ))
      3.800     1.800     1.800 peak   598 spectrum    1 weight  0.11000E+01 volume  0.15988E-03 ppm1      7.851 ppm2      2.522 CV     1
 ASSI {  600}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      5.100     5.100     0.900 peak   600 spectrum    1 weight  0.11000E+01 volume  0.41830E-03 ppm1      7.849 ppm2      0.673 CV     1
 ASSI {  601}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      4.400     2.400     1.600 peak   601 spectrum    1 weight  0.11000E+01 volume  0.27569E-03 ppm1      7.860 ppm2      1.438 CV     1
 ASSI {  602}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      6.000     5.100     0.000 peak   602 spectrum    1 weight  0.11000E+01 volume  0.32920E-03 ppm1      7.847 ppm2      3.022 CV     1
 ASSI {  603}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 120  and name HD2 ))
      5.600     4.000     0.400 peak   603 spectrum    1 weight  0.11000E+01 volume  0.22754E-03 ppm1      7.853 ppm2      7.143 CV     1
 ASSI {  604}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      4.900     3.000     1.100 peak   604 spectrum    1 weight  0.11000E+01 volume  0.22028E-03 ppm1      7.851 ppm2      8.946 CV     1
 ASSI {  605}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
      2.000     0.500     0.500 peak   605 spectrum    1 weight  0.11000E+01 volume  0.15024E-01 ppm1      7.853 ppm2      7.644 CV     1
 ASSI {  606}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      5.100     3.300     0.900 peak   606 spectrum    1 weight  0.11000E+01 volume  0.32185E-03 ppm1      8.442 ppm2      3.379 CV     1
 ASSI {  607}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      5.700     4.000     0.300 peak   607 spectrum    1 weight  0.11000E+01 volume  0.19372E-03 ppm1      8.443 ppm2      3.230 CV     1
 ASSI {  608}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      4.200     2.200     1.800 peak   608 spectrum    1 weight  0.11000E+01 volume  0.36880E-03 ppm1      8.445 ppm2      4.263 CV     1
 ASSI {  609}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      4.300     2.300     1.700 peak   609 spectrum    1 weight  0.11000E+01 volume  0.43252E-03 ppm1      8.444 ppm2      6.904 CV     1
 ASSI {  610}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      2.700     0.900     0.900 peak   610 spectrum    1 weight  0.11000E+01 volume  0.23755E-02 ppm1      8.444 ppm2      7.344 CV     1
 ASSI {  611}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      2.600     0.800     0.800 peak   611 spectrum    1 weight  0.11000E+01 volume  0.32281E-02 ppm1      8.444 ppm2      8.097 CV     1
 ASSI {  612}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 101  and name HG  ))
      4.700     2.700     1.300 peak   612 spectrum    1 weight  0.11000E+01 volume  0.50346E-03 ppm1      8.921 ppm2      1.565 CV     1
 ASSI {  613}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.400     3.400     2.600 peak   613 spectrum    1 weight  0.11000E+01 volume  0.19175E-03 ppm1      8.921 ppm2      5.101 CV     1
 ASSI {  614}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 90   and name HZ3 ))
      5.200     3.400     0.800 peak   614 spectrum    1 weight  0.11000E+01 volume  0.37142E-03 ppm1      8.925 ppm2      6.764 CV     1
 ASSI {  615}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      5.500     3.800     0.500 peak   615 spectrum    1 weight  0.11000E+01 volume  0.56253E-04 ppm1      8.923 ppm2      7.561 CV     1
 ASSI {  617}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 71   and name HD22))
      6.000     6.000     0.000 peak   617 spectrum    1 weight  0.11000E+01 volume  0.22772E-04 ppm1      8.925 ppm2      7.117 CV     1
 ASSI {  618}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HB2 ))
      6.000     4.600     0.000 peak   618 spectrum    1 weight  0.11000E+01 volume  0.14442E-03 ppm1      8.387 ppm2      1.978 CV     1
 ASSI {  619}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HB1 ))
      4.600     2.600     1.400 peak   619 spectrum    1 weight  0.11000E+01 volume  0.44884E-03 ppm1      8.075 ppm2      2.779 CV     1
 ASSI {  620}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HB2 ))
      5.200     3.300     0.800 peak   620 spectrum    1 weight  0.11000E+01 volume  0.13498E-03 ppm1      8.074 ppm2      3.081 CV     1
 ASSI {  621}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      4.500     2.500     1.500 peak   621 spectrum    1 weight  0.11000E+01 volume  0.30091E-03 ppm1      7.838 ppm2     -0.045 CV     1
 ASSI {  622}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
      6.000     6.000     0.000 peak   622 spectrum    1 weight  0.11000E+01 volume  0.24470E-03 ppm1      7.835 ppm2      0.470 CV     1
 ASSI {  623}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      2.900     1.100     1.100 peak   623 spectrum    1 weight  0.11000E+01 volume  0.13352E-02 ppm1      7.837 ppm2      7.343 CV     1
 ASSI {  625}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      6.000     6.000     0.000 peak   625 spectrum    1 weight  0.11000E+01 volume  0.52292E-04 ppm1      8.259 ppm2      2.512 CV     1
 ASSI {  626}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 71   and name HD22))
      4.100     2.100     1.900 peak   626 spectrum    1 weight  0.11000E+01 volume  0.16387E-03 ppm1      8.259 ppm2      7.062 CV     1
 ASSI {  627}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      5.800     4.300     0.200 peak   627 spectrum    1 weight  0.11000E+01 volume  0.17525E-03 ppm1      8.257 ppm2      7.562 CV     1
 ASSI {  628}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      4.900     3.000     1.100 peak   628 spectrum    1 weight  0.11000E+01 volume  0.33255E-03 ppm1      8.260 ppm2      8.761 CV     1
 ASSI {  629}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      5.600     4.000     0.400 peak   629 spectrum    1 weight  0.11000E+01 volume  0.90478E-04 ppm1      8.260 ppm2      9.207 CV     1
 ASSI {  631}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
      5.700     5.700     0.300 peak   631 spectrum    1 weight  0.11000E+01 volume  0.13815E-03 ppm1      8.552 ppm2      0.821 CV     1
 ASSI {  632}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB2 ))
      4.400     2.500     1.600 peak   632 spectrum    1 weight  0.11000E+01 volume  0.54123E-03 ppm1      8.498 ppm2      1.924 CV     1
 ASSI {  633}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HG2 ))
      4.500     2.600     1.500 peak   633 spectrum    1 weight  0.11000E+01 volume  0.62583E-03 ppm1      8.498 ppm2      2.143 CV     1
 ASSI {  634}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      3.900     1.900     1.900 peak   634 spectrum    1 weight  0.11000E+01 volume  0.93316E-03 ppm1      8.549 ppm2      7.911 CV     1
 ASSI {  635}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      4.900     3.000     1.100 peak   635 spectrum    1 weight  0.11000E+01 volume  0.33448E-03 ppm1      8.548 ppm2      8.222 CV     1
 ASSI {  636}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      4.300     2.300     1.700 peak   636 spectrum    1 weight  0.11000E+01 volume  0.18197E-02 ppm1      8.498 ppm2      8.209 CV     1
 ASSI {  637}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 56   and name HG2%)
      4.900     3.000     1.100 peak   637 spectrum    1 weight  0.11000E+01 volume  0.42623E-03 ppm1      8.059 ppm2      1.092 CV     1
 ASSI {  638}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 60   and name HD2%)
      5.700     5.700     0.300 peak   638 spectrum    1 weight  0.11000E+01 volume  0.32651E-03 ppm1      8.059 ppm2      0.684 CV     1
 ASSI {  639}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
      5.600     5.600     0.400 peak   639 spectrum    1 weight  0.11000E+01 volume  0.32866E-03 ppm1      8.058 ppm2      0.463 CV     1
 ASSI {  640}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      4.100     2.100     1.900 peak   640 spectrum    1 weight  0.11000E+01 volume  0.70224E-03 ppm1      8.059 ppm2      2.907 CV     1
 ASSI {  641}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HB2 ))
      3.900     1.900     1.900 peak   641 spectrum    1 weight  0.11000E+01 volume  0.36293E-03 ppm1      8.058 ppm2      3.376 CV     1
 ASSI {  642}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HA  ))
      4.000     2.000     2.000 peak   642 spectrum    1 weight  0.11000E+01 volume  0.38786E-03 ppm1      7.938 ppm2      4.178 CV     1
 ASSI {  643}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 127  and name HG1 ))
      5.700     4.100     0.300 peak   643 spectrum    1 weight  0.11000E+01 volume  0.40599E-03 ppm1      7.942 ppm2      1.517 CV     1
 ASSI {  645}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 56   and name HG2%)
      5.400     3.600     0.600 peak   645 spectrum    1 weight  0.11000E+01 volume  0.26958E-03 ppm1      7.885 ppm2      1.109 CV     1
 ASSI {  646}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HB  ))
      5.800     4.200     0.200 peak   646 spectrum    1 weight  0.11000E+01 volume  0.12822E-03 ppm1      7.883 ppm2      2.388 CV     1
 ASSI {  648}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 130  and name HN  ))
      2.700     0.900     0.900 peak   648 spectrum    1 weight  0.11000E+01 volume  0.22118E-02 ppm1      7.938 ppm2      7.690 CV     1
 ASSI {  651}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 131  and name HN  ))
      5.100     3.200     0.900 peak   651 spectrum    1 weight  0.11000E+01 volume  0.42881E-03 ppm1      7.936 ppm2      7.186 CV     1
 ASSI {  652}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      3.200     1.300     1.300 peak   652 spectrum    1 weight  0.11000E+01 volume  0.66529E-03 ppm1      7.882 ppm2      9.071 CV     1
 ASSI {  653}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      4.600     2.700     1.400 peak   653 spectrum    1 weight  0.11000E+01 volume  0.15450E-03 ppm1      8.062 ppm2      9.071 CV     1
 ASSI {  654}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
      4.300     2.300     1.700 peak   654 spectrum    1 weight  0.11000E+01 volume  0.42550E-03 ppm1      8.403 ppm2      2.988 CV     1
 ASSI {  655}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      4.600     2.700     1.400 peak   655 spectrum    1 weight  0.11000E+01 volume  0.56845E-03 ppm1      8.403 ppm2      8.172 CV     1
 ASSI {  656}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 77   and name HB  ))
      4.500     2.600     1.500 peak   656 spectrum    1 weight  0.11000E+01 volume  0.51324E-03 ppm1      7.564 ppm2      2.289 CV     1
 ASSI {  657}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HE2 ))
      4.600     2.700     1.400 peak   657 spectrum    1 weight  0.11000E+01 volume  0.48467E-04 ppm1      7.569 ppm2      2.969 CV     1
 ASSI {  659}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      2.700     0.900     0.900 peak   659 spectrum    1 weight  0.11000E+01 volume  0.24930E-02 ppm1      7.569 ppm2      7.834 CV     1
 ASSI {  660}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      5.600     3.900     0.400 peak   660 spectrum    1 weight  0.11000E+01 volume  0.86089E-04 ppm1      7.563 ppm2      8.516 CV     1
 ASSI {  663}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      2.600     0.800     0.800 peak   663 spectrum    1 weight  0.11000E+01 volume  0.51531E-02 ppm1      7.829 ppm2      7.516 CV     1
 ASSI {  666}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
      6.000     4.800     0.000 peak   666 spectrum    1 weight  0.11000E+01 volume  0.23413E-03 ppm1      7.264 ppm2      3.153 CV     1
 ASSI {  668}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      4.500     2.500     1.500 peak   668 spectrum    1 weight  0.11000E+01 volume  0.64038E-03 ppm1      7.268 ppm2      6.785 CV     1
 ASSI {  670}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 135  and name HG1 ))
      6.000     4.700     0.000 peak   670 spectrum    1 weight  0.11000E+01 volume  0.83189E-04 ppm1      9.150 ppm2      1.084 CV     1
 ASSI {  672}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 132  and name HA  ))
      5.000     3.100     1.000 peak   672 spectrum    1 weight  0.11000E+01 volume  0.12142E-03 ppm1      9.151 ppm2      2.668 CV     1
 ASSI {  673}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 135  and name HN  ))
      2.900     1.000     1.000 peak   673 spectrum    1 weight  0.11000E+01 volume  0.13177E-02 ppm1      9.152 ppm2      7.839 CV     1
 ASSI {  674}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
      4.900     2.900     1.100 peak   674 spectrum    1 weight  0.11000E+01 volume  0.41174E-03 ppm1      9.153 ppm2      7.067 CV     1
 ASSI {  675}
   (( segid "    " and resid 64   and name HD21))
   (( segid "    " and resid 64   and name HA  ))
      4.700     2.700     1.300 peak   675 spectrum    1 weight  0.11000E+01 volume  0.26530E-03 ppm1      7.651 ppm2      4.376 CV     1
 ASSI {  676}
   (( segid "    " and resid 64   and name HD21))
   (( segid "    " and resid 64   and name HD22))
      1.900     0.400     0.400 peak   676 spectrum    1 weight  0.11000E+01 volume  0.10230E-01 ppm1      7.649 ppm2      6.920 CV     1
 ASSI {  678}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 123  and name HD2 ))
      5.100     3.300     0.900 peak   678 spectrum    1 weight  0.11000E+01 volume  0.51700E-04 ppm1      7.461 ppm2      3.732 CV     1
 ASSI {  680}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      4.600     2.600     1.400 peak   680 spectrum    1 weight  0.11000E+01 volume  0.25378E-03 ppm1      7.412 ppm2      3.463 CV     1
 ASSI {  682}
   (( segid "    " and resid 64   and name HD22))
   (( segid "    " and resid 64   and name HA  ))
      6.000     6.000     0.000 peak   682 spectrum    1 weight  0.11000E+01 volume  0.12926E-04 ppm1      6.926 ppm2      4.383 CV     1
 ASSI {  685}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      4.000     2.000     2.000 peak   685 spectrum    1 weight  0.11000E+01 volume  0.60550E-03 ppm1      7.267 ppm2      9.556 CV     1
 ASSI {  686}
   (( segid "    " and resid 83   and name HD21))
   (( segid "    " and resid 83   and name HB2 ))
      4.100     2.100     1.900 peak   686 spectrum    1 weight  0.11000E+01 volume  0.56913E-03 ppm1      7.694 ppm2      2.830 CV     1
 ASSI {  687}
   (( segid "    " and resid 83   and name HD21))
   (( segid "    " and resid 83   and name HD22))
      1.800     0.400     0.400 peak   687 spectrum    1 weight  0.11000E+01 volume  0.86393E-02 ppm1      7.695 ppm2      6.972 CV     1
 ASSI {  691}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      4.100     2.100     1.900 peak   691 spectrum    1 weight  0.11000E+01 volume  0.78183E-03 ppm1      7.414 ppm2      8.326 CV     1
 ASSI {  693}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      5.800     5.800     0.200 peak   693 spectrum    1 weight  0.11000E+01 volume  0.16584E-03 ppm1      7.218 ppm2      0.485 CV     1
 ASSI {  694}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 111  and name HB1 ))
      5.500     3.800     0.500 peak   694 spectrum    1 weight  0.11000E+01 volume  0.22245E-03 ppm1      7.213 ppm2      3.013 CV     1
 ASSI {  695}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      3.300     1.400     1.400 peak   695 spectrum    1 weight  0.11000E+01 volume  0.18713E-02 ppm1      7.213 ppm2      8.316 CV     1
 ASSI {  697}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      6.000     6.000     0.000 peak   697 spectrum    1 weight  0.11000E+01 volume  0.94169E-05 ppm1      7.209 ppm2      6.771 CV     1
 ASSI {  698}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      5.900     5.900     0.100 peak   698 spectrum    1 weight  0.11000E+01 volume  0.17749E-03 ppm1     10.647 ppm2      0.833 CV     1
 ASSI {  699}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HB1 ))
      5.500     3.800     0.500 peak   699 spectrum    1 weight  0.11000E+01 volume  0.15166E-03 ppm1     10.640 ppm2      2.438 CV     1
 ASSI {  700}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HB2 ))
      4.900     3.000     1.100 peak   700 spectrum    1 weight  0.11000E+01 volume  0.17265E-03 ppm1     10.638 ppm2      3.011 CV     1
 ASSI {  702}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 97   and name HG2 ))
      3.200     3.200     2.800 peak   702 spectrum    1 weight  0.11000E+01 volume  0.44789E-03 ppm1     10.638 ppm2      1.353 CV     1
 ASSI {  703}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      2.300     0.700     0.700 peak   703 spectrum    1 weight  0.11000E+01 volume  0.42284E-02 ppm1     10.640 ppm2      8.341 CV     1
 ASSI {  704}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      2.300     0.700     0.700 peak   704 spectrum    1 weight  0.11000E+01 volume  0.39721E-02 ppm1     10.641 ppm2      8.129 CV     1
 ASSI {  705}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      4.800     2.900     1.200 peak   705 spectrum    1 weight  0.11000E+01 volume  0.45620E-03 ppm1     10.640 ppm2      7.523 CV     1
 ASSI {  706}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 90   and name HZ2 ))
      3.600     1.600     1.600 peak   706 spectrum    1 weight  0.11000E+01 volume  0.58368E-03 ppm1     10.640 ppm2      7.142 CV     1
 ASSI {  707}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
      3.800     1.800     1.800 peak   707 spectrum    1 weight  0.11000E+01 volume  0.16615E-03 ppm1      8.121 ppm2      2.580 CV     1
 ASSI {  708}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      6.000     6.000     0.000 peak   708 spectrum    1 weight  0.11000E+01 volume  0.78752E-04 ppm1      7.911 ppm2      0.044 CV     1
 ASSI {  710}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      2.400     0.700     0.700 peak   710 spectrum    1 weight  0.11000E+01 volume  0.45056E-02 ppm1      7.911 ppm2      7.519 CV     1
 ASSI {  711}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      2.600     0.900     0.900 peak   711 spectrum    1 weight  0.11000E+01 volume  0.25428E-02 ppm1      7.910 ppm2      8.321 CV     1
 ASSI {  712}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      5.300     3.500     0.700 peak   712 spectrum    1 weight  0.11000E+01 volume  0.11529E-03 ppm1      7.525 ppm2      3.480 CV     1
 ASSI {  714}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      2.900     1.000     1.000 peak   714 spectrum    1 weight  0.11000E+01 volume  0.24459E-02 ppm1      7.530 ppm2      8.336 CV     1
 ASSI {  717}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB1 ))
      3.900     1.900     1.900 peak   717 spectrum    1 weight  0.11000E+01 volume  0.71530E-03 ppm1      7.530 ppm2      2.263 CV     1
 ASSI {  718}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      4.700     4.700     1.300 peak   718 spectrum    1 weight  0.11000E+01 volume  0.62501E-03 ppm1      7.529 ppm2      0.929 CV     1
 ASSI {  719}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 71   and name HB1 ))
      3.900     1.900     1.900 peak   719 spectrum    1 weight  0.11000E+01 volume  0.32574E-03 ppm1      8.101 ppm2      2.534 CV     1
 ASSI {  721}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 69   and name HA2 ))
      5.100     3.200     0.900 peak   721 spectrum    1 weight  0.11000E+01 volume  0.15409E-03 ppm1      8.099 ppm2      3.810 CV     1
 ASSI {  723}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      3.400     1.400     1.400 peak   723 spectrum    1 weight  0.11000E+01 volume  0.18912E-02 ppm1      7.479 ppm2      4.133 CV     1
 ASSI {  724}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      4.300     2.300     1.700 peak   724 spectrum    1 weight  0.11000E+01 volume  0.46174E-03 ppm1      7.478 ppm2      8.109 CV     1
 ASSI {  726}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HD1 ))
      4.000     2.000     2.000 peak   726 spectrum    1 weight  0.11000E+01 volume  0.36110E-03 ppm1      7.480 ppm2      7.180 CV     1
 ASSI {  728}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 69   and name HA2 ))
      4.800     2.800     1.200 peak   728 spectrum    1 weight  0.11000E+01 volume  0.33772E-03 ppm1      7.078 ppm2      3.818 CV     1
 ASSI {  729}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 71   and name HB1 ))
      4.700     2.800     1.300 peak   729 spectrum    1 weight  0.11000E+01 volume  0.39397E-03 ppm1      7.087 ppm2      2.531 CV     1
 ASSI {  731}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 71   and name HD21))
      2.000     0.500     0.500 peak   731 spectrum    1 weight  0.11000E+01 volume  0.38213E-02 ppm1      7.087 ppm2      8.097 CV     1
 ASSI {  732}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HE1 ))
      6.000     4.700     0.000 peak   732 spectrum    1 weight  0.11000E+01 volume  0.13792E-03 ppm1      7.473 ppm2     10.337 CV     1
 ASSI {  733}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      3.900     1.900     1.900 peak   733 spectrum    1 weight  0.11000E+01 volume  0.97796E-03 ppm1      8.530 ppm2      5.393 CV     1
 ASSI {  736}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 57   and name HZ  ))
      4.200     2.200     1.800 peak   736 spectrum    1 weight  0.11000E+01 volume  0.19415E-03 ppm1      8.526 ppm2      6.818 CV     1
 ASSI {  737}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      4.800     2.900     1.200 peak   737 spectrum    1 weight  0.11000E+01 volume  0.40449E-03 ppm1      8.531 ppm2      9.194 CV     1
 ASSI {  738}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HB1 ))
      4.800     2.900     1.200 peak   738 spectrum    1 weight  0.11000E+01 volume  0.19300E-03 ppm1      8.349 ppm2      3.832 CV     1
 ASSI {  740}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      3.300     1.300     1.300 peak   740 spectrum    1 weight  0.11000E+01 volume  0.57240E-03 ppm1      9.205 ppm2      8.690 CV     1
 ASSI {  741}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      3.500     1.500     1.500 peak   741 spectrum    1 weight  0.11000E+01 volume  0.10200E-02 ppm1      9.206 ppm2      5.593 CV     1
 ASSI {  742}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      5.500     3.700     0.500 peak   742 spectrum    1 weight  0.11000E+01 volume  0.11701E-03 ppm1      7.291 ppm2      0.491 CV     1
 ASSI {  743}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      4.400     2.400     1.600 peak   743 spectrum    1 weight  0.11000E+01 volume  0.45869E-03 ppm1      7.287 ppm2      6.733 CV     1
 ASSI {  746}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      4.100     2.200     1.900 peak   746 spectrum    1 weight  0.11000E+01 volume  0.32830E-03 ppm1      7.275 ppm2      9.072 CV     1
 ASSI {  747}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      3.900     1.900     1.900 peak   747 spectrum    1 weight  0.11000E+01 volume  0.44924E-03 ppm1      8.531 ppm2      7.123 CV     1
 ASSI {  750}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      4.200     2.200     1.800 peak   750 spectrum    1 weight  0.11000E+01 volume  0.18918E-03 ppm1      8.226 ppm2      4.305 CV     1
 ASSI {  752}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HG1 ))
      4.100     2.100     1.900 peak   752 spectrum    1 weight  0.11000E+01 volume  0.68307E-03 ppm1      7.122 ppm2      1.443 CV     1
 ASSI {  753}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      2.100     0.500     0.500 peak   753 spectrum    1 weight  0.11000E+01 volume  0.95484E-02 ppm1      7.125 ppm2      7.380 CV     1
 ASSI {  754}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      2.600     0.800     0.800 peak   754 spectrum    1 weight  0.11000E+01 volume  0.23436E-02 ppm1      7.125 ppm2      8.486 CV     1
 ASSI {  759}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      3.900     1.900     1.900 peak   759 spectrum    1 weight  0.11000E+01 volume  0.56961E-03 ppm1      7.564 ppm2      3.919 CV     1
 ASSI {  760}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HA2 ))
      3.100     1.200     1.200 peak   760 spectrum    1 weight  0.11000E+01 volume  0.19296E-02 ppm1      7.496 ppm2      4.209 CV     1
 ASSI {  761}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HD21))
      3.300     1.300     1.300 peak   761 spectrum    1 weight  0.11000E+01 volume  0.44924E-03 ppm1      7.569 ppm2      8.101 CV     1
 ASSI {  763}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      2.500     0.800     0.800 peak   763 spectrum    1 weight  0.11000E+01 volume  0.29086E-02 ppm1      7.567 ppm2      8.793 CV     1
 ASSI {  764}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      5.000     5.000     1.000 peak   764 spectrum    1 weight  0.11000E+01 volume  0.24608E-03 ppm1      7.564 ppm2      7.076 CV     1
 ASSI {  765}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      2.500     0.800     0.800 peak   765 spectrum    1 weight  0.11000E+01 volume  0.35655E-02 ppm1      7.488 ppm2      8.755 CV     1
 ASSI {  767}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HE2 ))
      3.800     1.800     1.800 peak   767 spectrum    1 weight  0.11000E+01 volume  0.15562E-03 ppm1      8.099 ppm2      2.985 CV     1
 ASSI {  768}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 116  and name HG2 ))
      4.500     2.600     1.500 peak   768 spectrum    1 weight  0.11000E+01 volume  0.48944E-03 ppm1      8.098 ppm2      1.520 CV     1
 ASSI {  769}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.000     1.100     1.100 peak   769 spectrum    1 weight  0.11000E+01 volume  0.10236E-02 ppm1      8.093 ppm2      7.517 CV     1
 ASSI {  770}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 116  and name HN  ))
      2.700     0.900     0.900 peak   770 spectrum    1 weight  0.11000E+01 volume  0.20063E-02 ppm1      8.094 ppm2      7.824 CV     1
 ASSI {  771}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      5.200     3.400     0.800 peak   771 spectrum    1 weight  0.11000E+01 volume  0.95118E-04 ppm1      8.091 ppm2      8.949 CV     1
 ASSI {  774}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      4.700     2.800     1.300 peak   774 spectrum    1 weight  0.11000E+01 volume  0.20069E-03 ppm1      7.226 ppm2      9.556 CV     1
 ASSI {  776}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HB1 ))
      3.000     1.100     1.100 peak   776 spectrum    1 weight  0.11000E+01 volume  0.75524E-03 ppm1      8.280 ppm2      3.004 CV     1
 ASSI {  778}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 92   and name HD2%)
      3.700     1.700     1.700 peak   778 spectrum    1 weight  0.11000E+01 volume  0.40153E-02 ppm1      7.580 ppm2      0.679 CV     1
 ASSI {  779}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HG2 ))
      3.500     1.600     1.600 peak   779 spectrum    1 weight  0.11000E+01 volume  0.44508E-03 ppm1      7.581 ppm2      1.553 CV     1
 ASSI {  780}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.600     1.600     1.600 peak   780 spectrum    1 weight  0.11000E+01 volume  0.79522E-03 ppm1      7.580 ppm2      3.439 CV     1
 ASSI {  781}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      3.200     1.300     1.300 peak   781 spectrum    1 weight  0.11000E+01 volume  0.12638E-02 ppm1      7.582 ppm2      3.831 CV     1
 ASSI {  783}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      4.300     2.300     1.700 peak   783 spectrum    1 weight  0.11000E+01 volume  0.21419E-03 ppm1      7.578 ppm2      8.569 CV     1
 ASSI {  784}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      4.200     4.200     1.800 peak   784 spectrum    1 weight  0.11000E+01 volume  0.50023E-03 ppm1      7.368 ppm2      8.491 CV     1
 ASSI {  785}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      2.600     0.800     0.800 peak   785 spectrum    1 weight  0.11000E+01 volume  0.22049E-02 ppm1      7.368 ppm2      8.805 CV     1
 ASSI {  790}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      5.700     5.700     0.300 peak   790 spectrum    1 weight  0.11000E+01 volume  0.22055E-03 ppm1      8.807 ppm2      0.827 CV     1
 ASSI {  792}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      4.500     2.500     1.500 peak   792 spectrum    1 weight  0.11000E+01 volume  0.34865E-03 ppm1      8.811 ppm2      2.162 CV     1
 ASSI {  794}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      3.400     1.400     1.400 peak   794 spectrum    1 weight  0.11000E+01 volume  0.11663E-02 ppm1      8.811 ppm2      7.109 CV     1
 ASSI {  795}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      4.000     2.000     2.000 peak   795 spectrum    1 weight  0.11000E+01 volume  0.48274E-03 ppm1      8.813 ppm2      7.574 CV     1
 ASSI {  797}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      2.300     0.700     0.700 peak   797 spectrum    1 weight  0.11000E+01 volume  0.42264E-02 ppm1      8.103 ppm2      7.548 CV     1
 ASSI {  799}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      4.700     2.700     1.300 peak   799 spectrum    1 weight  0.11000E+01 volume  0.30073E-03 ppm1      8.349 ppm2      0.806 CV     1
 ASSI {  800}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      4.700     2.700     1.300 peak   800 spectrum    1 weight  0.11000E+01 volume  0.51613E-03 ppm1      8.341 ppm2      7.890 CV     1
 ASSI {  803}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 27   and name HD% )
      3.700     1.700     1.700 peak   803 spectrum    1 weight  0.11000E+01 volume  0.79142E-03 ppm1      8.064 ppm2      7.179 CV     1
 ASSI {  804}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HB2 ))
      3.700     1.700     1.700 peak   804 spectrum    1 weight  0.11000E+01 volume  0.58926E-03 ppm1      8.056 ppm2      3.146 CV     1
 ASSI {  805}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      4.200     2.200     1.800 peak   805 spectrum    1 weight  0.11000E+01 volume  0.25813E-03 ppm1      9.393 ppm2      4.013 CV     1
 ASSI {  806}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      5.300     3.500     0.700 peak   806 spectrum    1 weight  0.11000E+01 volume  0.24622E-03 ppm1      9.397 ppm2      0.049 CV     1
 ASSI {  810}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      3.000     1.100     1.100 peak   810 spectrum    1 weight  0.11000E+01 volume  0.96385E-03 ppm1      9.395 ppm2      8.700 CV     1
 ASSI {  816}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HG1 ))
      3.300     1.300     1.300 peak   816 spectrum    1 weight  0.11000E+01 volume  0.11036E-02 ppm1      7.845 ppm2      1.074 CV     1
 ASSI {  817}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HD1 ))
      2.800     1.000     1.000 peak   817 spectrum    1 weight  0.11000E+01 volume  0.40177E-02 ppm1      7.840 ppm2      1.444 CV     1
 ASSI {  821}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      2.600     0.800     0.800 peak   821 spectrum    1 weight  0.11000E+01 volume  0.28781E-02 ppm1      7.773 ppm2      7.513 CV     1
 ASSI {  822}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      2.900     1.000     1.000 peak   822 spectrum    1 weight  0.11000E+01 volume  0.11153E-02 ppm1      7.771 ppm2      8.280 CV     1
 ASSI {  824}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      3.600     1.700     1.700 peak   824 spectrum    1 weight  0.11000E+01 volume  0.93446E-03 ppm1      8.402 ppm2      7.240 CV     1
 ASSI {  831}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
      2.800     1.000     1.000 peak   831 spectrum    1 weight  0.11000E+01 volume  0.64048E-02 ppm1      7.924 ppm2      0.815 CV     1
 ASSI {  832}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      4.500     2.500     1.500 peak   832 spectrum    1 weight  0.11000E+01 volume  0.84008E-03 ppm1      7.919 ppm2      8.369 CV     1
 ASSI {  833}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 93   and name HB% )
      4.500     2.600     1.500 peak   833 spectrum    1 weight  0.11000E+01 volume  0.43191E-03 ppm1      8.589 ppm2      1.139 CV     1
 ASSI {  834}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 88   and name HG2 ))
      3.100     3.100     2.900 peak   834 spectrum    1 weight  0.11000E+01 volume  0.52119E-03 ppm1      8.591 ppm2      1.669 CV     1
 ASSI {  836}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HD1 ))
      4.900     4.900     1.100 peak   836 spectrum    1 weight  0.11000E+01 volume  0.66765E-03 ppm1      8.583 ppm2      7.102 CV     1
 ASSI {  837}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      2.700     0.900     0.900 peak   837 spectrum    1 weight  0.11000E+01 volume  0.24228E-02 ppm1      8.589 ppm2      7.462 CV     1
 ASSI {  838}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HN  ))
      2.900     1.100     1.100 peak   838 spectrum    1 weight  0.11000E+01 volume  0.13260E-02 ppm1      8.589 ppm2      8.110 CV     1
 ASSI {  839}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HG1 ))
      3.400     1.500     1.500 peak   839 spectrum    1 weight  0.11000E+01 volume  0.23207E-02 ppm1      8.489 ppm2      2.318 CV     1
 ASSI {  840}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
      3.600     1.600     1.600 peak   840 spectrum    1 weight  0.11000E+01 volume  0.17679E-02 ppm1      8.489 ppm2      7.690 CV     1
 ASSI {  841}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
      3.400     3.400     2.600 peak   841 spectrum    1 weight  0.11000E+01 volume  0.29222E-03 ppm1      8.495 ppm2      7.887 CV     1
 ASSI {  842}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HN  ))
      2.300     0.700     0.700 peak   842 spectrum    1 weight  0.11000E+01 volume  0.39485E-02 ppm1      7.066 ppm2      7.839 CV     1
 ASSI {  845}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      3.400     1.400     1.400 peak   845 spectrum    1 weight  0.11000E+01 volume  0.92444E-03 ppm1      7.072 ppm2      4.455 CV     1
 ASSI {  846}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      4.000     2.000     2.000 peak   846 spectrum    1 weight  0.11000E+01 volume  0.11628E-02 ppm1      8.123 ppm2      0.673 CV     1
 ASSI {  847}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      3.300     1.300     1.300 peak   847 spectrum    1 weight  0.11000E+01 volume  0.12812E-02 ppm1      8.118 ppm2      3.875 CV     1
 ASSI {  848}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      3.500     1.500     1.500 peak   848 spectrum    1 weight  0.11000E+01 volume  0.80712E-03 ppm1      8.121 ppm2      4.127 CV     1
 ASSI {  849}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 116  and name HB1 ))
      4.800     2.900     1.200 peak   849 spectrum    1 weight  0.11000E+01 volume  0.41196E-03 ppm1      7.690 ppm2      1.731 CV     1
 ASSI {  850}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      2.800     1.000     1.000 peak   850 spectrum    1 weight  0.11000E+01 volume  0.19475E-02 ppm1      8.123 ppm2      7.352 CV     1
 ASSI {  853}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      3.200     1.300     1.300 peak   853 spectrum    1 weight  0.11000E+01 volume  0.12226E-02 ppm1      7.525 ppm2      4.078 CV     1
 ASSI {  857}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HG1 ))
      3.400     1.500     1.500 peak   857 spectrum    1 weight  0.11000E+01 volume  0.27371E-02 ppm1      8.241 ppm2      2.178 CV     1
 ASSI {  858}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HB1 ))
      2.700     0.900     0.900 peak   858 spectrum    1 weight  0.11000E+01 volume  0.52870E-02 ppm1      8.242 ppm2      1.899 CV     1
 ASSI {  859}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      3.000     1.100     1.100 peak   859 spectrum    1 weight  0.11000E+01 volume  0.22029E-02 ppm1      8.243 ppm2      4.262 CV     1
 ASSI {  860}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.300     1.400     1.400 peak   860 spectrum    1 weight  0.11000E+01 volume  0.10201E-02 ppm1      8.195 ppm2      4.477 CV     1
 ASSI {  861}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 31   and name HE% )
      5.900     4.400     0.100 peak   861 spectrum    1 weight  0.11000E+01 volume  0.14410E-03 ppm1      8.197 ppm2      6.932 CV     1
 ASSI {  862}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      2.300     0.700     0.700 peak   862 spectrum    1 weight  0.11000E+01 volume  0.10706E-01 ppm1      8.174 ppm2      4.593 CV     1
 ASSI {  863}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      2.600     2.600     3.400 peak   863 spectrum    1 weight  0.11000E+01 volume  0.13048E-01 ppm1      8.174 ppm2      7.902 CV     1
 ASSI {  865}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      3.000     1.100     1.100 peak   865 spectrum    1 weight  0.11000E+01 volume  0.14355E-02 ppm1      8.627 ppm2      7.202 CV     1
 ASSI {  866}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      4.600     2.600     1.400 peak   866 spectrum    1 weight  0.11000E+01 volume  0.24968E-03 ppm1      8.627 ppm2      8.064 CV     1
 ASSI {  867}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HN  ))
      2.400     0.700     0.700 peak   867 spectrum    1 weight  0.11000E+01 volume  0.41074E-02 ppm1      8.627 ppm2      8.366 CV     1
 ASSI {  868}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 137  and name HA  ))
      2.800     1.000     1.000 peak   868 spectrum    1 weight  0.11000E+01 volume  0.28246E-02 ppm1      8.215 ppm2      4.254 CV     1
 ASSI {  869}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
      3.900     1.900     1.900 peak   869 spectrum    1 weight  0.11000E+01 volume  0.87583E-03 ppm1      8.218 ppm2      7.060 CV     1
 ASSI {  870}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      2.800     1.000     1.000 peak   870 spectrum    1 weight  0.11000E+01 volume  0.13688E-02 ppm1      7.843 ppm2      8.953 CV     1
 ASSI {  873}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HE1 ))
      5.200     3.300     0.800 peak   873 spectrum    1 weight  0.11000E+01 volume  0.28844E-03 ppm1      7.839 ppm2      2.950 CV     1
 ASSI {  875}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
      2.200     0.600     0.600 peak   875 spectrum    1 weight  0.11000E+01 volume  0.55776E-02 ppm1      7.843 ppm2      2.062 CV     1
 ASSI {  877}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      3.900     1.900     1.900 peak   877 spectrum    1 weight  0.11000E+01 volume  0.10988E-02 ppm1      8.720 ppm2      9.166 CV     1
 ASSI {  879}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 125  and name HN  ))
      2.600     0.800     0.800 peak   879 spectrum    1 weight  0.11000E+01 volume  0.36806E-02 ppm1      8.436 ppm2      7.454 CV     1
 ASSI {  880}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      3.800     1.800     1.800 peak   880 spectrum    1 weight  0.11000E+01 volume  0.47485E-03 ppm1      8.057 ppm2      4.042 CV     1
 ASSI {  881}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      4.600     2.600     1.400 peak   881 spectrum    1 weight  0.11000E+01 volume  0.30295E-03 ppm1      8.139 ppm2      8.696 CV     1
 ASSI {  883}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 51   and name HD2 ))
      2.600     0.800     0.800 peak   883 spectrum    1 weight  0.11000E+01 volume  0.15361E-02 ppm1      7.486 ppm2      3.731 CV     1
 ASSI {  885}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
      2.300     2.300     3.700 peak   885 spectrum    1 weight  0.11000E+01 volume  0.35730E-02 ppm1      7.488 ppm2      1.728 CV     1
 ASSI {  886}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      4.900     3.000     1.100 peak   886 spectrum    1 weight  0.11000E+01 volume  0.20611E-03 ppm1      7.488 ppm2      0.513 CV     1
 ASSI {  887}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      1.900     0.500     0.500 peak   887 spectrum    1 weight  0.11000E+01 volume  0.89616E-02 ppm1      7.487 ppm2      7.292 CV     1
 ASSI {  888}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      6.000     6.000     0.000 peak   888 spectrum    1 weight  0.11000E+01 volume  0.10017E-03 ppm1      8.792 ppm2      0.814 CV     1
 ASSI {  889}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      4.100     2.100     1.900 peak   889 spectrum    1 weight  0.11000E+01 volume  0.53049E-03 ppm1      8.798 ppm2      8.310 CV     1
 ASSI {  891}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      3.800     1.900     1.900 peak   891 spectrum    1 weight  0.11000E+01 volume  0.62525E-03 ppm1      8.795 ppm2      7.336 CV     1
 ASSI {  892}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      4.500     2.500     1.500 peak   892 spectrum    1 weight  0.11000E+01 volume  0.30596E-03 ppm1      8.793 ppm2      7.104 CV     1
 ASSI {  893}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 69   and name HA2 ))
      3.200     1.300     1.300 peak   893 spectrum    1 weight  0.11000E+01 volume  0.95648E-03 ppm1      8.793 ppm2      3.845 CV     1
 ASSI {  894}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 99   and name HA2 ))
      4.400     4.400     1.600 peak   894 spectrum    1 weight  0.11000E+01 volume  0.58093E-03 ppm1      8.337 ppm2      4.258 CV     1
 ASSI {  895}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      2.800     1.000     1.000 peak   895 spectrum    1 weight  0.11000E+01 volume  0.25419E-02 ppm1      8.337 ppm2      4.730 CV     1
 ASSI {  896}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      3.200     1.300     1.300 peak   896 spectrum    1 weight  0.11000E+01 volume  0.17632E-02 ppm1      8.335 ppm2      8.902 CV     1
 ASSI {  898}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 72   and name HB% )
      5.300     5.300     0.700 peak   898 spectrum    1 weight  0.11000E+01 volume  0.29667E-03 ppm1      8.335 ppm2      1.747 CV     1
 ASSI {  900}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 53   and name HE% )
      4.700     2.700     1.300 peak   900 spectrum    1 weight  0.11000E+01 volume  0.22485E-03 ppm1      7.482 ppm2      6.686 CV     1
 ASSI {  901}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      2.700     0.900     0.900 peak   901 spectrum    1 weight  0.11000E+01 volume  0.16929E-02 ppm1      7.433 ppm2      8.515 CV     1
 ASSI {  903}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
      4.900     3.000     1.100 peak   903 spectrum    1 weight  0.11000E+01 volume  0.22508E-03 ppm1      9.182 ppm2      3.264 CV     1
 ASSI {  904}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 105  and name HG2 ))
      5.300     3.500     0.700 peak   904 spectrum    1 weight  0.11000E+01 volume  0.24932E-03 ppm1      9.177 ppm2      2.910 CV     1
 ASSI {  905}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      5.600     3.900     0.400 peak   905 spectrum    1 weight  0.11000E+01 volume  0.41685E-03 ppm1      9.185 ppm2      0.831 CV     1
 ASSI {  906}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      3.500     1.500     1.500 peak   906 spectrum    1 weight  0.11000E+01 volume  0.11439E-02 ppm1      9.181 ppm2      8.696 CV     1
 ASSI {  909}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      4.100     2.100     1.900 peak   909 spectrum    1 weight  0.11000E+01 volume  0.10216E-02 ppm1      9.563 ppm2      6.784 CV     1
 ASSI {  910}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.600     0.800     0.800 peak   910 spectrum    1 weight  0.11000E+01 volume  0.23347E-02 ppm1      9.564 ppm2      7.049 CV     1
 ASSI {  911}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      2.400     0.700     0.700 peak   911 spectrum    1 weight  0.11000E+01 volume  0.31144E-02 ppm1      9.563 ppm2      7.266 CV     1
 ASSI {  912}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      4.900     3.100     1.100 peak   912 spectrum    1 weight  0.11000E+01 volume  0.17989E-03 ppm1      9.562 ppm2      9.081 CV     1
 ASSI {  913}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      4.900     3.000     1.100 peak   913 spectrum    1 weight  0.11000E+01 volume  0.51719E-03 ppm1      9.562 ppm2      2.206 CV     1
 ASSI {  914}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HB2 ))
      3.500     1.600     1.600 peak   914 spectrum    1 weight  0.11000E+01 volume  0.16458E-02 ppm1      8.320 ppm2      1.422 CV     1
 ASSI {  915}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 109  and name HB% )
      3.900     1.900     1.900 peak   915 spectrum    1 weight  0.11000E+01 volume  0.18781E-02 ppm1      8.321 ppm2      1.136 CV     1
 ASSI {  916}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      3.400     1.500     1.500 peak   916 spectrum    1 weight  0.11000E+01 volume  0.88214E-03 ppm1      8.321 ppm2      3.746 CV     1
 ASSI {  917}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 113  and name HN  ))
      5.200     3.400     0.800 peak   917 spectrum    1 weight  0.11000E+01 volume  0.11216E-03 ppm1      8.323 ppm2      7.767 CV     1
 ASSI {  918}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      2.800     1.000     1.000 peak   918 spectrum    1 weight  0.11000E+01 volume  0.13943E-02 ppm1      8.322 ppm2      7.206 CV     1
 ASSI {  919}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      6.000     6.000     0.000 peak   919 spectrum    1 weight  0.11000E+01 volume  0.12495E-04 ppm1      8.321 ppm2      6.718 CV     1
 ASSI {  920}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      5.100     3.300     0.900 peak   920 spectrum    1 weight  0.11000E+01 volume  0.34224E-03 ppm1      8.092 ppm2      3.067 CV     1
 ASSI {  922}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
      4.500     2.500     1.500 peak   922 spectrum    1 weight  0.11000E+01 volume  0.33498E-03 ppm1      7.972 ppm2      9.391 CV     1
 ASSI {  923}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      2.600     0.800     0.800 peak   923 spectrum    1 weight  0.11000E+01 volume  0.23299E-02 ppm1      7.974 ppm2      8.717 CV     1
 ASSI {  924}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
      2.700     0.900     0.900 peak   924 spectrum    1 weight  0.11000E+01 volume  0.25001E-02 ppm1      7.975 ppm2      8.555 CV     1
 ASSI {  927}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      6.000     5.800     0.000 peak   927 spectrum    1 weight  0.11000E+01 volume  0.68273E-04 ppm1      7.971 ppm2      9.159 CV     1
 ASSI {  928}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      6.000     4.800     0.000 peak   928 spectrum    1 weight  0.11000E+01 volume  0.45862E-04 ppm1      7.969 ppm2      5.576 CV     1
 ASSI {  930}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      2.300     0.700     0.700 peak   930 spectrum    1 weight  0.11000E+01 volume  0.37932E-02 ppm1      8.958 ppm2      2.057 CV     1
 ASSI {  931}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      3.700     1.700     1.700 peak   931 spectrum    1 weight  0.11000E+01 volume  0.19679E-02 ppm1      8.956 ppm2      0.678 CV     1
 ASSI {  933}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 123  and name HD1 ))
      6.000     4.500     0.000 peak   933 spectrum    1 weight  0.11000E+01 volume  0.14650E-03 ppm1      8.666 ppm2      3.306 CV     1
 ASSI {  935}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 123  and name HD2 ))
      6.000     4.600     0.000 peak   935 spectrum    1 weight  0.11000E+01 volume  0.18840E-03 ppm1      8.666 ppm2      3.686 CV     1
 ASSI {  936}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HG11))
      5.700     4.000     0.300 peak   936 spectrum    1 weight  0.11000E+01 volume  0.23286E-03 ppm1      8.366 ppm2      1.071 CV     1
 ASSI {  937}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      5.800     4.200     0.200 peak   937 spectrum    1 weight  0.11000E+01 volume  0.62704E-04 ppm1      8.962 ppm2      7.513 CV     1
 ASSI {  938}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 118  and name HN  ))
      2.400     0.700     0.700 peak   938 spectrum    1 weight  0.11000E+01 volume  0.35418E-02 ppm1      8.958 ppm2      7.816 CV     1
 ASSI {  940}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HN  ))
      4.500     2.500     1.500 peak   940 spectrum    1 weight  0.11000E+01 volume  0.64794E-03 ppm1      8.863 ppm2      7.461 CV     1
 ASSI {  942}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 124  and name HN  ))
      4.000     2.000     2.000 peak   942 spectrum    1 weight  0.11000E+01 volume  0.86730E-03 ppm1      8.668 ppm2      8.402 CV     1
 ASSI {  945}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      2.600     0.800     0.800 peak   945 spectrum    1 weight  0.11000E+01 volume  0.18773E-02 ppm1      6.904 ppm2      8.096 CV     1
 ASSI {  946}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 82   and name HD1 ))
      6.000     6.000     0.000 peak   946 spectrum    1 weight  0.11000E+01 volume  0.10318E-03 ppm1      6.910 ppm2      3.338 CV     1
 ASSI {  947}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      3.900     3.900     2.100 peak   947 spectrum    1 weight  0.11000E+01 volume  0.17334E-02 ppm1      6.904 ppm2      0.760 CV     1
 ASSI {  951}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      3.200     1.200     1.200 peak   951 spectrum    1 weight  0.11000E+01 volume  0.15152E-02 ppm1      7.047 ppm2      6.740 CV     1
 ASSI {  952}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      2.100     0.600     0.600 peak   952 spectrum    1 weight  0.11000E+01 volume  0.85376E-02 ppm1      7.056 ppm2      7.266 CV     1
 ASSI {  954}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      2.400     0.700     0.700 peak   954 spectrum    1 weight  0.11000E+01 volume  0.51574E-02 ppm1      7.350 ppm2      2.010 CV     1
 ASSI {  955}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      5.400     3.700     0.600 peak   955 spectrum    1 weight  0.11000E+01 volume  0.24796E-03 ppm1      7.350 ppm2      2.893 CV     1
 ASSI {  956}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      3.400     1.500     1.500 peak   956 spectrum    1 weight  0.11000E+01 volume  0.80881E-03 ppm1      7.350 ppm2      3.685 CV     1
 ASSI {  957}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HB1 ))
      4.600     2.700     1.400 peak   957 spectrum    1 weight  0.11000E+01 volume  0.36642E-03 ppm1      7.192 ppm2      1.453 CV     1
 ASSI {  959}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 128  and name HA  ))
      5.200     3.400     0.800 peak   959 spectrum    1 weight  0.11000E+01 volume  0.83733E-04 ppm1      7.193 ppm2      4.188 CV     1
 ASSI {  960}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      6.000     6.000     0.000 peak   960 spectrum    1 weight  0.11000E+01 volume  0.12722E-04 ppm1      7.196 ppm2      4.623 CV     1
 ASSI {  962}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      2.300     0.700     0.700 peak   962 spectrum    1 weight  0.11000E+01 volume  0.48872E-02 ppm1      7.350 ppm2      8.091 CV     1
 ASSI {  964}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HN  ))
      3.000     1.100     1.100 peak   964 spectrum    1 weight  0.11000E+01 volume  0.11397E-02 ppm1      7.194 ppm2      7.697 CV     1
 ASSI {  967}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
      5.000     3.100     1.000 peak   967 spectrum    1 weight  0.11000E+01 volume  0.29323E-03 ppm1      8.832 ppm2      2.204 CV     1
 ASSI {  968}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      4.900     3.000     1.100 peak   968 spectrum    1 weight  0.11000E+01 volume  0.10116E-03 ppm1      8.832 ppm2      5.204 CV     1
 ASSI {  975}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 108  and name HN  ))
      3.100     1.200     1.200 peak   975 spectrum    1 weight  0.11000E+01 volume  0.90637E-03 ppm1      8.082 ppm2      8.388 CV     1
 ASSI {  977}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
      3.000     1.100     1.100 peak   977 spectrum    1 weight  0.11000E+01 volume  0.12361E-02 ppm1      8.079 ppm2      9.389 CV     1
 ASSI {  979}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      4.100     2.100     1.900 peak   979 spectrum    1 weight  0.11000E+01 volume  0.51531E-03 ppm1      8.082 ppm2      7.258 CV     1
 ASSI {  980}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
      6.000     6.000     0.000 peak   980 spectrum    1 weight  0.11000E+01 volume  0.22025E-04 ppm1      9.079 ppm2      0.467 CV     1
 ASSI {  981}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HG11))
      5.000     3.100     1.000 peak   981 spectrum    1 weight  0.11000E+01 volume  0.28934E-03 ppm1      9.075 ppm2      1.336 CV     1
 ASSI {  982}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HG12))
      6.000     6.000     0.000 peak   982 spectrum    1 weight  0.11000E+01 volume  0.99511E-04 ppm1      9.077 ppm2      1.913 CV     1
 ASSI {  983}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HB1 ))
      2.500     0.800     0.800 peak   983 spectrum    1 weight  0.11000E+01 volume  0.15477E-02 ppm1      9.076 ppm2      3.299 CV     1
 ASSI {  985}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      2.400     0.700     0.700 peak   985 spectrum    1 weight  0.11000E+01 volume  0.25492E-02 ppm1      9.079 ppm2      7.246 CV     1
 ASSI {  989}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 106  and name HE% )
      5.800     4.200     0.200 peak   989 spectrum    1 weight  0.11000E+01 volume  0.56277E-04 ppm1      9.080 ppm2      5.815 CV     1
 ASSI {  990}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
      4.600     2.700     1.400 peak   990 spectrum    1 weight  0.11000E+01 volume  0.48192E-04 ppm1      8.495 ppm2      2.632 CV     1
 ASSI {  991}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      6.000     4.600     0.000 peak   991 spectrum    1 weight  0.11000E+01 volume  0.59582E-04 ppm1      8.493 ppm2      3.531 CV     1
 ASSI {  992}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      3.800     1.800     1.800 peak   992 spectrum    1 weight  0.11000E+01 volume  0.15773E-02 ppm1      8.493 ppm2      7.938 CV     1
 ASSI {  993}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
      5.000     3.100     1.000 peak   993 spectrum    1 weight  0.11000E+01 volume  0.21708E-03 ppm1      8.492 ppm2      8.834 CV     1
 ASSI {  999}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 137  and name HG2 ))
      2.900     2.900     3.100 peak   999 spectrum    1 weight  0.11000E+01 volume  0.81498E-03 ppm1      8.167 ppm2      1.526 CV     1
 ASSI { 1004}
   (( segid "    " and resid 90   and name HE1 ))
   (( segid "    " and resid 90   and name HB2 ))
      5.700     4.100     0.300 peak  1004 spectrum    1 weight  0.11000E+01 volume  0.17908E-03 ppm1     10.363 ppm2      3.383 CV     1
 ASSI { 1005}
   (( segid "    " and resid 90   and name HE1 ))
   (( segid "    " and resid 90   and name HD1 ))
      2.500     0.800     0.800 peak  1005 spectrum    1 weight  0.11000E+01 volume  0.62583E-02 ppm1     10.359 ppm2      7.175 CV     1
 ASSI { 1006}
   (( segid "    " and resid 90   and name HE1 ))
   (( segid "    " and resid 98   and name HN  ))
      6.000     5.700     0.000 peak  1006 spectrum    1 weight  0.11000E+01 volume  0.45568E-04 ppm1     10.355 ppm2      8.353 CV     1
 ASSI { 1007}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      4.400     2.500     1.600 peak  1007 spectrum    1 weight  0.11000E+01 volume  0.90179E-03 ppm1      8.318 ppm2      8.114 CV     1
 ASSI { 1010}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      6.000     4.600     0.000 peak  1010 spectrum    1 weight  0.11000E+01 volume  0.44979E-04 ppm1      6.910 ppm2      7.363 CV     1
 ASSI { 1011}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      6.000     4.500     0.000 peak  1011 spectrum    1 weight  0.11000E+01 volume  0.35404E-04 ppm1      8.961 ppm2      3.299 CV     1
 ASSI { 1012}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HE2 ))
      4.200     2.200     1.800 peak  1012 spectrum    1 weight  0.11000E+01 volume  0.83531E-04 ppm1      8.961 ppm2      2.947 CV     1
 ASSI { 1013}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      6.000     6.000     0.000 peak  1013 spectrum    1 weight  0.11000E+01 volume  0.73163E-04 ppm1      9.178 ppm2      4.008 CV     1
 ASSI { 1014}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 65   and name HA1 ))
      6.000     5.900     0.000 peak  1014 spectrum    1 weight  0.11000E+01 volume  0.92675E-04 ppm1      8.731 ppm2      3.753 CV     1
 ASSI { 1015}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HD1 ))
      6.000     6.000     0.000 peak  1015 spectrum    1 weight  0.11000E+01 volume  0.20486E-04 ppm1      8.731 ppm2      3.088 CV     1
 ASSI { 1016}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 69   and name HA1 ))
      6.000     6.000     0.000 peak  1016 spectrum    1 weight  0.11000E+01 volume  0.12314E-04 ppm1      8.795 ppm2      3.559 CV     1
 ASSI { 1021}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      3.100     1.200     1.200 peak  1021 spectrum    1 weight  0.11000E+01 volume  0.14390E-02 ppm1      8.336 ppm2      7.565 CV     1
 ASSI { 1023}
   (( segid "    " and resid 90   and name HE1 ))
   (( segid "    " and resid 101  and name HG  ))
      5.600     4.000     0.400 peak  1023 spectrum    1 weight  0.11000E+01 volume  0.12276E-03 ppm1     10.362 ppm2      1.587 CV     1
 ASSI { 1026}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      6.000     5.700     0.000 peak  1026 spectrum    1 weight  0.11000E+01 volume  0.92926E-04 ppm1      8.085 ppm2      6.791 CV     1
 ASSI { 1027}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HD21))
      6.000     6.000     0.000 peak  1027 spectrum    1 weight  0.11000E+01 volume  0.17294E-04 ppm1      8.324 ppm2      5.754 CV     1
 ASSI { 1028}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      6.000     6.000     0.000 peak  1028 spectrum    1 weight  0.11000E+01 volume  0.13446E-04 ppm1      8.326 ppm2      7.527 CV     1
 ASSI { 1030}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      6.000     5.600     0.000 peak  1030 spectrum    1 weight  0.11000E+01 volume  0.47831E-04 ppm1      7.487 ppm2      9.590 CV     1
 ASSI { 1031}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HD22))
      6.000     6.000     0.000 peak  1031 spectrum    1 weight  0.11000E+01 volume  0.23565E-04 ppm1      8.336 ppm2      7.049 CV     1
 ASSI { 1032}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 90   and name HH2 ))
      6.000     6.000     0.000 peak  1032 spectrum    1 weight  0.11000E+01 volume  0.57496E-04 ppm1      8.335 ppm2      6.806 CV     1
 ASSI { 1033}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 90   and name HZ3 ))
      5.700     4.100     0.300 peak  1033 spectrum    1 weight  0.11000E+01 volume  0.18666E-03 ppm1      8.798 ppm2      6.743 CV     1
 ASSI { 1037}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      4.300     2.300     1.700 peak  1037 spectrum    1 weight  0.11000E+01 volume  0.22630E-03 ppm1      8.138 ppm2      0.051 CV     1
 ASSI { 1040}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      4.800     2.900     1.200 peak  1040 spectrum    1 weight  0.11000E+01 volume  0.16203E-03 ppm1      7.841 ppm2      7.499 CV     1
 ASSI { 1042}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      5.600     5.600     0.400 peak  1042 spectrum    1 weight  0.11000E+01 volume  0.15597E-04 ppm1      8.627 ppm2      3.237 CV     1
 ASSI { 1043}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 106  and name HB1 ))
      6.000     6.000     0.000 peak  1043 spectrum    1 weight  0.11000E+01 volume  0.88281E-06 ppm1      8.627 ppm2      3.008 CV     1
 ASSI { 1046}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      5.700     4.000     0.300 peak  1046 spectrum    1 weight  0.11000E+01 volume  0.22109E-03 ppm1      7.840 ppm2      4.080 CV     1
 ASSI { 1047}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      5.400     3.700     0.600 peak  1047 spectrum    1 weight  0.11000E+01 volume  0.15690E-03 ppm1      7.681 ppm2      8.954 CV     1
 ASSI { 1049}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      3.600     1.700     1.700 peak  1049 spectrum    1 weight  0.11000E+01 volume  0.99719E-03 ppm1      7.525 ppm2      8.283 CV     1
 ASSI { 1053}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HE1 ))
      5.500     3.800     0.500 peak  1053 spectrum    1 weight  0.11000E+01 volume  0.20839E-03 ppm1      7.523 ppm2      2.972 CV     1
 ASSI { 1054}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      3.700     1.700     1.700 peak  1054 spectrum    1 weight  0.11000E+01 volume  0.19379E-03 ppm1      8.244 ppm2      1.327 CV     1
 ASSI { 1056}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      6.000     6.000     0.000 peak  1056 spectrum    1 weight  0.11000E+01 volume  0.11205E-04 ppm1      8.631 ppm2      0.502 CV     1
 ASSI { 1057}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      6.000     6.000     0.000 peak  1057 spectrum    1 weight  0.11000E+01 volume  0.10209E-04 ppm1      8.626 ppm2      0.058 CV     1
 ASSI { 1063}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 45   and name HG1%)
      5.300     3.500     0.700 peak  1063 spectrum    1 weight  0.11000E+01 volume  0.13709E-03 ppm1      7.580 ppm2      0.818 CV     1
 ASSI { 1064}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      6.000     5.000     0.000 peak  1064 spectrum    1 weight  0.11000E+01 volume  0.62679E-04 ppm1      7.580 ppm2      0.514 CV     1
 ASSI { 1065}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 46   and name HG1%)
      6.000     5.100     0.000 peak  1065 spectrum    1 weight  0.11000E+01 volume  0.41470E-04 ppm1      7.579 ppm2     -0.188 CV     1
 ASSI { 1066}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HB  ))
      5.500     3.800     0.500 peak  1066 spectrum    1 weight  0.11000E+01 volume  0.12982E-03 ppm1      7.583 ppm2     -1.223 CV     1
 ASSI { 1067}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 46   and name HG1%)
      4.800     2.900     1.200 peak  1067 spectrum    1 weight  0.11000E+01 volume  0.21967E-03 ppm1      8.400 ppm2     -0.194 CV     1
 ASSI { 1070}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 90   and name HH2 ))
      5.000     3.100     1.000 peak  1070 spectrum    1 weight  0.11000E+01 volume  0.14329E-03 ppm1      8.697 ppm2      6.830 CV     1
 ASSI { 1071}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 136  and name HD1 ))
      5.200     3.400     0.800 peak  1071 spectrum    1 weight  0.11000E+01 volume  0.37137E-03 ppm1      7.844 ppm2      3.175 CV     1
 ASSI { 1074}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 132  and name HA  ))
      5.400     3.700     0.600 peak  1074 spectrum    1 weight  0.11000E+01 volume  0.11158E-03 ppm1      7.842 ppm2      2.682 CV     1
 ASSI { 1076}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      4.100     2.100     1.900 peak  1076 spectrum    1 weight  0.11000E+01 volume  0.10168E-03 ppm1      8.395 ppm2      3.211 CV     1
 ASSI { 1077}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 106  and name HB1 ))
      5.200     3.300     0.800 peak  1077 spectrum    1 weight  0.11000E+01 volume  0.18933E-03 ppm1      8.403 ppm2      3.021 CV     1
 ASSI { 1078}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
      4.800     2.900     1.200 peak  1078 spectrum    1 weight  0.11000E+01 volume  0.31768E-03 ppm1      8.697 ppm2      0.421 CV     1
 ASSI { 1079}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
      4.900     3.000     1.100 peak  1079 spectrum    1 weight  0.11000E+01 volume  0.13062E-03 ppm1      8.400 ppm2      9.370 CV     1
 ASSI { 1080}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      3.600     1.600     1.600 peak  1080 spectrum    1 weight  0.11000E+01 volume  0.11829E-02 ppm1      8.482 ppm2      7.382 CV     1
 ASSI { 1084}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      4.800     2.900     1.200 peak  1084 spectrum    1 weight  0.11000E+01 volume  0.15706E-03 ppm1      8.093 ppm2      7.365 CV     1
 ASSI { 1086}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      1.800     0.400     0.400 peak  1086 spectrum    1 weight  0.11000E+01 volume  0.16790E-01 ppm1      7.579 ppm2      7.294 CV     1
 ASSI { 1088}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      4.700     2.700     1.300 peak  1088 spectrum    1 weight  0.11000E+01 volume  0.35784E-03 ppm1      9.389 ppm2      9.139 CV     1
 ASSI { 1090}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      5.600     4.000     0.400 peak  1090 spectrum    1 weight  0.11000E+01 volume  0.17643E-03 ppm1      8.106 ppm2      0.071 CV     1
 ASSI { 1092}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
      5.200     5.200     0.800 peak  1092 spectrum    1 weight  0.11000E+01 volume  0.22562E-03 ppm1      7.562 ppm2      0.476 CV     1
 ASSI { 1094}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      4.300     2.300     1.700 peak  1094 spectrum    1 weight  0.11000E+01 volume  0.30150E-03 ppm1      9.206 ppm2      7.455 CV     1
 ASSI { 1095}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 57   and name HZ  ))
      6.000     6.000     0.000 peak  1095 spectrum    1 weight  0.11000E+01 volume  0.73341E-05 ppm1      9.208 ppm2      6.810 CV     1
 ASSI { 1102}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      5.700     4.100     0.300 peak  1102 spectrum    1 weight  0.11000E+01 volume  0.15630E-03 ppm1      8.700 ppm2      4.513 CV     1
 ASSI { 1103}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.900     1.900     1.900 peak  1103 spectrum    1 weight  0.11000E+01 volume  0.37568E-03 ppm1      8.488 ppm2      4.401 CV     1
 ASSI { 1104}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      4.000     2.000     2.000 peak  1104 spectrum    1 weight  0.11000E+01 volume  0.30261E-03 ppm1      8.400 ppm2      3.736 CV     1
 ASSI { 1106}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      2.700     0.900     0.900 peak  1106 spectrum    1 weight  0.11000E+01 volume  0.22784E-02 ppm1      8.103 ppm2      4.069 CV     1
 ASSI { 1108}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      6.000     4.900     0.000 peak  1108 spectrum    1 weight  0.11000E+01 volume  0.13684E-03 ppm1      8.100 ppm2      2.238 CV     1
 ASSI { 1109}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HD2 ))
      4.600     2.700     1.400 peak  1109 spectrum    1 weight  0.11000E+01 volume  0.17897E-03 ppm1      8.051 ppm2      3.828 CV     1
 ASSI { 1110}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      4.300     2.300     1.700 peak  1110 spectrum    1 weight  0.11000E+01 volume  0.28377E-03 ppm1      8.062 ppm2      4.167 CV     1
 ASSI { 1117}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      6.000     6.000     0.000 peak  1117 spectrum    1 weight  0.11000E+01 volume  0.15529E-04 ppm1      8.719 ppm2      1.538 CV     1
 ASSI { 1119}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      5.500     3.800     0.500 peak  1119 spectrum    1 weight  0.11000E+01 volume  0.19148E-03 ppm1      8.721 ppm2      3.223 CV     1
 ASSI { 1123}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
      3.600     1.600     1.600 peak  1123 spectrum    1 weight  0.11000E+01 volume  0.53593E-03 ppm1      8.829 ppm2      2.841 CV     1
 ASSI { 1124}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      6.000     4.600     0.000 peak  1124 spectrum    1 weight  0.11000E+01 volume  0.94848E-05 ppm1      6.904 ppm2      4.506 CV     1
 ASSI { 1127}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      3.500     1.500     1.500 peak  1127 spectrum    1 weight  0.11000E+01 volume  0.13696E-02 ppm1      7.212 ppm2      4.030 CV     1
 ASSI { 1128}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      6.000     6.000     0.000 peak  1128 spectrum    1 weight  0.11000E+01 volume  0.13537E-04 ppm1      7.911 ppm2      1.978 CV     1
 ASSI { 1129}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 101  and name HG  ))
      4.300     2.300     1.700 peak  1129 spectrum    1 weight  0.11000E+01 volume  0.68263E-03 ppm1     10.645 ppm2      1.583 CV     1
 ASSI { 1134}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      4.800     2.800     1.200 peak  1134 spectrum    1 weight  0.11000E+01 volume  0.11273E-03 ppm1      7.803 ppm2      4.532 CV     1
 ASSI { 1138}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 120  and name HD2 ))
      5.400     3.600     0.600 peak  1138 spectrum    1 weight  0.11000E+01 volume  0.11746E-03 ppm1      7.798 ppm2      7.135 CV     1
 ASSI { 1139}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HD1 ))
      3.400     1.500     1.500 peak  1139 spectrum    1 weight  0.11000E+01 volume  0.36952E-02 ppm1      8.811 ppm2      1.276 CV     1
 ASSI { 1140}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 90   and name HZ3 ))
      4.600     2.600     1.400 peak  1140 spectrum    1 weight  0.11000E+01 volume  0.19397E-03 ppm1      8.815 ppm2      6.743 CV     1
 ASSI { 1144}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      3.200     1.300     1.300 peak  1144 spectrum    1 weight  0.11000E+01 volume  0.15268E-02 ppm1      7.581 ppm2      3.816 CV     1
 ASSI { 1145}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 66   and name HD2 ))
      3.500     3.500     2.500 peak  1145 spectrum    1 weight  0.11000E+01 volume  0.38406E-02 ppm1      8.701 ppm2      1.738 CV     1
 ASSI { 1146}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      5.300     3.500     0.700 peak  1146 spectrum    1 weight  0.11000E+01 volume  0.32565E-03 ppm1      8.482 ppm2      1.714 CV     1
 ASSI { 1147}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HD2 ))
      5.900     4.300     0.100 peak  1147 spectrum    1 weight  0.11000E+01 volume  0.19884E-03 ppm1      8.485 ppm2      1.252 CV     1
 ASSI { 1148}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 133  and name HA  ))
      4.300     2.300     1.700 peak  1148 spectrum    1 weight  0.11000E+01 volume  0.30224E-03 ppm1      7.845 ppm2      3.561 CV     1
 ASSI { 1149}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      4.600     2.600     1.400 peak  1149 spectrum    1 weight  0.11000E+01 volume  0.26575E-03 ppm1      7.771 ppm2      7.207 CV     1
 ASSI { 1153}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 31   and name HD% )
      3.900     1.900     1.900 peak  1153 spectrum    1 weight  0.11000E+01 volume  0.36094E-03 ppm1      8.194 ppm2      7.151 CV     1
 ASSI { 1154}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
      5.000     3.200     1.000 peak  1154 spectrum    1 weight  0.11000E+01 volume  0.11710E-03 ppm1      8.622 ppm2      9.375 CV     1
 ASSI { 1156}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      4.600     2.700     1.400 peak  1156 spectrum    1 weight  0.11000E+01 volume  0.28640E-03 ppm1      8.628 ppm2      2.041 CV     1
 ASSI { 1159}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 38   and name HA2 ))
      3.000     3.000     3.000 peak  1159 spectrum    1 weight  0.11000E+01 volume  0.65296E-03 ppm1      8.177 ppm2      3.884 CV     1
 ASSI { 1160}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 90   and name HZ3 ))
      6.000     5.200     0.000 peak  1160 spectrum    1 weight  0.11000E+01 volume  0.68837E-04 ppm1      8.178 ppm2      6.788 CV     1
 ASSI { 1162}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 108  and name HN  ))
      4.200     2.200     1.800 peak  1162 spectrum    1 weight  0.11000E+01 volume  0.41411E-03 ppm1      8.726 ppm2      8.425 CV     1
 ASSI { 1165}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      5.900     4.400     0.100 peak  1165 spectrum    1 weight  0.11000E+01 volume  0.50071E-04 ppm1      8.726 ppm2      8.224 CV     1
 ASSI { 1166}
   (( segid "    " and resid 90   and name HE1 ))
   (  segid "    " and resid 101  and name HD2%)
      6.000     6.000     0.000 peak  1166 spectrum    1 weight  0.11000E+01 volume  0.62501E-04 ppm1     10.364 ppm2      0.034 CV     1
 ASSI { 1167}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 51   and name HD1 ))
      6.000     6.000     0.000 peak  1167 spectrum    1 weight  0.11000E+01 volume  0.69314E-04 ppm1      7.282 ppm2      3.356 CV     1
 ASSI { 1169}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      2.700     2.700     3.300 peak  1169 spectrum    1 weight  0.11000E+01 volume  0.11772E-02 ppm1      7.290 ppm2      3.807 CV     1
 ASSI { 1170}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.500     1.500     1.500 peak  1170 spectrum    1 weight  0.11000E+01 volume  0.61017E-03 ppm1      7.294 ppm2      3.040 CV     1
 ASSI { 1173}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      5.600     4.000     0.400 peak  1173 spectrum    1 weight  0.11000E+01 volume  0.84070E-04 ppm1      7.489 ppm2      7.027 CV     1
 ASSI { 1174}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HG2 ))
      3.500     1.500     1.500 peak  1174 spectrum    1 weight  0.11000E+01 volume  0.37542E-02 ppm1      7.486 ppm2      1.841 CV     1
 ASSI { 1175}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HD2 ))
      2.500     0.800     0.800 peak  1175 spectrum    1 weight  0.11000E+01 volume  0.26690E-02 ppm1      7.265 ppm2      3.711 CV     1
 ASSI { 1176}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.900     1.900     1.900 peak  1176 spectrum    1 weight  0.11000E+01 volume  0.41769E-03 ppm1      7.266 ppm2      4.740 CV     1
 ASSI { 1177}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      4.900     3.000     1.100 peak  1177 spectrum    1 weight  0.11000E+01 volume  0.17072E-03 ppm1      7.268 ppm2      7.500 CV     1
 ASSI { 1178}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      3.000     1.100     1.100 peak  1178 spectrum    1 weight  0.11000E+01 volume  0.12126E-02 ppm1      7.053 ppm2      4.699 CV     1
 ASSI { 1179}
   (( segid "    " and resid 90   and name HE1 ))
   (( segid "    " and resid 100  and name HN  ))
      6.000     4.500     0.000 peak  1179 spectrum    1 weight  0.11000E+01 volume  0.13847E-03 ppm1     10.361 ppm2      8.116 CV     1
 ASSI { 1180}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 96   and name HB2 ))
      6.000     4.800     0.000 peak  1180 spectrum    1 weight  0.11000E+01 volume  0.10757E-03 ppm1      8.321 ppm2      3.138 CV     1
 ASSI { 1182}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
      4.200     2.200     1.800 peak  1182 spectrum    1 weight  0.11000E+01 volume  0.60603E-03 ppm1      8.126 ppm2      1.124 CV     1
 ASSI { 1184}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.200     0.600     0.600 peak  1184 spectrum    1 weight  0.11000E+01 volume  0.37346E-02 ppm1      8.922 ppm2      4.512 CV     1
 ASSI { 1186}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      3.800     1.800     1.800 peak  1186 spectrum    1 weight  0.11000E+01 volume  0.73226E-03 ppm1      8.260 ppm2      4.693 CV     1
 ASSI { 1187}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HG2 ))
      4.100     2.100     1.900 peak  1187 spectrum    1 weight  0.11000E+01 volume  0.53434E-03 ppm1      8.546 ppm2      2.182 CV     1
 ASSI { 1188}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB2 ))
      3.800     1.800     1.800 peak  1188 spectrum    1 weight  0.11000E+01 volume  0.83757E-03 ppm1      8.548 ppm2      1.919 CV     1
 ASSI { 1189}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.200     1.300     1.300 peak  1189 spectrum    1 weight  0.11000E+01 volume  0.27672E-02 ppm1      8.062 ppm2      7.832 CV     1
 ASSI { 1191}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      3.400     1.400     1.400 peak  1191 spectrum    1 weight  0.11000E+01 volume  0.12880E-02 ppm1      7.884 ppm2      7.297 CV     1
 ASSI { 1192}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      2.700     0.900     0.900 peak  1192 spectrum    1 weight  0.11000E+01 volume  0.17367E-02 ppm1      7.882 ppm2      8.082 CV     1
 ASSI { 1193}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      4.200     2.300     1.800 peak  1193 spectrum    1 weight  0.11000E+01 volume  0.12398E-02 ppm1      7.564 ppm2      1.061 CV     1
 ASSI { 1194}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
      2.600     0.800     0.800 peak  1194 spectrum    1 weight  0.11000E+01 volume  0.38890E-02 ppm1      7.565 ppm2      3.813 CV     1
 ASSI { 1195}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.200     0.600     0.600 peak  1195 spectrum    1 weight  0.11000E+01 volume  0.90873E-02 ppm1      7.829 ppm2      3.929 CV     1
 ASSI { 1196}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 78   and name HB2 ))
      3.100     3.100     2.900 peak  1196 spectrum    1 weight  0.11000E+01 volume  0.23976E-02 ppm1      7.829 ppm2      2.038 CV     1
 ASSI { 1197}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HB1 ))
      4.100     4.100     1.900 peak  1197 spectrum    1 weight  0.11000E+01 volume  0.17443E-02 ppm1      7.831 ppm2      1.014 CV     1
 ASSI { 1200}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 90   and name HE1 ))
      5.400     3.700     0.600 peak  1200 spectrum    1 weight  0.11000E+01 volume  0.17023E-03 ppm1      7.412 ppm2     10.350 CV     1
 ASSI { 1202}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      5.500     3.800     0.500 peak  1202 spectrum    1 weight  0.11000E+01 volume  0.17747E-04 ppm1      7.415 ppm2      8.635 CV     1
 ASSI { 1204}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      4.500     2.600     1.500 peak  1204 spectrum    1 weight  0.11000E+01 volume  0.54985E-04 ppm1     10.644 ppm2      1.983 CV     1
 ASSI { 1206}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
      3.000     1.100     1.100 peak  1206 spectrum    1 weight  0.11000E+01 volume  0.29147E-02 ppm1      7.463 ppm2      2.519 CV     1
 ASSI { 1209}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      6.000     6.000     0.000 peak  1209 spectrum    1 weight  0.11000E+01 volume  0.17476E-04 ppm1      7.212 ppm2      7.512 CV     1
 ASSI { 1210}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HB2 ))
      2.300     0.700     0.700 peak  1210 spectrum    1 weight  0.11000E+01 volume  0.30695E-02 ppm1      7.208 ppm2      1.411 CV     1
 ASSI { 1211}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      2.700     2.700     3.300 peak  1211 spectrum    1 weight  0.11000E+01 volume  0.12293E-02 ppm1      7.530 ppm2      1.086 CV     1
 ASSI { 1213}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 71   and name HN  ))
      5.800     4.200     0.200 peak  1213 spectrum    1 weight  0.11000E+01 volume  0.11660E-03 ppm1      7.069 ppm2      7.521 CV     1
 ASSI { 1215}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      3.400     1.500     1.500 peak  1215 spectrum    1 weight  0.11000E+01 volume  0.22874E-02 ppm1      7.275 ppm2      3.952 CV     1
 ASSI { 1216}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
      4.600     2.600     1.400 peak  1216 spectrum    1 weight  0.11000E+01 volume  0.42027E-03 ppm1      8.529 ppm2      1.965 CV     1
 ASSI { 1217}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      5.100     5.100     0.900 peak  1217 spectrum    1 weight  0.11000E+01 volume  0.35682E-03 ppm1      7.484 ppm2     -0.037 CV     1
 ASSI { 1218}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      4.400     4.400     1.600 peak  1218 spectrum    1 weight  0.11000E+01 volume  0.88835E-03 ppm1      7.489 ppm2      0.891 CV     1
 ASSI { 1220}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
      6.000     6.000     0.000 peak  1220 spectrum    1 weight  0.11000E+01 volume  0.20645E-04 ppm1      7.485 ppm2      2.564 CV     1
 ASSI { 1221}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      6.000     6.000     0.000 peak  1221 spectrum    1 weight  0.11000E+01 volume  0.25308E-04 ppm1      7.489 ppm2      5.594 CV     1
 ASSI { 1224}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      4.800     2.900     1.200 peak  1224 spectrum    1 weight  0.11000E+01 volume  0.80631E-04 ppm1      7.227 ppm2      4.721 CV     1
 ASSI { 1226}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      6.000     6.000     0.000 peak  1226 spectrum    1 weight  0.11000E+01 volume  0.16660E-04 ppm1      7.221 ppm2      7.864 CV     1
 ASSI { 1227}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HB1 ))
      4.400     2.500     1.600 peak  1227 spectrum    1 weight  0.11000E+01 volume  0.50384E-03 ppm1      7.224 ppm2      3.256 CV     1
 ASSI { 1228}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      6.000     5.800     0.000 peak  1228 spectrum    1 weight  0.11000E+01 volume  0.14465E-04 ppm1      8.101 ppm2      4.073 CV     1
 ASSI { 1229}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      6.000     6.000     0.000 peak  1229 spectrum    1 weight  0.11000E+01 volume  0.16163E-04 ppm1      8.095 ppm2      3.276 CV     1
 ASSI { 1230}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HG1 ))
      6.000     6.000     0.000 peak  1230 spectrum    1 weight  0.11000E+01 volume  0.33728E-05 ppm1      8.090 ppm2      1.178 CV     1
 ASSI { 1233}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      6.000     6.000     0.000 peak  1233 spectrum    1 weight  0.11000E+01 volume  0.43825E-04 ppm1      7.372 ppm2      4.388 CV     1
 ASSI { 1234}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      2.900     1.100     1.100 peak  1234 spectrum    1 weight  0.11000E+01 volume  0.18265E-02 ppm1      7.580 ppm2      3.934 CV     1
 ASSI { 1235}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
      2.100     0.600     0.600 peak  1235 spectrum    1 weight  0.11000E+01 volume  0.43186E-02 ppm1      7.580 ppm2      1.936 CV     1
 ASSI { 1236}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      6.000     5.800     0.000 peak  1236 spectrum    1 weight  0.11000E+01 volume  0.19603E-04 ppm1      8.814 ppm2      4.639 CV     1
 ASSI { 1237}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      5.300     3.500     0.700 peak  1237 spectrum    1 weight  0.11000E+01 volume  0.22297E-04 ppm1      8.809 ppm2      2.895 CV     1
 ASSI { 1238}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      5.900     4.300     0.100 peak  1238 spectrum    1 weight  0.11000E+01 volume  0.48713E-04 ppm1      8.096 ppm2      8.613 CV     1
 ASSI { 1239}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      2.300     0.700     0.700 peak  1239 spectrum    1 weight  0.11000E+01 volume  0.53304E-02 ppm1      8.107 ppm2      7.389 CV     1
 ASSI { 1242}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HG  ))
      4.100     4.100     1.900 peak  1242 spectrum    1 weight  0.11000E+01 volume  0.10964E-02 ppm1      8.105 ppm2      1.734 CV     1
 ASSI { 1243}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 90   and name HZ2 ))
      6.000     6.000     0.000 peak  1243 spectrum    1 weight  0.11000E+01 volume  0.50047E-04 ppm1      8.341 ppm2      7.144 CV     1
 ASSI { 1247}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HG  ))
      2.600     2.600     3.400 peak  1247 spectrum    1 weight  0.11000E+01 volume  0.53126E-02 ppm1      8.699 ppm2      1.544 CV     1
 ASSI { 1248}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     5.600     0.000 peak  1248 spectrum    1 weight  0.11000E+01 volume  0.31533E-04 ppm1      8.486 ppm2      8.835 CV     1
 ASSI { 1249}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      4.700     2.800     1.300 peak  1249 spectrum    1 weight  0.11000E+01 volume  0.13018E-03 ppm1      8.253 ppm2      4.529 CV     1
 ASSI { 1250}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 82   and name HD1 ))
      5.300     3.500     0.700 peak  1250 spectrum    1 weight  0.11000E+01 volume  0.22343E-04 ppm1      8.098 ppm2      3.323 CV     1
 ASSI { 1253}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HB2 ))
      3.900     1.900     1.900 peak  1253 spectrum    1 weight  0.11000E+01 volume  0.76545E-03 ppm1      7.845 ppm2      3.869 CV     1
 ASSI { 1254}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HE1 ))
      4.700     2.800     1.300 peak  1254 spectrum    1 weight  0.11000E+01 volume  0.27202E-03 ppm1      7.842 ppm2      2.985 CV     1
 ASSI { 1258}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      3.700     3.700     2.300 peak  1258 spectrum    1 weight  0.11000E+01 volume  0.40667E-02 ppm1      7.524 ppm2      0.679 CV     1
 ASSI { 1260}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 135  and name HN  ))
      5.900     4.400     0.100 peak  1260 spectrum    1 weight  0.11000E+01 volume  0.11205E-04 ppm1      8.217 ppm2      7.825 CV     1
 ASSI { 1262}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 137  and name HG1 ))
      3.000     1.100     1.100 peak  1262 spectrum    1 weight  0.11000E+01 volume  0.44722E-02 ppm1      8.221 ppm2      1.481 CV     1
 ASSI { 1263}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 90   and name HZ2 ))
      4.000     2.000     2.000 peak  1263 spectrum    1 weight  0.11000E+01 volume  0.32386E-03 ppm1      8.135 ppm2      7.154 CV     1
 ASSI { 1264}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 90   and name HH2 ))
      5.300     3.500     0.700 peak  1264 spectrum    1 weight  0.11000E+01 volume  0.64944E-04 ppm1      8.138 ppm2      6.804 CV     1
 ASSI { 1265}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      4.800     2.900     1.200 peak  1265 spectrum    1 weight  0.11000E+01 volume  0.40248E-04 ppm1      8.146 ppm2      7.517 CV     1
 ASSI { 1266}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      4.500     2.500     1.500 peak  1266 spectrum    1 weight  0.11000E+01 volume  0.41543E-03 ppm1      8.138 ppm2      8.380 CV     1
 ASSI { 1267}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      6.000     6.000     0.000 peak  1267 spectrum    1 weight  0.11000E+01 volume  0.40474E-04 ppm1      8.146 ppm2      4.545 CV     1
 ASSI { 1268}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 98   and name HB2 ))
      4.900     3.000     1.100 peak  1268 spectrum    1 weight  0.11000E+01 volume  0.17878E-03 ppm1      8.145 ppm2      3.012 CV     1
 ASSI { 1269}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 98   and name HB1 ))
      6.000     6.000     0.000 peak  1269 spectrum    1 weight  0.11000E+01 volume  0.18449E-04 ppm1      8.146 ppm2      2.415 CV     1
 ASSI { 1271}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HD2 ))
      5.900     4.400     0.100 peak  1271 spectrum    1 weight  0.11000E+01 volume  0.19196E-04 ppm1      8.444 ppm2      3.703 CV     1
 ASSI { 1273}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HD1 ))
      5.600     3.900     0.400 peak  1273 spectrum    1 weight  0.11000E+01 volume  0.12529E-03 ppm1      8.436 ppm2      3.291 CV     1
 ASSI { 1274}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      4.400     2.400     1.600 peak  1274 spectrum    1 weight  0.11000E+01 volume  0.43684E-03 ppm1      7.424 ppm2      7.841 CV     1
 ASSI { 1275}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HD21))
      4.700     2.700     1.300 peak  1275 spectrum    1 weight  0.11000E+01 volume  0.20013E-03 ppm1      8.794 ppm2      8.093 CV     1
 ASSI { 1276}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      6.000     5.900     0.000 peak  1276 spectrum    1 weight  0.11000E+01 volume  0.17544E-04 ppm1      8.720 ppm2      5.406 CV     1
 ASSI { 1277}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 64   and name HD22))
      6.000     6.000     0.000 peak  1277 spectrum    1 weight  0.11000E+01 volume  0.67276E-04 ppm1      8.726 ppm2      6.935 CV     1
 ASSI { 1279}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 66   and name HG1 ))
      4.000     2.000     2.000 peak  1279 spectrum    1 weight  0.11000E+01 volume  0.47964E-03 ppm1      9.183 ppm2      1.269 CV     1
 ASSI { 1280}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 53   and name HE% )
      4.600     2.600     1.400 peak  1280 spectrum    1 weight  0.11000E+01 volume  0.33185E-03 ppm1      8.319 ppm2      6.701 CV     1
 ASSI { 1281}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      6.000     4.900     0.000 peak  1281 spectrum    1 weight  0.11000E+01 volume  0.40746E-04 ppm1      7.342 ppm2      9.092 CV     1
 ASSI { 1282}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      6.000     4.500     0.000 peak  1282 spectrum    1 weight  0.11000E+01 volume  0.11776E-03 ppm1      9.076 ppm2      2.198 CV     1
 ASSI {    2}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      3.400     1.500     1.500 peak     2 spectrum    1 weight  0.11000E+01 volume  0.58849E-03 ppm1      3.956 ppm2      7.365 CV     1
 ASSI {    6}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      3.500     3.500     2.500 peak     6 spectrum    1 weight  0.11000E+01 volume  0.29407E-02 ppm1      4.179 ppm2      8.837 CV     1
 ASSI {    7}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      2.700     0.900     0.900 peak     7 spectrum    1 weight  0.11000E+01 volume  0.19489E-02 ppm1      4.180 ppm2      8.683 CV     1
 ASSI {    8}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      2.200     2.200     3.800 peak     8 spectrum    1 weight  0.11000E+01 volume  0.40335E-02 ppm1      4.125 ppm2      8.583 CV     1
 ASSI {   11}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 58   and name HD% )
      2.800     2.800     3.200 peak    11 spectrum    1 weight  0.11000E+01 volume  0.21106E-02 ppm1      3.981 ppm2      7.422 CV     1
 ASSI {   13}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HE3 ))
      2.700     0.900     0.900 peak    13 spectrum    1 weight  0.11000E+01 volume  0.25342E-02 ppm1      3.825 ppm2      7.329 CV     1
 ASSI {   14}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 76   and name HN  ))
      4.000     2.000     2.000 peak    14 spectrum    1 weight  0.11000E+01 volume  0.80977E-03 ppm1      3.990 ppm2      8.432 CV     1
 ASSI {   15}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 77   and name HN  ))
      3.000     1.100     1.100 peak    15 spectrum    1 weight  0.11000E+01 volume  0.40409E-02 ppm1      3.990 ppm2      8.584 CV     1
 ASSI {   17}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      3.000     1.200     1.200 peak    17 spectrum    1 weight  0.11000E+01 volume  0.14880E-02 ppm1      3.992 ppm2      7.477 CV     1
 ASSI {   18}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 78   and name HN  ))
      3.200     1.300     1.300 peak    18 spectrum    1 weight  0.11000E+01 volume  0.21248E-02 ppm1      3.992 ppm2      7.302 CV     1
 ASSI {   28}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
      2.700     0.900     0.900 peak    28 spectrum    1 weight  0.11000E+01 volume  0.30254E-02 ppm1      3.829 ppm2      7.641 CV     1
 ASSI {   37}
   (( segid "    " and resid 69   and name HA2 ))
   (( segid "    " and resid 90   and name HH2 ))
      2.700     0.900     0.900 peak    37 spectrum    1 weight  0.11000E+01 volume  0.11343E-02 ppm1      3.801 ppm2      6.812 CV     1
 ASSI {   40}
   (( segid "    " and resid 38   and name HA1 ))
   (( segid "    " and resid 41   and name HN  ))
      3.700     3.700     2.300 peak    40 spectrum    1 weight  0.11000E+01 volume  0.13427E-02 ppm1      3.921 ppm2      8.011 CV     1
 ASSI {   41}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 118  and name HN  ))
      4.000     2.000     2.000 peak    41 spectrum    1 weight  0.11000E+01 volume  0.22825E-02 ppm1      4.140 ppm2      7.790 CV     1
 ASSI {   42}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 119  and name HN  ))
      2.900     1.100     1.100 peak    42 spectrum    1 weight  0.11000E+01 volume  0.15543E-02 ppm1      4.145 ppm2      7.952 CV     1
 ASSI {   44}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 118  and name HN  ))
      4.000     2.000     2.000 peak    44 spectrum    1 weight  0.11000E+01 volume  0.23180E-02 ppm1      3.635 ppm2      7.802 CV     1
 ASSI {   47}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 31   and name HD% )
      3.300     1.400     1.400 peak    47 spectrum    1 weight  0.11000E+01 volume  0.98957E-03 ppm1      3.022 ppm2      7.072 CV     1
 ASSI {   52}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HN  ))
      2.300     0.600     0.600 peak    52 spectrum    1 weight  0.11000E+01 volume  0.14531E-01 ppm1      1.963 ppm2      7.490 CV     1
 ASSI {   55}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 119  and name HN  ))
      3.300     1.300     1.300 peak    55 spectrum    1 weight  0.11000E+01 volume  0.39602E-02 ppm1      2.148 ppm2      7.898 CV     1
 ASSI {   58}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 56   and name HN  ))
      2.900     1.000     1.000 peak    58 spectrum    1 weight  0.11000E+01 volume  0.86277E-02 ppm1      2.204 ppm2      7.219 CV     1
 ASSI {   59}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HN  ))
      2.400     0.700     0.700 peak    59 spectrum    1 weight  0.11000E+01 volume  0.47008E-02 ppm1      2.188 ppm2      7.362 CV     1
 ASSI {   60}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      3.000     1.100     1.100 peak    60 spectrum    1 weight  0.11000E+01 volume  0.46422E-02 ppm1      2.177 ppm2      7.205 CV     1
 ASSI {   62}
   (( segid "    " and resid 56   and name HG12))
   (( segid "    " and resid 106  and name HZ  ))
      4.400     2.500     1.600 peak    62 spectrum    1 weight  0.11000E+01 volume  0.13695E-02 ppm1      1.919 ppm2      7.323 CV     1
 ASSI {   63}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 90   and name HZ3 ))
      4.900     3.100     1.100 peak    63 spectrum    1 weight  0.11000E+01 volume  0.62761E-04 ppm1      0.829 ppm2      6.856 CV     1
 ASSI {   65}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 106  and name HZ  ))
      3.400     1.500     1.500 peak    65 spectrum    1 weight  0.11000E+01 volume  0.85935E-03 ppm1      0.475 ppm2      7.276 CV     1
 ASSI {   67}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 111  and name HD2 ))
      4.300     2.300     1.700 peak    67 spectrum    1 weight  0.11000E+01 volume  0.38701E-03 ppm1      0.772 ppm2      6.272 CV     1
 ASSI {   70}
   (  segid "    " and resid 46   and name HG2%)
   (  segid "    " and resid 53   and name HD% )
      4.700     2.800     1.300 peak    70 spectrum    1 weight  0.11000E+01 volume  0.12873E-03 ppm1      0.501 ppm2      6.754 CV     1
 ASSI {   72}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 84   and name HN  ))
      3.900     3.900     2.100 peak    72 spectrum    1 weight  0.11000E+01 volume  0.22806E-02 ppm1      1.097 ppm2      7.004 CV     1
 ASSI {   73}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 85   and name HN  ))
      2.900     1.000     1.000 peak    73 spectrum    1 weight  0.11000E+01 volume  0.12325E-02 ppm1      1.098 ppm2      6.864 CV     1
 ASSI {   77}
   (  segid "    " and resid 131  and name HG2%)
   (( segid "    " and resid 131  and name HN  ))
      3.100     1.200     1.200 peak    77 spectrum    1 weight  0.11000E+01 volume  0.26355E-02 ppm1      0.978 ppm2      7.126 CV     1
 ASSI {   79}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 70   and name HN  ))
      3.900     1.900     1.900 peak    79 spectrum    1 weight  0.11000E+01 volume  0.14807E-02 ppm1      1.331 ppm2      8.394 CV     1
 ASSI {   82}
   (  segid "    " and resid 59   and name HG2%)
   (( segid "    " and resid 61   and name HN  ))
      3.500     3.500     2.500 peak    82 spectrum    1 weight  0.11000E+01 volume  0.22064E-02 ppm1      1.441 ppm2      8.004 CV     1
 ASSI {   83}
   (  segid "    " and resid 59   and name HG2%)
   (  segid "    " and resid 106  and name HE% )
      4.000     4.000     2.000 peak    83 spectrum    1 weight  0.11000E+01 volume  0.19214E-02 ppm1      1.441 ppm2      6.028 CV     1
 ASSI {   85}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 112  and name HN  ))
      3.600     1.600     1.600 peak    85 spectrum    1 weight  0.11000E+01 volume  0.22417E-02 ppm1      0.723 ppm2      8.216 CV     1
 ASSI {   86}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 111  and name HD2 ))
      3.200     1.200     1.200 peak    86 spectrum    1 weight  0.11000E+01 volume  0.15102E-02 ppm1      0.724 ppm2      6.274 CV     1
 ASSI {   87}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 112  and name HN  ))
      2.300     2.300     3.700 peak    87 spectrum    1 weight  0.11000E+01 volume  0.28951E-02 ppm1      0.652 ppm2      8.188 CV     1
 ASSI {   88}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name HN  ))
      3.100     1.200     1.200 peak    88 spectrum    1 weight  0.11000E+01 volume  0.14855E-02 ppm1      0.650 ppm2      8.008 CV     1
 ASSI {   91}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 101  and name HA  ))
      2.600     0.800     0.800 peak    91 spectrum    1 weight  0.11000E+01 volume  0.30412E-02 ppm1      0.069 ppm2      5.826 CV     1
 ASSI {   94}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 78   and name HN  ))
      3.600     1.600     1.600 peak    94 spectrum    1 weight  0.11000E+01 volume  0.31412E-02 ppm1      1.040 ppm2      7.342 CV     1
 ASSI {   95}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 44   and name HN  ))
      4.500     4.500     1.500 peak    95 spectrum    1 weight  0.11000E+01 volume  0.35851E-03 ppm1      0.943 ppm2      8.840 CV     1
 ASSI {   98}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 116  and name HN  ))
      4.000     2.000     2.000 peak    98 spectrum    1 weight  0.11000E+01 volume  0.42533E-03 ppm1      0.685 ppm2      7.796 CV     1
 ASSI {  101}
   (  segid "    " and resid 45   and name HG2%)
   (( segid "    " and resid 46   and name HN  ))
      4.000     2.000     2.000 peak   101 spectrum    1 weight  0.11000E+01 volume  0.15206E-02 ppm1      0.804 ppm2      9.293 CV     1
 ASSI {  102}
   (  segid "    " and resid 45   and name HG2%)
   (( segid "    " and resid 111  and name HE1 ))
      6.000     5.600     0.000 peak   102 spectrum    1 weight  0.11000E+01 volume  0.66500E-04 ppm1      0.808 ppm2      7.547 CV     1
 ASSI {  103}
   (  segid "    " and resid 45   and name HG2%)
   (( segid "    " and resid 129  and name HD2 ))
      3.300     3.300     2.700 peak   103 spectrum    1 weight  0.11000E+01 volume  0.16735E-02 ppm1      0.806 ppm2      6.898 CV     1
 ASSI {  105}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 90   and name HZ3 ))
      2.300     0.700     0.700 peak   105 spectrum    1 weight  0.11000E+01 volume  0.28226E-02 ppm1      1.779 ppm2      6.841 CV     1
 ASSI {  107}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 74   and name HN  ))
      4.100     2.100     1.900 peak   107 spectrum    1 weight  0.11000E+01 volume  0.98630E-03 ppm1      1.778 ppm2      7.476 CV     1
 ASSI {  108}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 90   and name HE3 ))
      4.500     2.500     1.500 peak   108 spectrum    1 weight  0.11000E+01 volume  0.55515E-03 ppm1      1.777 ppm2      7.301 CV     1
 ASSI {  109}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 112  and name HN  ))
      3.800     3.800     2.200 peak   109 spectrum    1 weight  0.11000E+01 volume  0.15517E-02 ppm1      1.156 ppm2      8.208 CV     1
 ASSI {  111}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 50   and name HN  ))
      2.800     2.800     3.200 peak   111 spectrum    1 weight  0.11000E+01 volume  0.10933E-02 ppm1      1.818 ppm2      7.337 CV     1
 ASSI {  112}
   (  segid "    " and resid 107  and name HB% )
   (  segid "    " and resid 53   and name HD% )
      4.600     2.700     1.400 peak   112 spectrum    1 weight  0.11000E+01 volume  0.11095E-03 ppm1      1.816 ppm2      6.755 CV     1
 ASSI {  115}
   (  segid "    " and resid 70   and name HB% )
   (( segid "    " and resid 68   and name HN  ))
      4.500     4.500     1.500 peak   115 spectrum    1 weight  0.11000E+01 volume  0.74642E-03 ppm1      1.295 ppm2      8.232 CV     1
 ASSI {  116}
   (  segid "    " and resid 70   and name HB% )
   (( segid "    " and resid 74   and name HN  ))
      4.400     2.400     1.600 peak   116 spectrum    1 weight  0.11000E+01 volume  0.52817E-03 ppm1      1.296 ppm2      7.488 CV     1
 ASSI {  117}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 60   and name HN  ))
      3.100     3.100     2.900 peak   117 spectrum    1 weight  0.11000E+01 volume  0.40658E-02 ppm1      1.102 ppm2      7.435 CV     1
 ASSI {  118}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 56   and name HN  ))
      3.400     1.400     1.400 peak   118 spectrum    1 weight  0.11000E+01 volume  0.41946E-02 ppm1      1.098 ppm2      7.234 CV     1
 ASSI {  119}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 89   and name HN  ))
      4.500     2.500     1.500 peak   119 spectrum    1 weight  0.11000E+01 volume  0.72122E-03 ppm1      0.899 ppm2      8.212 CV     1
 ASSI {  120}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 90   and name HN  ))
      3.600     1.600     1.600 peak   120 spectrum    1 weight  0.11000E+01 volume  0.96799E-03 ppm1      2.093 ppm2      8.673 CV     1
 ASSI {  121}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 77   and name HN  ))
      4.400     2.400     1.600 peak   121 spectrum    1 weight  0.11000E+01 volume  0.12436E-02 ppm1      2.092 ppm2      8.560 CV     1
 ASSI {  124}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 108  and name HN  ))
      3.600     1.700     1.700 peak   124 spectrum    1 weight  0.11000E+01 volume  0.29686E-02 ppm1      1.161 ppm2      8.526 CV     1
 ASSI {  128}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 90   and name HZ3 ))
      5.000     5.000     1.000 peak   128 spectrum    1 weight  0.11000E+01 volume  0.65445E-03 ppm1      0.436 ppm2      6.834 CV     1
 ASSI {  129}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 112  and name HN  ))
      4.700     2.700     1.300 peak   129 spectrum    1 weight  0.11000E+01 volume  0.67420E-03 ppm1      0.650 ppm2      8.215 CV     1
 ASSI {  130}
   (  segid "    " and resid 56   and name HD1%)
   (( segid "    " and resid 55   and name HN  ))
      4.100     4.100     1.900 peak   130 spectrum    1 weight  0.11000E+01 volume  0.23547E-02 ppm1      1.051 ppm2      7.329 CV     1
 ASSI {  132}
   (( segid "    " and resid 14   and name HB  ))
   (( segid "    " and resid 14   and name HA  ))
      3.500     1.500     1.500 peak   132 spectrum    1 weight  0.11000E+01 volume  0.73842E-03 ppm1      2.015 ppm2      4.115 CV     1
 ASSI {  133}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 114  and name HA  ))
      2.900     1.100     1.100 peak   133 spectrum    1 weight  0.11000E+01 volume  0.13979E-02 ppm1      2.049 ppm2      3.824 CV     1
 ASSI {  136}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 107  and name HA  ))
      3.700     1.700     1.700 peak   136 spectrum    1 weight  0.11000E+01 volume  0.10454E-02 ppm1      1.375 ppm2      3.777 CV     1
 ASSI {  137}
   (( segid "    " and resid 118  and name HG1 ))
   (( segid "    " and resid 118  and name HA  ))
      3.600     1.600     1.600 peak   137 spectrum    1 weight  0.11000E+01 volume  0.16435E-02 ppm1      2.240 ppm2      4.146 CV     1
 ASSI {  141}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 42   and name HA  ))
      5.300     3.500     0.700 peak   141 spectrum    1 weight  0.11000E+01 volume  0.13968E-03 ppm1      0.891 ppm2      4.136 CV     1
 ASSI {  143}
   (( segid "    " and resid 128  and name HB1 ))
   (( segid "    " and resid 128  and name HA  ))
      2.200     0.600     0.600 peak   143 spectrum    1 weight  0.11000E+01 volume  0.81392E-02 ppm1      2.036 ppm2      4.160 CV     1
 ASSI {  144}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 91   and name HA  ))
      2.100     0.600     0.600 peak   144 spectrum    1 weight  0.11000E+01 volume  0.10877E-01 ppm1      1.966 ppm2      3.914 CV     1
 ASSI {  148}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 45   and name HA  ))
      4.000     2.000     2.000 peak   148 spectrum    1 weight  0.11000E+01 volume  0.17345E-02 ppm1      1.814 ppm2      3.841 CV     1
 ASSI {  149}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HA  ))
      2.400     0.700     0.700 peak   149 spectrum    1 weight  0.11000E+01 volume  0.53323E-02 ppm1      1.788 ppm2      4.047 CV     1
 ASSI {  154}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 121  and name HA  ))
      2.400     0.700     0.700 peak   154 spectrum    1 weight  0.11000E+01 volume  0.58652E-02 ppm1      2.002 ppm2      4.259 CV     1
 ASSI {  155}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 37   and name HA  ))
      3.300     1.400     1.400 peak   155 spectrum    1 weight  0.11000E+01 volume  0.12800E-02 ppm1      1.886 ppm2      4.269 CV     1
 ASSI {  157}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HA  ))
      2.200     0.600     0.600 peak   157 spectrum    1 weight  0.11000E+01 volume  0.10506E-01 ppm1      2.172 ppm2      4.138 CV     1
 ASSI {  159}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HA  ))
      3.100     1.200     1.200 peak   159 spectrum    1 weight  0.11000E+01 volume  0.25774E-02 ppm1      2.026 ppm2      3.896 CV     1
 ASSI {  162}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HA  ))
      6.000     5.500     0.000 peak   162 spectrum    1 weight  0.11000E+01 volume  0.47924E-04 ppm1      1.695 ppm2      3.993 CV     1
 ASSI {  166}
   (  segid "    " and resid 108  and name HD1%)
   (( segid "    " and resid 108  and name HA  ))
      3.300     1.300     1.300 peak   166 spectrum    1 weight  0.11000E+01 volume  0.31417E-02 ppm1      1.197 ppm2      4.083 CV     1
 ASSI {  168}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HA  ))
      3.800     1.800     1.800 peak   168 spectrum    1 weight  0.11000E+01 volume  0.16737E-02 ppm1      2.095 ppm2      4.203 CV     1
 ASSI {  169}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HD2 ))
      2.900     1.000     1.000 peak   169 spectrum    1 weight  0.11000E+01 volume  0.35246E-02 ppm1      2.097 ppm2      3.894 CV     1
 ASSI {  172}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 73   and name HA  ))
      4.500     2.500     1.500 peak   172 spectrum    1 weight  0.11000E+01 volume  0.66119E-03 ppm1      1.273 ppm2      3.931 CV     1
 ASSI {  173}
   (  segid "    " and resid 126  and name HD2%)
   (( segid "    " and resid 126  and name HA  ))
      3.600     1.700     1.700 peak   173 spectrum    1 weight  0.11000E+01 volume  0.11277E-02 ppm1      0.961 ppm2      4.145 CV     1
 ASSI {  174}
   (  segid "    " and resid 117  and name HD1%)
   (( segid "    " and resid 117  and name HA  ))
      2.800     2.800     3.200 peak   174 spectrum    1 weight  0.11000E+01 volume  0.43124E-02 ppm1      0.858 ppm2      4.094 CV     1
 ASSI {  178}
   (( segid "    " and resid 91   and name HG1 ))
   (( segid "    " and resid 88   and name HA  ))
      4.000     2.000     2.000 peak   178 spectrum    1 weight  0.11000E+01 volume  0.82042E-03 ppm1      1.541 ppm2      4.102 CV     1
 ASSI {  179}
   (( segid "    " and resid 114  and name HG2 ))
   (( segid "    " and resid 114  and name HA  ))
      3.900     1.900     1.900 peak   179 spectrum    1 weight  0.11000E+01 volume  0.95180E-03 ppm1      1.480 ppm2      3.809 CV     1
 ASSI {  182}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HA  ))
      2.400     0.700     0.700 peak   182 spectrum    1 weight  0.11000E+01 volume  0.45156E-02 ppm1      1.359 ppm2      3.857 CV     1
 ASSI {  183}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HA  ))
      4.600     2.600     1.400 peak   183 spectrum    1 weight  0.11000E+01 volume  0.87024E-03 ppm1      0.876 ppm2      5.119 CV     1
 ASSI {  184}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 68   and name HA  ))
      4.000     2.000     2.000 peak   184 spectrum    1 weight  0.11000E+01 volume  0.92063E-03 ppm1      0.877 ppm2      4.508 CV     1
 ASSI {  187}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 108  and name HA  ))
      3.600     1.700     1.700 peak   187 spectrum    1 weight  0.11000E+01 volume  0.74840E-03 ppm1      1.203 ppm2      4.070 CV     1
 ASSI {  188}
   (  segid "    " and resid 122  and name HD1%)
   (( segid "    " and resid 122  and name HA  ))
      3.200     1.200     1.200 peak   188 spectrum    1 weight  0.11000E+01 volume  0.13008E-02 ppm1      0.791 ppm2      4.406 CV     1
 ASSI {  189}
   (  segid "    " and resid 122  and name HD1%)
   (( segid "    " and resid 123  and name HD2 ))
      3.500     1.600     1.600 peak   189 spectrum    1 weight  0.11000E+01 volume  0.13177E-02 ppm1      0.788 ppm2      3.734 CV     1
 ASSI {  190}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HA  ))
      2.800     1.000     1.000 peak   190 spectrum    1 weight  0.11000E+01 volume  0.40910E-02 ppm1      0.732 ppm2      3.905 CV     1
 ASSI {  191}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 108  and name HA  ))
      2.900     1.100     1.100 peak   191 spectrum    1 weight  0.11000E+01 volume  0.23707E-02 ppm1      0.501 ppm2      4.054 CV     1
 ASSI {  194}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 95   and name HA  ))
      2.900     1.000     1.000 peak   194 spectrum    1 weight  0.11000E+01 volume  0.33131E-02 ppm1      1.046 ppm2      3.480 CV     1
 ASSI {  195}
   (  segid "    " and resid 131  and name HG2%)
   (( segid "    " and resid 128  and name HA  ))
      2.900     1.100     1.100 peak   195 spectrum    1 weight  0.11000E+01 volume  0.30686E-02 ppm1      0.979 ppm2      4.207 CV     1
 ASSI {  196}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 85   and name HA  ))
      2.500     0.800     0.800 peak   196 spectrum    1 weight  0.11000E+01 volume  0.48848E-02 ppm1      0.980 ppm2      3.695 CV     1
 ASSI {  197}
   (  segid "    " and resid 117  and name HD2%)
   (( segid "    " and resid 117  and name HA  ))
      2.800     1.000     1.000 peak   197 spectrum    1 weight  0.11000E+01 volume  0.62593E-02 ppm1      0.920 ppm2      4.078 CV     1
 ASSI {  198}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 92   and name HA  ))
      3.200     1.300     1.300 peak   198 spectrum    1 weight  0.11000E+01 volume  0.78834E-02 ppm1      0.668 ppm2      3.983 CV     1
 ASSI {  201}
   (  segid "    " and resid 60   and name HD2%)
   (( segid "    " and resid 60   and name HA  ))
      2.600     0.800     0.800 peak   201 spectrum    1 weight  0.11000E+01 volume  0.30319E-02 ppm1      0.682 ppm2      4.451 CV     1
 ASSI {  202}
   (  segid "    " and resid 46   and name HG1%)
   (( segid "    " and resid 108  and name HA  ))
      3.300     1.400     1.400 peak   202 spectrum    1 weight  0.11000E+01 volume  0.14776E-02 ppm1     -0.199 ppm2      4.052 CV     1
 ASSI {  204}
   (  segid "    " and resid 59   and name HG2%)
   (( segid "    " and resid 56   and name HA  ))
      3.700     1.700     1.700 peak   204 spectrum    1 weight  0.11000E+01 volume  0.19209E-02 ppm1      1.441 ppm2      3.941 CV     1
 ASSI {  207}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 52   and name HA  ))
      2.200     2.200     3.800 peak   207 spectrum    1 weight  0.11000E+01 volume  0.10987E-01 ppm1      1.112 ppm2      3.932 CV     1
 ASSI {  210}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 77   and name HA  ))
      2.200     0.600     0.600 peak   210 spectrum    1 weight  0.11000E+01 volume  0.11865E-01 ppm1      1.042 ppm2      3.987 CV     1
 ASSI {  211}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 63   and name HA  ))
      2.600     2.600     3.400 peak   211 spectrum    1 weight  0.11000E+01 volume  0.52427E-02 ppm1      0.947 ppm2      4.168 CV     1
 ASSI {  213}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 42   and name HA  ))
      2.400     2.400     3.600 peak   213 spectrum    1 weight  0.11000E+01 volume  0.81888E-02 ppm1      0.903 ppm2      4.144 CV     1
 ASSI {  214}
   (  segid "    " and resid 45   and name HG1%)
   (( segid "    " and resid 45   and name HA  ))
      2.600     0.800     0.800 peak   214 spectrum    1 weight  0.11000E+01 volume  0.57568E-02 ppm1      0.805 ppm2      3.873 CV     1
 ASSI {  215}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 69   and name HA2 ))
      3.500     1.500     1.500 peak   215 spectrum    1 weight  0.11000E+01 volume  0.47444E-03 ppm1      1.780 ppm2      3.830 CV     1
 ASSI {  220}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 109  and name HA  ))
      3.300     1.400     1.400 peak   220 spectrum    1 weight  0.11000E+01 volume  0.66876E-03 ppm1      1.150 ppm2      3.631 CV     1
 ASSI {  221}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 104  and name HA  ))
      2.500     0.800     0.800 peak   221 spectrum    1 weight  0.11000E+01 volume  0.34133E-02 ppm1      1.816 ppm2      4.043 CV     1
 ASSI {  223}
   (  segid "    " and resid 70   and name HB% )
   (( segid "    " and resid 70   and name HA  ))
      2.300     0.600     0.600 peak   223 spectrum    1 weight  0.11000E+01 volume  0.10855E-01 ppm1      1.297 ppm2      3.933 CV     1
 ASSI {  225}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 89   and name HA  ))
      3.100     1.200     1.200 peak   225 spectrum    1 weight  0.11000E+01 volume  0.12854E-02 ppm1      0.899 ppm2      3.472 CV     1
 ASSI {  227}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 90   and name HA  ))
      2.800     2.800     3.200 peak   227 spectrum    1 weight  0.11000E+01 volume  0.46847E-02 ppm1      0.895 ppm2      3.837 CV     1
 ASSI {  228}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 109  and name HA  ))
      2.800     1.000     1.000 peak   228 spectrum    1 weight  0.11000E+01 volume  0.20698E-02 ppm1      0.899 ppm2      3.638 CV     1
 ASSI {  230}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 86   and name HA  ))
      4.600     2.600     1.400 peak   230 spectrum    1 weight  0.11000E+01 volume  0.21504E-03 ppm1      2.090 ppm2      3.855 CV     1
 ASSI {  231}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 90   and name HB2 ))
      3.900     1.900     1.900 peak   231 spectrum    1 weight  0.11000E+01 volume  0.42884E-03 ppm1      2.092 ppm2      3.476 CV     1
 ASSI {  233}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 72   and name HA  ))
      2.800     1.000     1.000 peak   233 spectrum    1 weight  0.11000E+01 volume  0.18524E-02 ppm1      0.438 ppm2      4.093 CV     1
 ASSI {  234}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 90   and name HA  ))
      4.100     4.100     1.900 peak   234 spectrum    1 weight  0.11000E+01 volume  0.24104E-02 ppm1      0.643 ppm2      3.844 CV     1
 ASSI {  235}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 89   and name HA  ))
      3.900     1.900     1.900 peak   235 spectrum    1 weight  0.11000E+01 volume  0.74584E-03 ppm1      0.643 ppm2      3.468 CV     1
 ASSI {  236}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 79   and name HB2 ))
      2.800     1.000     1.000 peak   236 spectrum    1 weight  0.11000E+01 volume  0.21074E-02 ppm1      0.761 ppm2      4.171 CV     1
 ASSI {  237}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 79   and name HB1 ))
      3.100     3.100     2.900 peak   237 spectrum    1 weight  0.11000E+01 volume  0.34964E-02 ppm1      0.758 ppm2      3.788 CV     1
 ASSI {  238}
   (  segid "    " and resid 56   and name HD1%)
   (( segid "    " and resid 56   and name HA  ))
      4.000     2.000     2.000 peak   238 spectrum    1 weight  0.11000E+01 volume  0.16965E-02 ppm1      1.050 ppm2      3.939 CV     1
 ASSI {  239}
   (( segid "    " and resid 52   and name HB  ))
   (  segid "    " and resid 52   and name HG2%)
      2.500     0.800     0.800 peak   239 spectrum    1 weight  0.11000E+01 volume  0.49970E-02 ppm1      3.902 ppm2      1.109 CV     1
 ASSI {  241}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
      2.500     0.800     0.800 peak   241 spectrum    1 weight  0.11000E+01 volume  0.54663E-02 ppm1      3.471 ppm2      1.911 CV     1
 ASSI {  242}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HB2 ))
      3.100     1.200     1.200 peak   242 spectrum    1 weight  0.11000E+01 volume  0.28024E-02 ppm1      3.603 ppm2      2.169 CV     1
 ASSI {  243}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HB1 ))
      2.400     0.700     0.700 peak   243 spectrum    1 weight  0.11000E+01 volume  0.46350E-02 ppm1      3.603 ppm2      1.837 CV     1
 ASSI {  244}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HG1 ))
      5.500     3.700     0.500 peak   244 spectrum    1 weight  0.11000E+01 volume  0.20730E-03 ppm1      3.602 ppm2      1.525 CV     1
 ASSI {  249}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HB2 ))
      2.900     1.100     1.100 peak   249 spectrum    1 weight  0.11000E+01 volume  0.44319E-02 ppm1      4.198 ppm2      2.427 CV     1
 ASSI {  251}
   (( segid "    " and resid 79   and name HB2 ))
   (  segid "    " and resid 81   and name HD2%)
      3.300     3.300     2.700 peak   251 spectrum    1 weight  0.11000E+01 volume  0.65344E-02 ppm1      4.201 ppm2      0.950 CV     1
 ASSI {  253}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
      2.300     0.700     0.700 peak   253 spectrum    1 weight  0.11000E+01 volume  0.73202E-02 ppm1      3.722 ppm2      2.087 CV     1
 ASSI {  254}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      2.200     0.600     0.600 peak   254 spectrum    1 weight  0.11000E+01 volume  0.93200E-02 ppm1      3.723 ppm2      0.661 CV     1
 ASSI {  255}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 88   and name HG2 ))
      3.000     1.100     1.100 peak   255 spectrum    1 weight  0.11000E+01 volume  0.14669E-02 ppm1      3.673 ppm2      1.651 CV     1
 ASSI {  256}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 85   and name HG2%)
      2.400     0.700     0.700 peak   256 spectrum    1 weight  0.11000E+01 volume  0.65878E-02 ppm1      3.678 ppm2      1.069 CV     1
 ASSI {  258}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 84   and name HG2%)
      2.800     1.000     1.000 peak   258 spectrum    1 weight  0.11000E+01 volume  0.37055E-02 ppm1      4.029 ppm2      1.299 CV     1
 ASSI {  261}
   (( segid "    " and resid 77   and name HA  ))
   (  segid "    " and resid 86   and name HD2%)
      2.700     2.700     3.300 peak   261 spectrum    1 weight  0.11000E+01 volume  0.42138E-02 ppm1      3.979 ppm2      0.787 CV     1
 ASSI {  263}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB  ))
      2.600     0.900     0.900 peak   263 spectrum    1 weight  0.11000E+01 volume  0.50447E-02 ppm1      3.865 ppm2      2.122 CV     1
 ASSI {  264}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 45   and name HG2%)
      2.200     2.200     3.800 peak   264 spectrum    1 weight  0.11000E+01 volume  0.14633E-01 ppm1      3.865 ppm2      0.804 CV     1
 ASSI {  268}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      2.500     0.800     0.800 peak   268 spectrum    1 weight  0.11000E+01 volume  0.34256E-02 ppm1      4.182 ppm2     -0.046 CV     1
 ASSI {  269}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
      3.100     1.200     1.200 peak   269 spectrum    1 weight  0.11000E+01 volume  0.13703E-02 ppm1      4.179 ppm2      1.527 CV     1
 ASSI {  270}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB1 ))
      2.400     0.700     0.700 peak   270 spectrum    1 weight  0.11000E+01 volume  0.25548E-02 ppm1      4.175 ppm2      1.217 CV     1
 ASSI {  272}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 63   and name HG1%)
      2.200     2.200     3.800 peak   272 spectrum    1 weight  0.11000E+01 volume  0.13243E-01 ppm1      4.169 ppm2      0.919 CV     1
 ASSI {  273}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
      2.800     1.000     1.000 peak   273 spectrum    1 weight  0.11000E+01 volume  0.32707E-02 ppm1      4.161 ppm2      1.970 CV     1
 ASSI {  275}
   (( segid "    " and resid 131  and name HA  ))
   (  segid "    " and resid 131  and name HG2%)
      2.500     0.800     0.800 peak   275 spectrum    1 weight  0.11000E+01 volume  0.58970E-02 ppm1      3.714 ppm2      0.970 CV     1
 ASSI {  276}
   (( segid "    " and resid 131  and name HA  ))
   (  segid "    " and resid 131  and name HG1%)
      2.900     1.100     1.100 peak   276 spectrum    1 weight  0.11000E+01 volume  0.32742E-02 ppm1      3.714 ppm2      0.820 CV     1
 ASSI {  277}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 109  and name HB% )
      2.900     1.000     1.000 peak   277 spectrum    1 weight  0.11000E+01 volume  0.16958E-02 ppm1      4.216 ppm2      1.166 CV     1
 ASSI {  279}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HB  ))
      2.900     1.000     1.000 peak   279 spectrum    1 weight  0.11000E+01 volume  0.26747E-02 ppm1      4.121 ppm2      1.804 CV     1
 ASSI {  282}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 113  and name HG2%)
      5.500     3.800     0.500 peak   282 spectrum    1 weight  0.11000E+01 volume  0.15225E-03 ppm1      4.064 ppm2      0.866 CV     1
 ASSI {  283}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 76   and name HB1 ))
      3.700     1.700     1.700 peak   283 spectrum    1 weight  0.11000E+01 volume  0.26337E-02 ppm1      3.921 ppm2      2.133 CV     1
 ASSI {  284}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB2 ))
      2.600     0.800     0.800 peak   284 spectrum    1 weight  0.11000E+01 volume  0.52114E-02 ppm1      3.924 ppm2      1.796 CV     1
 ASSI {  285}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HG2 ))
      3.100     1.200     1.200 peak   285 spectrum    1 weight  0.11000E+01 volume  0.17966E-02 ppm1      3.916 ppm2      1.272 CV     1
 ASSI {  286}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HB2 ))
      2.500     0.800     0.800 peak   286 spectrum    1 weight  0.11000E+01 volume  0.29144E-02 ppm1      3.809 ppm2      2.015 CV     1
 ASSI {  287}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HB1 ))
      2.700     0.900     0.900 peak   287 spectrum    1 weight  0.11000E+01 volume  0.41303E-02 ppm1      3.810 ppm2      1.855 CV     1
 ASSI {  288}
   (( segid "    " and resid 114  and name HA  ))
   (  segid "    " and resid 117  and name HD1%)
      3.200     1.300     1.300 peak   288 spectrum    1 weight  0.11000E+01 volume  0.43617E-02 ppm1      3.813 ppm2      0.875 CV     1
 ASSI {  289}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HG1 ))
      2.000     0.500     0.500 peak   289 spectrum    1 weight  0.11000E+01 volume  0.10773E-01 ppm1      4.045 ppm2      1.978 CV     1
 ASSI {  291}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HD1 ))
      2.500     2.500     3.500 peak   291 spectrum    1 weight  0.11000E+01 volume  0.49753E-02 ppm1      4.005 ppm2      1.754 CV     1
 ASSI {  293}
   (( segid "    " and resid 76   and name HA  ))
   (  segid "    " and resid 86   and name HD1%)
      3.300     3.300     2.700 peak   293 spectrum    1 weight  0.11000E+01 volume  0.27767E-02 ppm1      3.990 ppm2      0.764 CV     1
 ASSI {  294}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 91   and name HB1 ))
      2.900     2.900     3.100 peak   294 spectrum    1 weight  0.11000E+01 volume  0.12022E-01 ppm1      4.139 ppm2      1.962 CV     1
 ASSI {  295}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HG2 ))
      2.600     0.900     0.900 peak   295 spectrum    1 weight  0.11000E+01 volume  0.45149E-02 ppm1      4.140 ppm2      1.671 CV     1
 ASSI {  296}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HG1 ))
      3.100     1.200     1.200 peak   296 spectrum    1 weight  0.11000E+01 volume  0.21171E-02 ppm1      4.140 ppm2      1.436 CV     1
 ASSI {  300}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 77   and name HG1%)
      4.400     2.400     1.600 peak   300 spectrum    1 weight  0.11000E+01 volume  0.21866E-03 ppm1      4.077 ppm2      1.030 CV     1
 ASSI {  301}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB1 ))
      2.200     0.600     0.600 peak   301 spectrum    1 weight  0.11000E+01 volume  0.10186E-01 ppm1      3.990 ppm2      1.966 CV     1
 ASSI {  302}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 78   and name HG2 ))
      2.900     2.900     3.100 peak   302 spectrum    1 weight  0.11000E+01 volume  0.36704E-02 ppm1      3.989 ppm2      1.658 CV     1
 ASSI {  303}
   (( segid "    " and resid 74   and name HA  ))
   (  segid "    " and resid 77   and name HG1%)
      3.100     1.200     1.200 peak   303 spectrum    1 weight  0.11000E+01 volume  0.55785E-02 ppm1      3.990 ppm2      1.085 CV     1
 ASSI {  304}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HB1 ))
      2.300     0.600     0.600 peak   304 spectrum    1 weight  0.11000E+01 volume  0.75355E-02 ppm1      4.096 ppm2      1.980 CV     1
 ASSI {  307}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HD1 ))
      3.800     1.800     1.800 peak   307 spectrum    1 weight  0.11000E+01 volume  0.33403E-02 ppm1      3.883 ppm2      1.701 CV     1
 ASSI {  312}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB1 ))
      2.500     0.800     0.800 peak   312 spectrum    1 weight  0.11000E+01 volume  0.33405E-02 ppm1      3.930 ppm2      2.207 CV     1
 ASSI {  315}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HD1 ))
      4.000     2.000     2.000 peak   315 spectrum    1 weight  0.11000E+01 volume  0.21282E-02 ppm1      3.912 ppm2      1.694 CV     1
 ASSI {  320}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HG1 ))
      2.900     1.000     1.000 peak   320 spectrum    1 weight  0.11000E+01 volume  0.45471E-02 ppm1      3.835 ppm2      1.357 CV     1
 ASSI {  321}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
      2.000     0.500     0.500 peak   321 spectrum    1 weight  0.11000E+01 volume  0.60550E-02 ppm1      3.800 ppm2      2.005 CV     1
 ASSI {  324}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.500     1.500     1.500 peak   324 spectrum    1 weight  0.11000E+01 volume  0.17767E-02 ppm1      4.277 ppm2      1.130 CV     1
 ASSI {  326}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HG2 ))
      2.800     1.000     1.000 peak   326 spectrum    1 weight  0.11000E+01 volume  0.20966E-02 ppm1      4.141 ppm2      2.530 CV     1
 ASSI {  327}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HB1 ))
      2.000     0.500     0.500 peak   327 spectrum    1 weight  0.11000E+01 volume  0.15244E-01 ppm1      4.144 ppm2      2.169 CV     1
 ASSI {  328}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HG1 ))
      2.900     1.000     1.000 peak   328 spectrum    1 weight  0.11000E+01 volume  0.54985E-02 ppm1      4.086 ppm2      1.448 CV     1
 ASSI {  330}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HB2 ))
      2.800     1.000     1.000 peak   330 spectrum    1 weight  0.11000E+01 volume  0.25451E-02 ppm1      3.970 ppm2      1.916 CV     1
 ASSI {  331}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 126  and name HD1%)
      3.200     3.200     2.800 peak   331 spectrum    1 weight  0.11000E+01 volume  0.18644E-02 ppm1      3.971 ppm2      0.854 CV     1
 ASSI {  333}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HB1 ))
      2.700     0.900     0.900 peak   333 spectrum    1 weight  0.11000E+01 volume  0.32759E-02 ppm1      3.968 ppm2      1.068 CV     1
 ASSI {  335}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 113  and name HB  ))
      2.100     0.600     0.600 peak   335 spectrum    1 weight  0.11000E+01 volume  0.62940E-02 ppm1      3.767 ppm2      1.927 CV     1
 ASSI {  336}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 110  and name HB2 ))
      2.600     0.900     0.900 peak   336 spectrum    1 weight  0.11000E+01 volume  0.17327E-02 ppm1      3.761 ppm2      1.374 CV     1
 ASSI {  337}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
      2.400     0.700     0.700 peak   337 spectrum    1 weight  0.11000E+01 volume  0.13690E-01 ppm1      4.264 ppm2      2.013 CV     1
 ASSI {  338}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG1 ))
      2.500     0.800     0.800 peak   338 spectrum    1 weight  0.11000E+01 volume  0.50910E-02 ppm1      4.261 ppm2      2.202 CV     1
 ASSI {  341}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 72   and name HB% )
      2.100     0.500     0.500 peak   341 spectrum    1 weight  0.11000E+01 volume  0.10408E-01 ppm1      4.084 ppm2      1.774 CV     1
 ASSI {  343}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HB1 ))
      2.200     0.600     0.600 peak   343 spectrum    1 weight  0.11000E+01 volume  0.83979E-02 ppm1      4.281 ppm2      1.729 CV     1
 ASSI {  346}
   (( segid "    " and resid 107  and name HA  ))
   (  segid "    " and resid 107  and name HB% )
      2.400     0.700     0.700 peak   346 spectrum    1 weight  0.11000E+01 volume  0.32321E-02 ppm1      3.770 ppm2      1.810 CV     1
 ASSI {  347}
   (( segid "    " and resid 109  and name HA  ))
   (  segid "    " and resid 109  and name HB% )
      2.200     0.600     0.600 peak   347 spectrum    1 weight  0.11000E+01 volume  0.92844E-02 ppm1      3.634 ppm2      1.160 CV     1
 ASSI {  349}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HB1 ))
      3.800     1.800     1.800 peak   349 spectrum    1 weight  0.11000E+01 volume  0.21970E-02 ppm1      3.925 ppm2      1.723 CV     1
 ASSI {  350}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 124  and name HB% )
      2.100     0.500     0.500 peak   350 spectrum    1 weight  0.11000E+01 volume  0.13813E-01 ppm1      4.056 ppm2      1.379 CV     1
 ASSI {  351}
   (( segid "    " and resid 93   and name HA  ))
   (  segid "    " and resid 93   and name HB% )
      2.000     0.500     0.500 peak   351 spectrum    1 weight  0.11000E+01 volume  0.13606E-01 ppm1      4.104 ppm2      1.169 CV     1
 ASSI {  353}
   (( segid "    " and resid 93   and name HA  ))
   (  segid "    " and resid 112  and name HD1%)
      3.200     1.300     1.300 peak   353 spectrum    1 weight  0.11000E+01 volume  0.12977E-02 ppm1      4.088 ppm2      0.835 CV     1
 ASSI {  354}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HB2 ))
      2.700     0.900     0.900 peak   354 spectrum    1 weight  0.11000E+01 volume  0.21749E-02 ppm1      4.178 ppm2      1.535 CV     1
 ASSI {  356}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 92   and name HD2%)
      3.300     3.300     2.700 peak   356 spectrum    1 weight  0.11000E+01 volume  0.10838E-02 ppm1      4.177 ppm2      0.679 CV     1
 ASSI {  357}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
      2.700     0.900     0.900 peak   357 spectrum    1 weight  0.11000E+01 volume  0.41526E-02 ppm1      4.288 ppm2      1.332 CV     1
 ASSI {  361}
   (( segid "    " and resid 132  and name HD2 ))
   (  segid "    " and resid 126  and name HD1%)
      4.100     4.100     1.900 peak   361 spectrum    1 weight  0.11000E+01 volume  0.10191E-03 ppm1      4.283 ppm2      0.823 CV     1
 ASSI {  365}
   (( segid "    " and resid 127  and name HD2 ))
   (  segid "    " and resid 130  and name HD1%)
      3.300     1.400     1.400 peak   365 spectrum    1 weight  0.11000E+01 volume  0.10253E-02 ppm1      4.085 ppm2      0.766 CV     1
 ASSI {  367}
   (( segid "    " and resid 127  and name HD1 ))
   (( segid "    " and resid 130  and name HG  ))
      4.300     2.300     1.700 peak   367 spectrum    1 weight  0.11000E+01 volume  0.15904E-02 ppm1      3.479 ppm2      0.939 CV     1
 ASSI {  368}
   (( segid "    " and resid 127  and name HD1 ))
   (  segid "    " and resid 130  and name HD1%)
      3.500     1.500     1.500 peak   368 spectrum    1 weight  0.11000E+01 volume  0.26031E-02 ppm1      3.477 ppm2      0.781 CV     1
 ASSI {  370}
   (( segid "    " and resid 132  and name HD1 ))
   (  segid "    " and resid 95   and name HG2%)
      4.100     2.100     1.900 peak   370 spectrum    1 weight  0.11000E+01 volume  0.89852E-03 ppm1      3.236 ppm2      1.012 CV     1
 ASSI {  372}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 125  and name HB1 ))
      3.500     3.500     2.500 peak   372 spectrum    1 weight  0.11000E+01 volume  0.24671E-03 ppm1      4.093 ppm2      2.314 CV     1
 ASSI {  373}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 130  and name HG  ))
      3.300     1.400     1.400 peak   373 spectrum    1 weight  0.11000E+01 volume  0.20161E-02 ppm1      4.082 ppm2      0.937 CV     1
 ASSI {  376}
   (( segid "    " and resid 82   and name HD2 ))
   (  segid "    " and resid 85   and name HG2%)
      2.700     0.900     0.900 peak   376 spectrum    1 weight  0.11000E+01 volume  0.21716E-02 ppm1      3.963 ppm2      1.066 CV     1
 ASSI {  377}
   (( segid "    " and resid 82   and name HD2 ))
   (  segid "    " and resid 81   and name HD2%)
      2.900     1.100     1.100 peak   377 spectrum    1 weight  0.11000E+01 volume  0.46040E-02 ppm1      3.961 ppm2      0.918 CV     1
 ASSI {  378}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HG2 ))
      1.800     0.400     0.400 peak   378 spectrum    1 weight  0.11000E+01 volume  0.96062E-02 ppm1      3.950 ppm2      2.119 CV     1
 ASSI {  380}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name HG2 ))
      2.200     0.600     0.600 peak   380 spectrum    1 weight  0.11000E+01 volume  0.55458E-02 ppm1      3.895 ppm2      2.202 CV     1
 ASSI {  381}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name HB2 ))
      3.400     1.400     1.400 peak   381 spectrum    1 weight  0.11000E+01 volume  0.25731E-02 ppm1      3.891 ppm2      2.460 CV     1
 ASSI {  383}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 127  and name HB1 ))
      2.300     0.700     0.700 peak   383 spectrum    1 weight  0.11000E+01 volume  0.50654E-02 ppm1      3.877 ppm2      1.920 CV     1
 ASSI {  386}
   (( segid "    " and resid 51   and name HD2 ))
   (( segid "    " and resid 51   and name HB2 ))
      4.200     2.200     1.800 peak   386 spectrum    1 weight  0.11000E+01 volume  0.55053E-03 ppm1      3.751 ppm2      2.361 CV     1
 ASSI {  387}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HG2 ))
      2.400     0.700     0.700 peak   387 spectrum    1 weight  0.11000E+01 volume  0.28762E-02 ppm1      3.429 ppm2      1.868 CV     1
 ASSI {  388}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HG1 ))
      3.100     1.200     1.200 peak   388 spectrum    1 weight  0.11000E+01 volume  0.21086E-02 ppm1      3.435 ppm2      1.237 CV     1
 ASSI {  389}
   (( segid "    " and resid 128  and name HD1 ))
   (( segid "    " and resid 128  and name HG1 ))
      2.600     0.800     0.800 peak   389 spectrum    1 weight  0.11000E+01 volume  0.21820E-02 ppm1      3.384 ppm2      2.124 CV     1
 ASSI {  390}
   (( segid "    " and resid 82   and name HD1 ))
   (( segid "    " and resid 82   and name HG1 ))
      2.100     0.600     0.600 peak   390 spectrum    1 weight  0.11000E+01 volume  0.51362E-02 ppm1      3.340 ppm2      2.122 CV     1
 ASSI {  391}
   (( segid "    " and resid 82   and name HD1 ))
   (( segid "    " and resid 81   and name HB1 ))
      2.900     1.100     1.100 peak   391 spectrum    1 weight  0.11000E+01 volume  0.32113E-02 ppm1      3.340 ppm2      1.068 CV     1
 ASSI {  392}
   (( segid "    " and resid 82   and name HD1 ))
   (  segid "    " and resid 81   and name HD2%)
      3.200     1.300     1.300 peak   392 spectrum    1 weight  0.11000E+01 volume  0.40024E-02 ppm1      3.339 ppm2      0.925 CV     1
 ASSI {  393}
   (( segid "    " and resid 51   and name HD2 ))
   (( segid "    " and resid 50   and name HB2 ))
      4.400     2.400     1.600 peak   393 spectrum    1 weight  0.11000E+01 volume  0.96418E-03 ppm1      3.744 ppm2      2.291 CV     1
 ASSI {  400}
   (  segid "    " and resid 56   and name HD1%)
   (( segid "    " and resid 53   and name HB2 ))
      6.000     6.000     0.000 peak   400 spectrum    1 weight  0.11000E+01 volume  0.52634E-04 ppm1      1.047 ppm2      3.226 CV     1
 ASSI {  402}
   (  segid "    " and resid 56   and name HD1%)
   (( segid "    " and resid 56   and name HB  ))
      2.600     0.900     0.900 peak   402 spectrum    1 weight  0.11000E+01 volume  0.32785E-02 ppm1      1.051 ppm2      2.393 CV     1
 ASSI {  403}
   (  segid "    " and resid 56   and name HD1%)
   (( segid "    " and resid 56   and name HG12))
      2.300     0.700     0.700 peak   403 spectrum    1 weight  0.11000E+01 volume  0.53781E-02 ppm1      1.048 ppm2      1.906 CV     1
 ASSI {  404}
   (  segid "    " and resid 56   and name HD1%)
   (( segid "    " and resid 56   and name HG11))
      2.500     0.800     0.800 peak   404 spectrum    1 weight  0.11000E+01 volume  0.35515E-02 ppm1      1.048 ppm2      1.334 CV     1
 ASSI {  406}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 39   and name HA  ))
      3.800     1.800     1.800 peak   406 spectrum    1 weight  0.11000E+01 volume  0.20057E-02 ppm1      0.778 ppm2      4.117 CV     1
 ASSI {  407}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 36   and name HA2 ))
      2.500     2.500     3.500 peak   407 spectrum    1 weight  0.11000E+01 volume  0.18847E-02 ppm1      0.777 ppm2      3.903 CV     1
 ASSI {  409}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 39   and name HB  ))
      3.000     1.100     1.100 peak   409 spectrum    1 weight  0.11000E+01 volume  0.33588E-02 ppm1      0.782 ppm2      1.807 CV     1
 ASSI {  411}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 76   and name HG2 ))
      5.200     3.400     0.800 peak   411 spectrum    1 weight  0.11000E+01 volume  0.12096E-03 ppm1      0.789 ppm2      2.968 CV     1
 ASSI {  412}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 110  and name HA  ))
      3.000     1.100     1.100 peak   412 spectrum    1 weight  0.11000E+01 volume  0.10978E-02 ppm1      0.785 ppm2      3.791 CV     1
 ASSI {  417}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 116  and name HN  ))
      5.300     3.500     0.700 peak   417 spectrum    1 weight  0.11000E+01 volume  0.11504E-03 ppm1      0.646 ppm2      7.852 CV     1
 ASSI {  418}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 115  and name HN  ))
      4.100     4.100     1.900 peak   418 spectrum    1 weight  0.11000E+01 volume  0.82799E-03 ppm1      0.648 ppm2      8.062 CV     1
 ASSI {  419}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 113  and name HN  ))
      3.900     1.900     1.900 peak   419 spectrum    1 weight  0.11000E+01 volume  0.63836E-03 ppm1      0.644 ppm2      7.694 CV     1
 ASSI {  421}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 116  and name HE2 ))
      6.000     5.400     0.000 peak   421 spectrum    1 weight  0.11000E+01 volume  0.30762E-04 ppm1      0.643 ppm2      2.964 CV     1
 ASSI {  422}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 113  and name HA  ))
      2.900     1.000     1.000 peak   422 spectrum    1 weight  0.11000E+01 volume  0.20303E-02 ppm1      0.644 ppm2      3.288 CV     1
 ASSI {  425}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 81   and name HG  ))
      3.200     3.200     2.800 peak   425 spectrum    1 weight  0.11000E+01 volume  0.44986E-03 ppm1      0.769 ppm2      1.549 CV     1
 ASSI {  426}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 116  and name HD2 ))
      3.500     1.600     1.600 peak   426 spectrum    1 weight  0.11000E+01 volume  0.74430E-03 ppm1      0.641 ppm2      1.700 CV     1
 ASSI {  427}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 116  and name HG2 ))
      3.700     1.700     1.700 peak   427 spectrum    1 weight  0.11000E+01 volume  0.66645E-03 ppm1      0.644 ppm2      1.509 CV     1
 ASSI {  428}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 116  and name HB2 ))
      2.400     2.400     3.600 peak   428 spectrum    1 weight  0.11000E+01 volume  0.96346E-02 ppm1      0.640 ppm2      2.111 CV     1
 ASSI {  429}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 89   and name HG12))
      2.100     0.600     0.600 peak   429 spectrum    1 weight  0.11000E+01 volume  0.10716E-01 ppm1      0.644 ppm2      1.907 CV     1
 ASSI {  430}
   (  segid "    " and resid 67   and name HD1%)
   (  segid "    " and resid 106  and name HD% )
      2.400     0.700     0.700 peak   430 spectrum    1 weight  0.11000E+01 volume  0.18978E-02 ppm1      0.436 ppm2      7.447 CV     1
 ASSI {  432}
   (  segid "    " and resid 67   and name HD1%)
   (  segid "    " and resid 106  and name HE% )
      6.000     4.900     0.000 peak   432 spectrum    1 weight  0.11000E+01 volume  0.28495E-04 ppm1      0.437 ppm2      5.913 CV     1
 ASSI {  433}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 106  and name HB2 ))
      2.900     1.100     1.100 peak   433 spectrum    1 weight  0.11000E+01 volume  0.65320E-03 ppm1      0.437 ppm2      3.209 CV     1
 ASSI {  434}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 106  and name HB1 ))
      4.600     2.600     1.400 peak   434 spectrum    1 weight  0.11000E+01 volume  0.74416E-03 ppm1      0.438 ppm2      3.061 CV     1
 ASSI {  435}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 71   and name HB2 ))
      4.300     2.300     1.700 peak   435 spectrum    1 weight  0.11000E+01 volume  0.28510E-03 ppm1      0.439 ppm2      2.859 CV     1
 ASSI {  440}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 57   and name HN  ))
      6.000     6.000     0.000 peak   440 spectrum    1 weight  0.11000E+01 volume  0.63556E-04 ppm1      0.434 ppm2      9.141 CV     1
 ASSI {  444}
   (  segid "    " and resid 67   and name HD1%)
   (  segid "    " and resid 67   and name HG2%)
      2.200     2.200     3.800 peak   444 spectrum    1 weight  0.11000E+01 volume  0.48631E-02 ppm1      0.437 ppm2     -0.044 CV     1
 ASSI {  445}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 113  and name HN  ))
      4.100     2.100     1.900 peak   445 spectrum    1 weight  0.11000E+01 volume  0.72643E-03 ppm1      1.170 ppm2      7.633 CV     1
 ASSI {  446}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 110  and name HN  ))
      3.400     1.400     1.400 peak   446 spectrum    1 weight  0.11000E+01 volume  0.55645E-03 ppm1      1.167 ppm2      7.124 CV     1
 ASSI {  449}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 108  and name HA  ))
      4.100     2.100     1.900 peak   449 spectrum    1 weight  0.11000E+01 volume  0.14091E-02 ppm1      1.167 ppm2      4.045 CV     1
 ASSI {  450}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 76   and name HG2 ))
      4.100     4.100     1.900 peak   450 spectrum    1 weight  0.11000E+01 volume  0.25307E-03 ppm1      1.166 ppm2      2.974 CV     1
 ASSI {  452}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 106  and name HB2 ))
      4.400     2.400     1.600 peak   452 spectrum    1 weight  0.11000E+01 volume  0.68972E-04 ppm1      1.161 ppm2      3.230 CV     1
 ASSI {  453}
   (  segid "    " and resid 109  and name HB% )
   (  segid "    " and resid 76   and name HE% )
      2.800     2.800     3.200 peak   453 spectrum    1 weight  0.11000E+01 volume  0.23801E-02 ppm1      1.169 ppm2      2.089 CV     1
 ASSI {  454}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 113  and name HB  ))
      4.500     4.500     1.500 peak   454 spectrum    1 weight  0.11000E+01 volume  0.68022E-03 ppm1      1.165 ppm2      1.891 CV     1
 ASSI {  455}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 108  and name HB2 ))
      6.000     6.000     0.000 peak   455 spectrum    1 weight  0.11000E+01 volume  0.60699E-04 ppm1      1.163 ppm2      2.578 CV     1
 ASSI {  456}
   (  segid "    " and resid 109  and name HB% )
   (  segid "    " and resid 101  and name HD1%)
      2.100     2.100     3.900 peak   456 spectrum    1 weight  0.11000E+01 volume  0.10789E-01 ppm1      1.165 ppm2      0.823 CV     1
 ASSI {  457}
   (  segid "    " and resid 109  and name HB% )
   (  segid "    " and resid 67   and name HD1%)
      3.400     3.400     2.600 peak   457 spectrum    1 weight  0.11000E+01 volume  0.32728E-03 ppm1      1.163 ppm2      0.454 CV     1
 ASSI {  458}
   (  segid "    " and resid 109  and name HB% )
   (  segid "    " and resid 101  and name HD2%)
      3.700     1.700     1.700 peak   458 spectrum    1 weight  0.11000E+01 volume  0.71496E-03 ppm1      1.170 ppm2      0.074 CV     1
 ASSI {  459}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 72   and name HA  ))
      4.100     2.100     1.900 peak   459 spectrum    1 weight  0.11000E+01 volume  0.59413E-03 ppm1      2.091 ppm2      4.139 CV     1
 ASSI {  462}
   (  segid "    " and resid 23   and name HE% )
   (( segid "    " and resid 23   and name HA  ))
      5.000     3.100     1.000 peak   462 spectrum    1 weight  0.11000E+01 volume  0.30261E-04 ppm1      2.099 ppm2      4.564 CV     1
 ASSI {  463}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 90   and name HB1 ))
      4.400     2.400     1.600 peak   463 spectrum    1 weight  0.11000E+01 volume  0.11858E-02 ppm1      2.089 ppm2      3.323 CV     1
 ASSI {  464}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 109  and name HA  ))
      4.900     2.900     1.100 peak   464 spectrum    1 weight  0.11000E+01 volume  0.15145E-03 ppm1      2.092 ppm2      3.625 CV     1
 ASSI {  465}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 90   and name HZ3 ))
      4.800     2.800     1.200 peak   465 spectrum    1 weight  0.11000E+01 volume  0.23182E-03 ppm1      2.092 ppm2      6.830 CV     1
 ASSI {  467}
   (  segid "    " and resid 76   and name HE% )
   (  segid "    " and resid 113  and name HG2%)
      3.000     3.000     3.000 peak   467 spectrum    1 weight  0.11000E+01 volume  0.18955E-01 ppm1      2.091 ppm2      0.901 CV     1
 ASSI {  469}
   (  segid "    " and resid 76   and name HE% )
   (  segid "    " and resid 101  and name HD2%)
      4.500     4.500     1.500 peak   469 spectrum    1 weight  0.11000E+01 volume  0.37564E-03 ppm1      2.092 ppm2      0.049 CV     1
 ASSI {  470}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 76   and name HG2 ))
      4.000     2.000     2.000 peak   470 spectrum    1 weight  0.11000E+01 volume  0.15707E-03 ppm1      2.092 ppm2      2.960 CV     1
 ASSI {  471}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 89   and name HN  ))
      6.000     6.000     0.000 peak   471 spectrum    1 weight  0.11000E+01 volume  0.21283E-04 ppm1      2.092 ppm2      8.168 CV     1
 ASSI {  472}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 93   and name HN  ))
      6.000     6.000     0.000 peak   472 spectrum    1 weight  0.11000E+01 volume  0.19988E-04 ppm1      2.091 ppm2      8.065 CV     1
 ASSI {  477}
   (  segid "    " and resid 67   and name HG2%)
   (  segid "    " and resid 106  and name HD% )
      4.400     2.400     1.600 peak   477 spectrum    1 weight  0.11000E+01 volume  0.42313E-03 ppm1     -0.038 ppm2      7.432 CV     1
 ASSI {  480}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 101  and name HN  ))
      5.300     3.500     0.700 peak   480 spectrum    1 weight  0.11000E+01 volume  0.33134E-03 ppm1     -0.039 ppm2      8.689 CV     1
 ASSI {  481}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 72   and name HN  ))
      4.700     2.700     1.300 peak   481 spectrum    1 weight  0.11000E+01 volume  0.39425E-03 ppm1     -0.040 ppm2      8.843 CV     1
 ASSI {  484}
   (  segid "    " and resid 67   and name HG2%)
   (  segid "    " and resid 106  and name HE% )
      6.000     5.700     0.000 peak   484 spectrum    1 weight  0.11000E+01 volume  0.26582E-04 ppm1     -0.038 ppm2      5.910 CV     1
 ASSI {  487}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 71   and name HB1 ))
      4.700     2.800     1.300 peak   487 spectrum    1 weight  0.11000E+01 volume  0.17427E-03 ppm1     -0.040 ppm2      2.539 CV     1
 ASSI {  488}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 71   and name HB2 ))
      4.200     2.200     1.800 peak   488 spectrum    1 weight  0.11000E+01 volume  0.23791E-03 ppm1     -0.040 ppm2      2.844 CV     1
 ASSI {  489}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 57   and name HA  ))
      3.300     1.400     1.400 peak   489 spectrum    1 weight  0.11000E+01 volume  0.10098E-02 ppm1     -0.039 ppm2      3.090 CV     1
 ASSI {  490}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 62   and name HD2 ))
      3.500     3.500     2.500 peak   490 spectrum    1 weight  0.11000E+01 volume  0.24085E-03 ppm1     -0.040 ppm2      3.431 CV     1
 ASSI {  491}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 58   and name HA  ))
      3.600     3.600     2.400 peak   491 spectrum    1 weight  0.11000E+01 volume  0.20777E-03 ppm1     -0.043 ppm2      3.991 CV     1
 ASSI {  492}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 67   and name HB  ))
      2.300     0.600     0.600 peak   492 spectrum    1 weight  0.11000E+01 volume  0.53169E-02 ppm1     -0.039 ppm2      1.791 CV     1
 ASSI {  500}
   (  segid "    " and resid 56   and name HG2%)
   (  segid "    " and resid 106  and name HE% )
      4.200     2.200     1.800 peak   500 spectrum    1 weight  0.11000E+01 volume  0.32902E-03 ppm1      1.091 ppm2      6.005 CV     1
 ASSI {  501}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 57   and name HA  ))
      4.100     2.100     1.900 peak   501 spectrum    1 weight  0.11000E+01 volume  0.57491E-03 ppm1      1.099 ppm2      3.063 CV     1
 ASSI {  503}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 56   and name HA  ))
      2.300     0.700     0.700 peak   503 spectrum    1 weight  0.11000E+01 volume  0.51555E-02 ppm1      1.100 ppm2      3.928 CV     1
 ASSI {  505}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 56   and name HB  ))
      2.200     0.600     0.600 peak   505 spectrum    1 weight  0.11000E+01 volume  0.64698E-02 ppm1      1.100 ppm2      2.391 CV     1
 ASSI {  506}
   (  segid "    " and resid 56   and name HD1%)
   (( segid "    " and resid 55   and name HB1 ))
      2.600     2.600     3.400 peak   506 spectrum    1 weight  0.11000E+01 volume  0.16175E-02 ppm1      1.098 ppm2      2.198 CV     1
 ASSI {  508}
   (  segid "    " and resid 56   and name HG2%)
   (  segid "    " and resid 60   and name HD2%)
      3.600     1.600     1.600 peak   508 spectrum    1 weight  0.11000E+01 volume  0.13003E-02 ppm1      1.100 ppm2      0.680 CV     1
 ASSI {  509}
   (  segid "    " and resid 56   and name HG2%)
   (  segid "    " and resid 60   and name HD1%)
      2.800     2.800     3.200 peak   509 spectrum    1 weight  0.11000E+01 volume  0.35996E-02 ppm1      1.100 ppm2      0.465 CV     1
 ASSI {  511}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 36   and name HA1 ))
      2.800     2.800     3.200 peak   511 spectrum    1 weight  0.11000E+01 volume  0.93629E-03 ppm1      0.830 ppm2      3.912 CV     1
 ASSI {  512}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 114  and name HN  ))
      3.700     1.700     1.700 peak   512 spectrum    1 weight  0.11000E+01 volume  0.88156E-03 ppm1      0.889 ppm2      7.469 CV     1
 ASSI {  513}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 113  and name HN  ))
      4.100     2.100     1.900 peak   513 spectrum    1 weight  0.11000E+01 volume  0.15312E-02 ppm1      0.893 ppm2      7.675 CV     1
 ASSI {  514}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 116  and name HN  ))
      3.900     1.900     1.900 peak   514 spectrum    1 weight  0.11000E+01 volume  0.94265E-03 ppm1      0.892 ppm2      7.858 CV     1
 ASSI {  515}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 86   and name HN  ))
      2.800     2.800     3.200 peak   515 spectrum    1 weight  0.11000E+01 volume  0.10197E-02 ppm1      0.896 ppm2      8.052 CV     1
 ASSI {  517}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 90   and name HN  ))
      4.300     2.400     1.700 peak   517 spectrum    1 weight  0.11000E+01 volume  0.27906E-03 ppm1      0.900 ppm2      8.683 CV     1
 ASSI {  520}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 40   and name HN  ))
      5.200     3.400     0.800 peak   520 spectrum    1 weight  0.11000E+01 volume  0.18216E-03 ppm1      0.831 ppm2      8.291 CV     1
 ASSI {  522}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 108  and name HG  ))
      3.600     3.600     2.400 peak   522 spectrum    1 weight  0.11000E+01 volume  0.22540E-02 ppm1      1.818 ppm2      1.489 CV     1
 ASSI {  523}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 104  and name HB2 ))
      3.300     3.300     2.700 peak   523 spectrum    1 weight  0.11000E+01 volume  0.35510E-03 ppm1      1.817 ppm2      2.273 CV     1
 ASSI {  524}
   (  segid "    " and resid 107  and name HB% )
   (  segid "    " and resid 108  and name HD2%)
      4.700     4.700     1.300 peak   524 spectrum    1 weight  0.11000E+01 volume  0.59967E-03 ppm1      1.816 ppm2      1.128 CV     1
 ASSI {  526}
   (  segid "    " and resid 107  and name HB% )
   (  segid "    " and resid 46   and name HG1%)
      4.200     2.200     1.800 peak   526 spectrum    1 weight  0.11000E+01 volume  0.22499E-03 ppm1      1.817 ppm2     -0.203 CV     1
 ASSI {  527}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 53   and name HB1 ))
      3.800     1.800     1.800 peak   527 spectrum    1 weight  0.11000E+01 volume  0.20587E-02 ppm1      1.817 ppm2      3.156 CV     1
 ASSI {  528}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 104  and name HG2 ))
      4.800     2.900     1.200 peak   528 spectrum    1 weight  0.11000E+01 volume  0.28445E-03 ppm1      1.818 ppm2      2.536 CV     1
 ASSI {  529}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 103  and name HA  ))
      3.100     3.100     2.900 peak   529 spectrum    1 weight  0.11000E+01 volume  0.58628E-03 ppm1      1.817 ppm2      2.806 CV     1
 ASSI {  531}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 108  and name HN  ))
      3.600     1.600     1.600 peak   531 spectrum    1 weight  0.11000E+01 volume  0.45053E-03 ppm1      1.823 ppm2      8.480 CV     1
 ASSI {  533}
   (  segid "    " and resid 70   and name HB% )
   (( segid "    " and resid 68   and name HB  ))
      4.800     2.900     1.200 peak   533 spectrum    1 weight  0.11000E+01 volume  0.16941E-03 ppm1      1.295 ppm2      4.725 CV     1
 ASSI {  535}
   (  segid "    " and resid 70   and name HB% )
   (( segid "    " and resid 74   and name HE2 ))
      5.600     3.900     0.400 peak   535 spectrum    1 weight  0.11000E+01 volume  0.92285E-04 ppm1      1.296 ppm2      2.934 CV     1
 ASSI {  539}
   (  segid "    " and resid 124  and name HB% )
   (( segid "    " and resid 123  and name HA  ))
      3.700     1.700     1.700 peak   539 spectrum    1 weight  0.11000E+01 volume  0.10677E-02 ppm1      1.382 ppm2      4.531 CV     1
 ASSI {  540}
   (  segid "    " and resid 124  and name HB% )
   (( segid "    " and resid 123  and name HB2 ))
      3.200     3.200     2.800 peak   540 spectrum    1 weight  0.11000E+01 volume  0.25797E-02 ppm1      1.378 ppm2      2.323 CV     1
 ASSI {  541}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 94   and name HN  ))
      2.900     1.000     1.000 peak   541 spectrum    1 weight  0.11000E+01 volume  0.25330E-02 ppm1      1.155 ppm2      7.330 CV     1
 ASSI {  542}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 91   and name HN  ))
      3.800     3.800     2.200 peak   542 spectrum    1 weight  0.11000E+01 volume  0.12186E-02 ppm1      1.149 ppm2      7.481 CV     1
 ASSI {  543}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 108  and name HN  ))
      4.900     4.900     1.100 peak   543 spectrum    1 weight  0.11000E+01 volume  0.45521E-03 ppm1      1.149 ppm2      8.527 CV     1
 ASSI {  547}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 108  and name HB2 ))
      4.800     2.900     1.200 peak   547 spectrum    1 weight  0.11000E+01 volume  0.56888E-03 ppm1      1.152 ppm2      2.545 CV     1
 ASSI {  548}
   (  segid "    " and resid 77   and name HG1%)
   (( segid "    " and resid 76   and name HN  ))
      6.000     6.000     0.000 peak   548 spectrum    1 weight  0.11000E+01 volume  0.24241E-03 ppm1      1.048 ppm2      8.428 CV     1
 ASSI {  550}
   (  segid "    " and resid 77   and name HG1%)
   (( segid "    " and resid 77   and name HB  ))
      3.300     1.400     1.400 peak   550 spectrum    1 weight  0.11000E+01 volume  0.66433E-03 ppm1      1.049 ppm2      2.297 CV     1
 ASSI {  551}
   (  segid "    " and resid 77   and name HG1%)
   (( segid "    " and resid 77   and name HA  ))
      3.500     1.500     1.500 peak   551 spectrum    1 weight  0.11000E+01 volume  0.93465E-03 ppm1      1.051 ppm2      4.005 CV     1
 ASSI {  552}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 92   and name HB2 ))
      6.000     4.700     0.000 peak   552 spectrum    1 weight  0.11000E+01 volume  0.12758E-03 ppm1      1.152 ppm2      1.938 CV     1
 ASSI {  553}
   (  segid "    " and resid 93   and name HB% )
   (  segid "    " and resid 101  and name HD1%)
      3.300     3.300     2.700 peak   553 spectrum    1 weight  0.11000E+01 volume  0.10207E-02 ppm1      1.162 ppm2      0.813 CV     1
 ASSI {  554}
   (  segid "    " and resid 93   and name HB% )
   (  segid "    " and resid 130  and name HD2%)
      6.000     6.000     0.000 peak   554 spectrum    1 weight  0.11000E+01 volume  0.52870E-04 ppm1      1.158 ppm2      0.562 CV     1
 ASSI {  555}
   (  segid "    " and resid 93   and name HB% )
   (  segid "    " and resid 101  and name HD2%)
      3.000     3.000     3.000 peak   555 spectrum    1 weight  0.11000E+01 volume  0.16983E-02 ppm1      1.154 ppm2      0.063 CV     1
 ASSI {  561}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 76   and name HG1 ))
      4.600     2.700     1.400 peak   561 spectrum    1 weight  0.11000E+01 volume  0.41865E-03 ppm1      1.779 ppm2      2.984 CV     1
 ASSI {  562}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 101  and name HG  ))
      3.900     1.900     1.900 peak   562 spectrum    1 weight  0.11000E+01 volume  0.76849E-03 ppm1      1.781 ppm2      1.539 CV     1
 ASSI {  565}
   (  segid "    " and resid 72   and name HB% )
   (  segid "    " and resid 101  and name HD1%)
      2.500     2.500     3.500 peak   565 spectrum    1 weight  0.11000E+01 volume  0.47618E-02 ppm1      1.774 ppm2      0.827 CV     1
 ASSI {  566}
   (  segid "    " and resid 72   and name HB% )
   (  segid "    " and resid 67   and name HD1%)
      2.300     2.300     3.700 peak   566 spectrum    1 weight  0.11000E+01 volume  0.43275E-02 ppm1      1.775 ppm2      0.438 CV     1
 ASSI {  567}
   (  segid "    " and resid 72   and name HB% )
   (  segid "    " and resid 101  and name HD2%)
      3.900     1.900     1.900 peak   567 spectrum    1 weight  0.11000E+01 volume  0.13509E-02 ppm1      1.777 ppm2      0.020 CV     1
 ASSI {  568}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 43   and name HN  ))
      5.800     4.200     0.200 peak   568 spectrum    1 weight  0.11000E+01 volume  0.11536E-03 ppm1      0.893 ppm2      8.435 CV     1
 ASSI {  570}
   (  segid "    " and resid 131  and name HG1%)
   (( segid "    " and resid 130  and name HN  ))
      4.600     2.600     1.400 peak   570 spectrum    1 weight  0.11000E+01 volume  0.69699E-03 ppm1      0.800 ppm2      7.784 CV     1
 ASSI {  572}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 65   and name HN  ))
      5.600     5.600     0.400 peak   572 spectrum    1 weight  0.11000E+01 volume  0.21610E-03 ppm1      0.906 ppm2      8.838 CV     1
 ASSI {  573}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 66   and name HE1 ))
      6.000     6.000     0.000 peak   573 spectrum    1 weight  0.11000E+01 volume  0.51338E-04 ppm1      0.906 ppm2      3.103 CV     1
 ASSI {  574}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 64   and name HB1 ))
      4.400     2.400     1.600 peak   574 spectrum    1 weight  0.11000E+01 volume  0.87660E-03 ppm1      0.910 ppm2      2.809 CV     1
 ASSI {  575}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 42   and name HB  ))
      2.500     0.800     0.800 peak   575 spectrum    1 weight  0.11000E+01 volume  0.59673E-02 ppm1      0.894 ppm2      2.092 CV     1
 ASSI {  577}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 115  and name HN  ))
      5.100     5.100     0.900 peak   577 spectrum    1 weight  0.11000E+01 volume  0.37741E-03 ppm1      0.730 ppm2      8.008 CV     1
 ASSI {  578}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 111  and name HN  ))
      4.900     4.900     1.100 peak   578 spectrum    1 weight  0.11000E+01 volume  0.76116E-03 ppm1      0.726 ppm2      8.368 CV     1
 ASSI {  580}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 108  and name HA  ))
      2.800     2.800     3.200 peak   580 spectrum    1 weight  0.11000E+01 volume  0.91986E-03 ppm1      0.726 ppm2      4.064 CV     1
 ASSI {  581}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 111  and name HB2 ))
      3.100     3.100     2.900 peak   581 spectrum    1 weight  0.11000E+01 volume  0.59143E-03 ppm1      0.725 ppm2      3.307 CV     1
 ASSI {  582}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 112  and name HG  ))
      2.000     0.500     0.500 peak   582 spectrum    1 weight  0.11000E+01 volume  0.12140E-01 ppm1      0.724 ppm2      1.975 CV     1
 ASSI {  584}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 112  and name HB1 ))
      2.600     0.900     0.900 peak   584 spectrum    1 weight  0.11000E+01 volume  0.31902E-02 ppm1      0.725 ppm2      1.138 CV     1
 ASSI {  587}
   (  segid "    " and resid 59   and name HG2%)
   (( segid "    " and resid 60   and name HN  ))
      4.100     2.100     1.900 peak   587 spectrum    1 weight  0.11000E+01 volume  0.56281E-03 ppm1      1.445 ppm2      7.399 CV     1
 ASSI {  590}
   (  segid "    " and resid 59   and name HG2%)
   (  segid "    " and resid 60   and name HD2%)
      4.300     2.300     1.700 peak   590 spectrum    1 weight  0.11000E+01 volume  0.27347E-03 ppm1      1.438 ppm2      0.710 CV     1
 ASSI {  591}
   (  segid "    " and resid 59   and name HG2%)
   (  segid "    " and resid 60   and name HD1%)
      4.700     4.700     1.300 peak   591 spectrum    1 weight  0.11000E+01 volume  0.79691E-03 ppm1      1.444 ppm2      0.463 CV     1
 ASSI {  593}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 90   and name HE3 ))
      4.000     2.000     2.000 peak   593 spectrum    1 weight  0.11000E+01 volume  0.51285E-03 ppm1      0.070 ppm2      7.319 CV     1
 ASSI {  594}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 97   and name HN  ))
      5.500     5.500     0.500 peak   594 spectrum    1 weight  0.11000E+01 volume  0.17662E-04 ppm1      0.068 ppm2      7.488 CV     1
 ASSI {  597}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 105  and name HN  ))
      6.000     5.400     0.000 peak   597 spectrum    1 weight  0.11000E+01 volume  0.24168E-03 ppm1      0.069 ppm2      8.799 CV     1
 ASSI {  603}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 105  and name HA  ))
      4.700     2.800     1.300 peak   603 spectrum    1 weight  0.11000E+01 volume  0.54181E-03 ppm1      0.071 ppm2      4.017 CV     1
 ASSI {  604}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 105  and name HG2 ))
      4.400     2.400     1.600 peak   604 spectrum    1 weight  0.11000E+01 volume  0.96968E-04 ppm1      0.068 ppm2      2.910 CV     1
 ASSI {  605}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 105  and name HB2 ))
      3.700     1.800     1.800 peak   605 spectrum    1 weight  0.11000E+01 volume  0.20950E-02 ppm1      0.070 ppm2      2.485 CV     1
 ASSI {  606}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 94   and name HB2 ))
      2.400     0.700     0.700 peak   606 spectrum    1 weight  0.11000E+01 volume  0.32972E-02 ppm1      0.069 ppm2      2.227 CV     1
 ASSI {  607}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 101  and name HB2 ))
      3.400     1.400     1.400 peak   607 spectrum    1 weight  0.11000E+01 volume  0.17455E-02 ppm1      0.069 ppm2      1.832 CV     1
 ASSI {  608}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 101  and name HG  ))
      2.300     0.700     0.700 peak   608 spectrum    1 weight  0.11000E+01 volume  0.47957E-02 ppm1      0.070 ppm2      1.573 CV     1
 ASSI {  609}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 94   and name HB1 ))
      3.500     1.600     1.600 peak   609 spectrum    1 weight  0.11000E+01 volume  0.42236E-02 ppm1      0.069 ppm2      1.171 CV     1
 ASSI {  615}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 68   and name HB  ))
      3.700     1.700     1.700 peak   615 spectrum    1 weight  0.11000E+01 volume  0.55313E-03 ppm1      1.333 ppm2      4.729 CV     1
 ASSI {  622}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 86   and name HA  ))
      3.000     1.100     1.100 peak   622 spectrum    1 weight  0.11000E+01 volume  0.23578E-02 ppm1      0.981 ppm2      3.883 CV     1
 ASSI {  623}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 84   and name HB  ))
      3.500     3.500     2.500 peak   623 spectrum    1 weight  0.11000E+01 volume  0.39931E-02 ppm1      0.977 ppm2      4.198 CV     1
 ASSI {  624}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 132  and name HD2 ))
      3.400     1.400     1.400 peak   624 spectrum    1 weight  0.11000E+01 volume  0.82726E-03 ppm1      1.044 ppm2      4.271 CV     1
 ASSI {  626}
   (  segid "    " and resid 131  and name HG2%)
   (( segid "    " and resid 44   and name HE3 ))
      4.700     4.700     1.300 peak   626 spectrum    1 weight  0.11000E+01 volume  0.41960E-03 ppm1      0.977 ppm2      7.640 CV     1
 ASSI {  627}
   (  segid "    " and resid 131  and name HG2%)
   (( segid "    " and resid 130  and name HN  ))
      4.700     2.700     1.300 peak   627 spectrum    1 weight  0.11000E+01 volume  0.52716E-03 ppm1      0.977 ppm2      7.794 CV     1
 ASSI {  628}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 86   and name HN  ))
      4.500     2.500     1.500 peak   628 spectrum    1 weight  0.11000E+01 volume  0.30741E-03 ppm1      0.983 ppm2      8.035 CV     1
 ASSI {  629}
   (  segid "    " and resid 95   and name HG2%)
   (  segid "    " and resid 135  and name HZ% )
      4.700     2.800     1.300 peak   629 spectrum    1 weight  0.11000E+01 volume  0.29831E-03 ppm1      1.047 ppm2      8.005 CV     1
 ASSI {  632}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 94   and name HA  ))
      5.000     5.000     1.000 peak   632 spectrum    1 weight  0.11000E+01 volume  0.64558E-03 ppm1      0.914 ppm2      4.498 CV     1
 ASSI {  633}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 132  and name HD2 ))
      4.700     4.700     1.300 peak   633 spectrum    1 weight  0.11000E+01 volume  0.24798E-03 ppm1      0.905 ppm2      4.277 CV     1
 ASSI {  636}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 89   and name HN  ))
      6.000     6.000     0.000 peak   636 spectrum    1 weight  0.11000E+01 volume  0.22461E-04 ppm1      1.099 ppm2      8.211 CV     1
 ASSI {  638}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 89   and name HN  ))
      4.000     2.000     2.000 peak   638 spectrum    1 weight  0.11000E+01 volume  0.44947E-03 ppm1      0.981 ppm2      8.210 CV     1
 ASSI {  639}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 132  and name HA  ))
      6.000     6.000     0.000 peak   639 spectrum    1 weight  0.11000E+01 volume  0.91605E-04 ppm1      1.046 ppm2      2.683 CV     1
 ASSI {  643}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 82   and name HD1 ))
      5.100     3.200     0.900 peak   643 spectrum    1 weight  0.11000E+01 volume  0.74931E-03 ppm1      0.982 ppm2      3.310 CV     1
 ASSI {  644}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 132  and name HD1 ))
      5.100     3.200     0.900 peak   644 spectrum    1 weight  0.11000E+01 volume  0.33258E-03 ppm1      0.911 ppm2      3.230 CV     1
 ASSI {  645}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 135  and name HE1 ))
      4.400     2.400     1.600 peak   645 spectrum    1 weight  0.11000E+01 volume  0.43861E-03 ppm1      0.911 ppm2      2.984 CV     1
 ASSI {  646}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 116  and name HE2 ))
      3.100     1.200     1.200 peak   646 spectrum    1 weight  0.11000E+01 volume  0.20793E-02 ppm1      0.980 ppm2      2.966 CV     1
 ASSI {  649}
   (  segid "    " and resid 117  and name HD2%)
   (( segid "    " and resid 117  and name HB2 ))
      2.600     0.800     0.800 peak   649 spectrum    1 weight  0.11000E+01 volume  0.79561E-02 ppm1      0.927 ppm2      2.024 CV     1
 ASSI {  650}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 85   and name HB  ))
      2.000     0.500     0.500 peak   650 spectrum    1 weight  0.11000E+01 volume  0.92039E-02 ppm1      0.980 ppm2      2.130 CV     1
 ASSI {  652}
   (  segid "    " and resid 131  and name HG2%)
   (( segid "    " and resid 132  and name HG1 ))
      3.100     3.100     2.900 peak   652 spectrum    1 weight  0.11000E+01 volume  0.11108E-01 ppm1      0.979 ppm2      1.703 CV     1
 ASSI {  653}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 116  and name HG2 ))
      2.800     2.800     3.200 peak   653 spectrum    1 weight  0.11000E+01 volume  0.10509E-01 ppm1      0.982 ppm2      1.529 CV     1
 ASSI {  654}
   (  segid "    " and resid 117  and name HD2%)
   (( segid "    " and resid 117  and name HB1 ))
      2.400     2.400     3.600 peak   654 spectrum    1 weight  0.11000E+01 volume  0.79927E-02 ppm1      0.917 ppm2      1.455 CV     1
 ASSI {  655}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 95   and name HB  ))
      2.200     0.600     0.600 peak   655 spectrum    1 weight  0.11000E+01 volume  0.97931E-02 ppm1      0.912 ppm2      1.801 CV     1
 ASSI {  656}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 95   and name HB  ))
      2.100     0.500     0.500 peak   656 spectrum    1 weight  0.11000E+01 volume  0.14153E-01 ppm1      1.046 ppm2      1.798 CV     1
 ASSI {  658}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 125  and name HB1 ))
      4.100     2.100     1.900 peak   658 spectrum    1 weight  0.11000E+01 volume  0.10048E-02 ppm1      0.680 ppm2      2.348 CV     1
 ASSI {  659}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 118  and name HG1 ))
      4.300     2.300     1.700 peak   659 spectrum    1 weight  0.11000E+01 volume  0.10392E-02 ppm1      0.682 ppm2      2.238 CV     1
 ASSI {  664}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 112  and name HA  ))
      2.600     0.900     0.900 peak   664 spectrum    1 weight  0.11000E+01 volume  0.19396E-02 ppm1      0.731 ppm2      3.844 CV     1
 ASSI {  667}
   (  segid "    " and resid 60   and name HD2%)
   (( segid "    " and resid 60   and name HG  ))
      2.000     0.500     0.500 peak   667 spectrum    1 weight  0.11000E+01 volume  0.12597E-01 ppm1      0.680 ppm2      1.569 CV     1
 ASSI {  668}
   (  segid "    " and resid 60   and name HD2%)
   (( segid "    " and resid 106  and name HZ  ))
      4.400     2.400     1.600 peak   668 spectrum    1 weight  0.11000E+01 volume  0.10906E-02 ppm1      0.685 ppm2      7.277 CV     1
 ASSI {  673}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 89   and name HN  ))
      2.800     2.800     3.200 peak   673 spectrum    1 weight  0.11000E+01 volume  0.10358E-02 ppm1      0.656 ppm2      8.214 CV     1
 ASSI {  676}
   (  segid "    " and resid 60   and name HD2%)
   (  segid "    " and resid 106  and name HE% )
      5.900     4.400     0.100 peak   676 spectrum    1 weight  0.11000E+01 volume  0.24895E-03 ppm1      0.685 ppm2      6.001 CV     1
 ASSI {  680}
   (  segid "    " and resid 46   and name HG1%)
   (( segid "    " and resid 44   and name HD1 ))
      4.300     2.300     1.700 peak   680 spectrum    1 weight  0.11000E+01 volume  0.87679E-03 ppm1     -0.201 ppm2      7.485 CV     1
 ASSI {  681}
   (  segid "    " and resid 46   and name HG1%)
   (( segid "    " and resid 44   and name HZ2 ))
      3.500     1.500     1.500 peak   681 spectrum    1 weight  0.11000E+01 volume  0.11422E-02 ppm1     -0.203 ppm2      7.271 CV     1
 ASSI {  682}
   (  segid "    " and resid 46   and name HG1%)
   (( segid "    " and resid 111  and name HD2 ))
      4.800     2.900     1.200 peak   682 spectrum    1 weight  0.11000E+01 volume  0.39687E-03 ppm1     -0.201 ppm2      6.272 CV     1
 ASSI {  684}
   (  segid "    " and resid 46   and name HG1%)
   (( segid "    " and resid 111  and name HB2 ))
      3.800     1.800     1.800 peak   684 spectrum    1 weight  0.11000E+01 volume  0.86682E-03 ppm1     -0.201 ppm2      3.273 CV     1
 ASSI {  685}
   (  segid "    " and resid 46   and name HG1%)
   (( segid "    " and resid 46   and name HA  ))
      2.800     1.000     1.000 peak   685 spectrum    1 weight  0.11000E+01 volume  0.43295E-02 ppm1     -0.200 ppm2      3.020 CV     1
 ASSI {  687}
   (  segid "    " and resid 46   and name HG1%)
   (  segid "    " and resid 108  and name HD2%)
      3.900     3.900     2.100 peak   687 spectrum    1 weight  0.11000E+01 volume  0.13455E-02 ppm1     -0.199 ppm2      1.167 CV     1
 ASSI {  688}
   (  segid "    " and resid 46   and name HG1%)
   (  segid "    " and resid 130  and name HD1%)
      3.000     3.000     3.000 peak   688 spectrum    1 weight  0.11000E+01 volume  0.70195E-02 ppm1     -0.200 ppm2      0.799 CV     1
 ASSI {  689}
   (  segid "    " and resid 84   and name HG2%)
   (( segid "    " and resid 85   and name HN  ))
      5.400     3.600     0.600 peak   689 spectrum    1 weight  0.11000E+01 volume  0.12228E-03 ppm1      1.307 ppm2      6.854 CV     1
 ASSI {  690}
   (  segid "    " and resid 84   and name HG2%)
   (( segid "    " and resid 84   and name HN  ))
      4.800     2.900     1.200 peak   690 spectrum    1 weight  0.11000E+01 volume  0.27847E-03 ppm1      1.300 ppm2      7.010 CV     1
 ASSI {  692}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 82   and name HA  ))
      4.600     4.600     1.400 peak   692 spectrum    1 weight  0.11000E+01 volume  0.53400E-04 ppm1      1.100 ppm2      4.515 CV     1
 ASSI {  693}
   (  segid "    " and resid 22   and name HG2%)
   (( segid "    " and resid 22   and name HB  ))
      4.000     2.000     2.000 peak   693 spectrum    1 weight  0.11000E+01 volume  0.41918E-03 ppm1      1.179 ppm2      4.213 CV     1
 ASSI {  697}
   (  segid "    " and resid 84   and name HG2%)
   (( segid "    " and resid 84   and name HB  ))
      2.400     0.700     0.700 peak   697 spectrum    1 weight  0.11000E+01 volume  0.68042E-02 ppm1      1.305 ppm2      4.139 CV     1
 ASSI {  698}
   (  segid "    " and resid 84   and name HG2%)
   (( segid "    " and resid 83   and name HB2 ))
      3.100     3.100     2.900 peak   698 spectrum    1 weight  0.11000E+01 volume  0.50457E-03 ppm1      1.309 ppm2      2.897 CV     1
 ASSI {  699}
   (  segid "    " and resid 95   and name HG2%)
   (  segid "    " and resid 101  and name HD2%)
      6.000     6.000     0.000 peak   699 spectrum    1 weight  0.11000E+01 volume  0.70735E-04 ppm1      1.050 ppm2      0.070 CV     1
 ASSI {  703}
   (  segid "    " and resid 60   and name HD2%)
   (  segid "    " and resid 67   and name HG2%)
      5.000     5.000     1.000 peak   703 spectrum    1 weight  0.11000E+01 volume  0.61658E-03 ppm1      0.679 ppm2     -0.049 CV     1
 ASSI {  706}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 132  and name HD1 ))
      3.400     1.400     1.400 peak   706 spectrum    1 weight  0.11000E+01 volume  0.33228E-03 ppm1      1.160 ppm2      3.270 CV     1
 ASSI {  707}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 111  and name HB1 ))
      5.600     5.600     0.400 peak   707 spectrum    1 weight  0.11000E+01 volume  0.65320E-04 ppm1      1.158 ppm2      2.995 CV     1
 ASSI {  709}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 88   and name HE1 ))
      4.300     4.300     1.700 peak   709 spectrum    1 weight  0.11000E+01 volume  0.24644E-03 ppm1      1.050 ppm2      2.962 CV     1
 ASSI {  712}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 116  and name HE2 ))
      3.900     1.900     1.900 peak   712 spectrum    1 weight  0.11000E+01 volume  0.69463E-03 ppm1      0.916 ppm2      2.962 CV     1
 ASSI {  713}
   (  segid "    " and resid 131  and name HG2%)
   (( segid "    " and resid 135  and name HE2 ))
      3.700     3.700     2.300 peak   713 spectrum    1 weight  0.11000E+01 volume  0.10338E-02 ppm1      0.969 ppm2      2.948 CV     1
 ASSI {  714}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 93   and name HA  ))
      4.300     2.300     1.700 peak   714 spectrum    1 weight  0.11000E+01 volume  0.27420E-03 ppm1      1.042 ppm2      4.119 CV     1
 ASSI {  715}
   (  segid "    " and resid 122  and name HD1%)
   (( segid "    " and resid 123  and name HD1 ))
      3.800     1.800     1.800 peak   715 spectrum    1 weight  0.11000E+01 volume  0.13828E-02 ppm1      0.778 ppm2      3.321 CV     1
 ASSI {  716}
   (  segid "    " and resid 122  and name HD1%)
   (( segid "    " and resid 88   and name HE1 ))
      6.000     6.000     0.000 peak   716 spectrum    1 weight  0.11000E+01 volume  0.19458E-04 ppm1      0.786 ppm2      2.967 CV     1
 ASSI {  721}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 81   and name HA  ))
      3.100     1.200     1.200 peak   721 spectrum    1 weight  0.11000E+01 volume  0.12362E-02 ppm1      0.918 ppm2      4.483 CV     1
 ASSI {  722}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 83   and name HA  ))
      3.800     1.800     1.800 peak   722 spectrum    1 weight  0.11000E+01 volume  0.42999E-03 ppm1      0.732 ppm2      4.262 CV     1
 ASSI {  724}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 111  and name HD2 ))
      4.100     4.100     1.900 peak   724 spectrum    1 weight  0.11000E+01 volume  0.58782E-03 ppm1      1.161 ppm2      6.272 CV     1
 ASSI {  731}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 127  and name HD2 ))
      3.900     1.900     1.900 peak   731 spectrum    1 weight  0.11000E+01 volume  0.69978E-03 ppm1      0.600 ppm2      4.055 CV     1
 ASSI {  732}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 112  and name HA  ))
      3.500     3.500     2.500 peak   732 spectrum    1 weight  0.11000E+01 volume  0.25866E-03 ppm1      0.594 ppm2      3.837 CV     1
 ASSI {  733}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HB1 ))
      4.700     4.700     1.300 peak   733 spectrum    1 weight  0.11000E+01 volume  0.44432E-03 ppm1      0.499 ppm2      2.289 CV     1
 ASSI {  734}
   (  segid "    " and resid 46   and name HG2%)
   (  segid "    " and resid 107  and name HB% )
      2.500     0.800     0.800 peak   734 spectrum    1 weight  0.11000E+01 volume  0.55511E-02 ppm1      0.500 ppm2      1.814 CV     1
 ASSI {  735}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 45   and name HB  ))
      3.300     3.300     2.700 peak   735 spectrum    1 weight  0.11000E+01 volume  0.37647E-03 ppm1      0.596 ppm2      2.118 CV     1
 ASSI {  736}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 130  and name HB1 ))
      3.000     1.100     1.100 peak   736 spectrum    1 weight  0.11000E+01 volume  0.13721E-02 ppm1      0.595 ppm2      1.479 CV     1
 ASSI {  737}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 130  and name HB2 ))
      3.400     1.500     1.500 peak   737 spectrum    1 weight  0.11000E+01 volume  0.22994E-02 ppm1      0.596 ppm2      1.680 CV     1
 ASSI {  738}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 112  and name HG  ))
      4.200     2.200     1.800 peak   738 spectrum    1 weight  0.11000E+01 volume  0.24863E-03 ppm1      0.596 ppm2      1.943 CV     1
 ASSI {  739}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 76   and name HB1 ))
      3.300     1.400     1.400 peak   739 spectrum    1 weight  0.11000E+01 volume  0.39940E-02 ppm1      0.732 ppm2      2.135 CV     1
 ASSI {  740}
   (  segid "    " and resid 122  and name HD1%)
   (( segid "    " and resid 122  and name HB2 ))
      2.700     0.900     0.900 peak   740 spectrum    1 weight  0.11000E+01 volume  0.10739E-01 ppm1      0.793 ppm2      1.681 CV     1
 ASSI {  741}
   (  segid "    " and resid 122  and name HD1%)
   (( segid "    " and resid 123  and name HG2 ))
      6.000     6.000     0.000 peak   741 spectrum    1 weight  0.11000E+01 volume  0.81657E-04 ppm1      0.791 ppm2      1.919 CV     1
 ASSI {  742}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HG  ))
      2.400     0.700     0.700 peak   742 spectrum    1 weight  0.11000E+01 volume  0.60140E-02 ppm1      0.732 ppm2      1.541 CV     1
 ASSI {  743}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HB2 ))
      2.900     1.100     1.100 peak   743 spectrum    1 weight  0.11000E+01 volume  0.20735E-02 ppm1      0.732 ppm2      1.791 CV     1
 ASSI {  745}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 112  and name HG  ))
      2.400     2.400     3.600 peak   745 spectrum    1 weight  0.11000E+01 volume  0.40032E-02 ppm1      1.159 ppm2      1.954 CV     1
 ASSI {  748}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 108  and name HB1 ))
      2.400     0.700     0.700 peak   748 spectrum    1 weight  0.11000E+01 volume  0.36627E-02 ppm1      1.162 ppm2      1.746 CV     1
 ASSI {  750}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 112  and name HN  ))
      5.000     5.000     1.000 peak   750 spectrum    1 weight  0.11000E+01 volume  0.65363E-03 ppm1      0.496 ppm2      8.307 CV     1
 ASSI {  752}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 44   and name HD1 ))
      3.700     1.700     1.700 peak   752 spectrum    1 weight  0.11000E+01 volume  0.80756E-03 ppm1      0.594 ppm2      7.502 CV     1
 ASSI {  754}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 81   and name HN  ))
      3.300     3.300     2.700 peak   754 spectrum    1 weight  0.11000E+01 volume  0.34853E-03 ppm1      0.730 ppm2      7.452 CV     1
 ASSI {  755}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 111  and name HE1 ))
      3.100     3.100     2.900 peak   755 spectrum    1 weight  0.11000E+01 volume  0.55564E-03 ppm1      0.730 ppm2      7.585 CV     1
 ASSI {  756}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 81   and name HN  ))
      6.000     6.000     0.000 peak   756 spectrum    1 weight  0.11000E+01 volume  0.22048E-04 ppm1      0.914 ppm2      7.434 CV     1
 ASSI {  759}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 108  and name HN  ))
      4.400     2.500     1.600 peak   759 spectrum    1 weight  0.11000E+01 volume  0.93224E-03 ppm1      1.160 ppm2      8.472 CV     1
 ASSI {  760}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HN  ))
      4.200     2.200     1.800 peak   760 spectrum    1 weight  0.11000E+01 volume  0.44529E-03 ppm1      0.732 ppm2      8.057 CV     1
 ASSI {  761}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 89   and name HN  ))
      6.000     6.000     0.000 peak   761 spectrum    1 weight  0.11000E+01 volume  0.20223E-04 ppm1      0.733 ppm2      8.212 CV     1
 ASSI {  767}
   (  segid "    " and resid 46   and name HG2%)
   (  segid "    " and resid 46   and name HG1%)
      2.400     2.400     3.600 peak   767 spectrum    1 weight  0.11000E+01 volume  0.82423E-02 ppm1      0.500 ppm2     -0.208 CV     1
 ASSI {  768}
   (  segid "    " and resid 130  and name HD2%)
   (  segid "    " and resid 46   and name HG1%)
      2.200     2.200     3.800 peak   768 spectrum    1 weight  0.11000E+01 volume  0.43777E-02 ppm1      0.595 ppm2     -0.207 CV     1
 ASSI {  769}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
      2.300     0.700     0.700 peak   769 spectrum    1 weight  0.11000E+01 volume  0.53367E-02 ppm1      0.500 ppm2     -1.227 CV     1
 ASSI {  770}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 46   and name HB  ))
      3.200     3.200     2.800 peak   770 spectrum    1 weight  0.11000E+01 volume  0.41698E-03 ppm1      0.598 ppm2     -1.215 CV     1
 ASSI {  771}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 46   and name HB  ))
      5.900     5.900     0.100 peak   771 spectrum    1 weight  0.11000E+01 volume  0.11048E-03 ppm1      1.159 ppm2     -1.224 CV     1
 ASSI {  772}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HE2 ))
      3.100     1.200     1.200 peak   772 spectrum    1 weight  0.11000E+01 volume  0.33336E-02 ppm1      1.363 ppm2      2.995 CV     1
 ASSI {  774}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 111  and name HE1 ))
      3.000     1.100     1.100 peak   774 spectrum    1 weight  0.11000E+01 volume  0.19788E-02 ppm1      1.353 ppm2      7.510 CV     1
 ASSI {  776}
   (( segid "    " and resid 48   and name HG1 ))
   (  segid "    " and resid 46   and name HG2%)
      4.700     4.700     1.300 peak   776 spectrum    1 weight  0.11000E+01 volume  0.56604E-03 ppm1      1.359 ppm2      0.497 CV     1
 ASSI {  777}
   (( segid "    " and resid 48   and name HG2 ))
   (  segid "    " and resid 45   and name HG1%)
      2.500     2.500     3.500 peak   777 spectrum    1 weight  0.11000E+01 volume  0.29514E-02 ppm1      1.354 ppm2      0.841 CV     1
 ASSI {  783}
   (  segid "    " and resid 108  and name HD2%)
   (  segid "    " and resid 130  and name HD2%)
      3.000     3.000     3.000 peak   783 spectrum    1 weight  0.11000E+01 volume  0.24640E-02 ppm1      1.161 ppm2      0.579 CV     1
 ASSI {  784}
   (  segid "    " and resid 108  and name HD2%)
   (  segid "    " and resid 112  and name HD1%)
      2.400     2.400     3.600 peak   784 spectrum    1 weight  0.11000E+01 volume  0.52379E-02 ppm1      1.160 ppm2      0.765 CV     1
 ASSI {  785}
   (  segid "    " and resid 108  and name HD2%)
   (  segid "    " and resid 126  and name HD1%)
      2.300     2.300     3.700 peak   785 spectrum    1 weight  0.11000E+01 volume  0.28691E-02 ppm1      1.155 ppm2      0.915 CV     1
 ASSI {  786}
   (( segid "    " and resid 80   and name HG1 ))
   (( segid "    " and resid 80   and name HB1 ))
      3.500     1.600     1.600 peak   786 spectrum    1 weight  0.11000E+01 volume  0.14922E-02 ppm1      1.432 ppm2      2.210 CV     1
 ASSI {  787}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 94   and name HB2 ))
      4.100     2.100     1.900 peak   787 spectrum    1 weight  0.11000E+01 volume  0.21810E-02 ppm1      1.367 ppm2      2.196 CV     1
 ASSI {  789}
   (( segid "    " and resid 116  and name HG1 ))
   (( segid "    " and resid 117  and name HB2 ))
      2.400     2.400     3.600 peak   789 spectrum    1 weight  0.11000E+01 volume  0.10440E-01 ppm1      1.298 ppm2      2.013 CV     1
 ASSI {  791}
   (( segid "    " and resid 80   and name HG1 ))
   (( segid "    " and resid 80   and name HA  ))
      2.700     0.900     0.900 peak   791 spectrum    1 weight  0.11000E+01 volume  0.60242E-02 ppm1      1.434 ppm2      3.934 CV     1
 ASSI {  799}
   (( segid "    " and resid 66   and name HD1 ))
   (( segid "    " and resid 66   and name HE1 ))
      2.500     0.800     0.800 peak   799 spectrum    1 weight  0.11000E+01 volume  0.59273E-02 ppm1      1.546 ppm2      3.051 CV     1
 ASSI {  800}
   (( segid "    " and resid 114  and name HG2 ))
   (( segid "    " and resid 114  and name HE2 ))
      2.600     2.600     3.400 peak   800 spectrum    1 weight  0.11000E+01 volume  0.62024E-02 ppm1      1.479 ppm2      2.962 CV     1
 ASSI {  801}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HE2 ))
      2.600     0.900     0.900 peak   801 spectrum    1 weight  0.11000E+01 volume  0.52832E-02 ppm1      1.357 ppm2      3.059 CV     1
 ASSI {  802}
   (( segid "    " and resid 114  and name HG1 ))
   (( segid "    " and resid 114  and name HE2 ))
      3.800     1.800     1.800 peak   802 spectrum    1 weight  0.11000E+01 volume  0.86316E-03 ppm1      1.189 ppm2      2.946 CV     1
 ASSI {  806}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 126  and name HA  ))
      2.800     2.800     3.200 peak   806 spectrum    1 weight  0.11000E+01 volume  0.10248E-02 ppm1      0.769 ppm2      4.137 CV     1
 ASSI {  809}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HA  ))
      4.300     4.300     1.700 peak   809 spectrum    1 weight  0.11000E+01 volume  0.54022E-03 ppm1      1.370 ppm2      4.505 CV     1
 ASSI {  811}
   (( segid "    " and resid 114  and name HG1 ))
   (( segid "    " and resid 114  and name HD1 ))
      2.700     0.900     0.900 peak   811 spectrum    1 weight  0.11000E+01 volume  0.34369E-02 ppm1      1.189 ppm2      1.913 CV     1
 ASSI {  812}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 132  and name HG2 ))
      2.900     1.100     1.100 peak   812 spectrum    1 weight  0.11000E+01 volume  0.16682E-02 ppm1      1.094 ppm2      1.796 CV     1
 ASSI {  813}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 135  and name HB2 ))
      3.000     1.100     1.100 peak   813 spectrum    1 weight  0.11000E+01 volume  0.14484E-02 ppm1      1.105 ppm2      1.976 CV     1
 ASSI {  815}
   (( segid "    " and resid 67   and name HG11))
   (  segid "    " and resid 67   and name HG2%)
      3.400     1.500     1.500 peak   815 spectrum    1 weight  0.11000E+01 volume  0.18548E-02 ppm1      1.437 ppm2     -0.036 CV     1
 ASSI {  816}
   (( segid "    " and resid 60   and name HG  ))
   (( segid "    " and resid 106  and name HZ  ))
      3.400     1.500     1.500 peak   816 spectrum    1 weight  0.11000E+01 volume  0.20364E-02 ppm1      1.611 ppm2      7.290 CV     1
 ASSI {  818}
   (( segid "    " and resid 60   and name HG  ))
   (( segid "    " and resid 59   and name HN  ))
      5.100     3.200     0.900 peak   818 spectrum    1 weight  0.11000E+01 volume  0.20903E-03 ppm1      1.593 ppm2      8.184 CV     1
 ASSI {  819}
   (( segid "    " and resid 88   and name HG1 ))
   (( segid "    " and resid 88   and name HN  ))
      3.800     1.800     1.800 peak   819 spectrum    1 weight  0.11000E+01 volume  0.47732E-03 ppm1      1.476 ppm2      7.287 CV     1
 ASSI {  820}
   (( segid "    " and resid 114  and name HG2 ))
   (( segid "    " and resid 114  and name HN  ))
      3.700     1.700     1.700 peak   820 spectrum    1 weight  0.11000E+01 volume  0.16830E-02 ppm1      1.472 ppm2      7.472 CV     1
 ASSI {  824}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 68   and name HN  ))
      3.200     3.200     2.800 peak   824 spectrum    1 weight  0.11000E+01 volume  0.44597E-03 ppm1      0.875 ppm2      8.226 CV     1
 ASSI {  825}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 69   and name HN  ))
      3.000     3.000     3.000 peak   825 spectrum    1 weight  0.11000E+01 volume  0.71790E-03 ppm1      0.873 ppm2      8.995 CV     1
 ASSI {  826}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 130  and name HN  ))
      4.300     2.300     1.700 peak   826 spectrum    1 weight  0.11000E+01 volume  0.58295E-03 ppm1      0.771 ppm2      7.796 CV     1
 ASSI {  828}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 129  and name HD2 ))
      4.400     2.400     1.600 peak   828 spectrum    1 weight  0.11000E+01 volume  0.23782E-03 ppm1      0.771 ppm2      6.888 CV     1
 ASSI {  829}
   (( segid "    " and resid 91   and name HG1 ))
   (( segid "    " and resid 89   and name HN  ))
      4.300     2.300     1.700 peak   829 spectrum    1 weight  0.11000E+01 volume  0.91495E-03 ppm1      1.541 ppm2      8.209 CV     1
 ASSI {  830}
   (( segid "    " and resid 91   and name HG2 ))
   (( segid "    " and resid 93   and name HN  ))
      5.300     3.600     0.700 peak   830 spectrum    1 weight  0.11000E+01 volume  0.26014E-03 ppm1      1.530 ppm2      8.040 CV     1
 ASSI {  836}
   (( segid "    " and resid 67   and name HG12))
   (  segid "    " and resid 67   and name HD1%)
      2.100     0.600     0.600 peak   836 spectrum    1 weight  0.11000E+01 volume  0.39212E-02 ppm1      1.434 ppm2      0.443 CV     1
 ASSI {  837}
   (( segid "    " and resid 60   and name HG  ))
   (  segid "    " and resid 60   and name HD1%)
      2.300     0.600     0.600 peak   837 spectrum    1 weight  0.11000E+01 volume  0.49103E-02 ppm1      1.590 ppm2      0.462 CV     1
 ASSI {  838}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HB1 ))
      2.600     0.900     0.900 peak   838 spectrum    1 weight  0.11000E+01 volume  0.46605E-02 ppm1      1.493 ppm2      2.265 CV     1
 ASSI {  839}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HB2 ))
      2.500     0.800     0.800 peak   839 spectrum    1 weight  0.11000E+01 volume  0.72609E-02 ppm1      1.830 ppm2      2.294 CV     1
 ASSI {  840}
   (( segid "    " and resid 78   and name HG2 ))
   (( segid "    " and resid 78   and name HE1 ))
      2.600     0.800     0.800 peak   840 spectrum    1 weight  0.11000E+01 volume  0.24433E-02 ppm1      1.697 ppm2      2.962 CV     1
 ASSI {  841}
   (( segid "    " and resid 78   and name HG2 ))
   (( segid "    " and resid 78   and name HE2 ))
      3.000     3.000     3.000 peak   841 spectrum    1 weight  0.11000E+01 volume  0.25191E-02 ppm1      1.660 ppm2      3.008 CV     1
 ASSI {  842}
   (( segid "    " and resid 26   and name HG1 ))
   (( segid "    " and resid 26   and name HD1 ))
      2.600     0.800     0.800 peak   842 spectrum    1 weight  0.11000E+01 volume  0.22836E-02 ppm1      1.901 ppm2      3.313 CV     1
 ASSI {  845}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 51   and name HD2 ))
      3.900     1.900     1.900 peak   845 spectrum    1 weight  0.11000E+01 volume  0.23764E-02 ppm1      1.895 ppm2      3.734 CV     1
 ASSI {  848}
   (( segid "    " and resid 78   and name HG2 ))
   (( segid "    " and resid 78   and name HA  ))
      2.900     1.000     1.000 peak   848 spectrum    1 weight  0.11000E+01 volume  0.53391E-02 ppm1      1.703 ppm2      4.100 CV     1
 ASSI {  849}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HA  ))
      2.700     0.900     0.900 peak   849 spectrum    1 weight  0.11000E+01 volume  0.27226E-02 ppm1      1.845 ppm2      4.054 CV     1
 ASSI {  850}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 86   and name HA  ))
      2.900     1.000     1.000 peak   850 spectrum    1 weight  0.11000E+01 volume  0.29694E-02 ppm1      1.539 ppm2      3.908 CV     1
 ASSI {  851}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HA  ))
      2.400     0.700     0.700 peak   851 spectrum    1 weight  0.11000E+01 volume  0.27353E-02 ppm1      1.510 ppm2      4.023 CV     1
 ASSI {  853}
   (( segid "    " and resid 78   and name HG1 ))
   (( segid "    " and resid 78   and name HA  ))
      3.300     1.400     1.400 peak   853 spectrum    1 weight  0.11000E+01 volume  0.26627E-02 ppm1      1.437 ppm2      4.103 CV     1
 ASSI {  854}
   (( segid "    " and resid 91   and name HG2 ))
   (( segid "    " and resid 91   and name HE2 ))
      2.900     1.000     1.000 peak   854 spectrum    1 weight  0.11000E+01 volume  0.24409E-02 ppm1      1.561 ppm2      3.102 CV     1
 ASSI {  856}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HE2 ))
      2.700     0.900     0.900 peak   856 spectrum    1 weight  0.11000E+01 volume  0.30870E-02 ppm1      1.488 ppm2      3.122 CV     1
 ASSI {  857}
   (( segid "    " and resid 78   and name HG1 ))
   (( segid "    " and resid 78   and name HE1 ))
      3.300     1.300     1.300 peak   857 spectrum    1 weight  0.11000E+01 volume  0.25085E-02 ppm1      1.425 ppm2      2.943 CV     1
 ASSI {  864}
   (  segid "    " and resid 126  and name HD2%)
   (( segid "    " and resid 131  and name HA  ))
      3.600     1.600     1.600 peak   864 spectrum    1 weight  0.11000E+01 volume  0.22822E-03 ppm1      0.962 ppm2      3.737 CV     1
 ASSI {  865}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 116  and name HE1 ))
      6.000     4.900     0.000 peak   865 spectrum    1 weight  0.11000E+01 volume  0.33793E-04 ppm1      0.856 ppm2      2.949 CV     1
 ASSI {  866}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 113  and name HA  ))
      3.000     3.000     3.000 peak   866 spectrum    1 weight  0.11000E+01 volume  0.25549E-02 ppm1      0.858 ppm2      3.306 CV     1
 ASSI {  870}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 72   and name HN  ))
      4.800     2.900     1.200 peak   870 spectrum    1 weight  0.11000E+01 volume  0.91162E-03 ppm1      1.265 ppm2      8.897 CV     1
 ASSI {  872}
   (( segid "    " and resid 50   and name HG1 ))
   (  segid "    " and resid 53   and name HD% )
      6.000     6.000     0.000 peak   872 spectrum    1 weight  0.11000E+01 volume  0.82129E-05 ppm1      1.496 ppm2      6.757 CV     1
 ASSI {  876}
   (( segid "    " and resid 60   and name HG  ))
   (  segid "    " and resid 67   and name HG2%)
      5.700     4.000     0.300 peak   876 spectrum    1 weight  0.11000E+01 volume  0.16385E-03 ppm1      1.587 ppm2     -0.037 CV     1
 ASSI {  880}
   (( segid "    " and resid 126  and name HB1 ))
   (  segid "    " and resid 126  and name HD1%)
      2.400     2.400     3.600 peak   880 spectrum    1 weight  0.11000E+01 volume  0.14846E-01 ppm1      1.524 ppm2      0.877 CV     1
 ASSI {  881}
   (( segid "    " and resid 60   and name HG  ))
   (  segid "    " and resid 56   and name HG2%)
      2.500     0.800     0.800 peak   881 spectrum    1 weight  0.11000E+01 volume  0.27602E-02 ppm1      1.602 ppm2      1.105 CV     1
 ASSI {  883}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name HB1 ))
      2.000     0.500     0.500 peak   883 spectrum    1 weight  0.11000E+01 volume  0.10967E-01 ppm1      1.540 ppm2      1.965 CV     1
 ASSI {  884}
   (( segid "    " and resid 114  and name HG2 ))
   (( segid "    " and resid 114  and name HB2 ))
      2.300     0.600     0.600 peak   884 spectrum    1 weight  0.11000E+01 volume  0.11058E-01 ppm1      1.438 ppm2      1.982 CV     1
 ASSI {  885}
   (( segid "    " and resid 114  and name HG1 ))
   (  segid "    " and resid 117  and name HD1%)
      3.600     3.600     2.400 peak   885 spectrum    1 weight  0.11000E+01 volume  0.26550E-02 ppm1      1.183 ppm2      0.879 CV     1
 ASSI {  886}
   (( segid "    " and resid 114  and name HG1 ))
   (  segid "    " and resid 115  and name HG2%)
      4.500     2.500     1.500 peak   886 spectrum    1 weight  0.11000E+01 volume  0.28728E-03 ppm1      1.191 ppm2      0.663 CV     1
 ASSI {  887}
   (( segid "    " and resid 116  and name HG1 ))
   (  segid "    " and resid 115  and name HG1%)
      5.600     5.600     0.400 peak   887 spectrum    1 weight  0.11000E+01 volume  0.17094E-03 ppm1      1.285 ppm2      0.648 CV     1
 ASSI {  888}
   (( segid "    " and resid 116  and name HG1 ))
   (  segid "    " and resid 81   and name HD1%)
      3.200     3.200     2.800 peak   888 spectrum    1 weight  0.11000E+01 volume  0.34915E-02 ppm1      1.294 ppm2      0.857 CV     1
 ASSI {  889}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HB2 ))
      2.400     0.700     0.700 peak   889 spectrum    1 weight  0.11000E+01 volume  0.12866E-01 ppm1      1.357 ppm2      1.987 CV     1
 ASSI {  891}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 135  and name HG2 ))
      1.500     0.300     0.700 peak   891 spectrum    1 weight  0.11000E+01 volume  0.15397E-01 ppm1      1.090 ppm2      1.402 CV     1
 ASSI {  892}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 67   and name HN  ))
      6.000     6.000     0.000 peak   892 spectrum    1 weight  0.11000E+01 volume  0.10745E-04 ppm1      0.869 ppm2      9.305 CV     1
 ASSI {  894}
   (( segid "    " and resid 135  and name HG1 ))
   (  segid "    " and resid 135  and name HZ% )
      4.800     2.900     1.200 peak   894 spectrum    1 weight  0.11000E+01 volume  0.43726E-03 ppm1      1.098 ppm2      7.954 CV     1
 ASSI {  898}
   (( segid "    " and resid 133  and name HG1 ))
   (( segid "    " and resid 133  and name HG2 ))
      1.800     0.400     0.400 peak   898 spectrum    1 weight  0.11000E+01 volume  0.79951E-02 ppm1      1.540 ppm2      2.127 CV     1
 ASSI {  900}
   (( segid "    " and resid 133  and name HG1 ))
   (( segid "    " and resid 132  and name HA  ))
      5.300     3.600     0.700 peak   900 spectrum    1 weight  0.11000E+01 volume  0.47656E-03 ppm1      1.517 ppm2      2.646 CV     1
 ASSI {  902}
   (( segid "    " and resid 100  and name HG  ))
   (  segid "    " and resid 100  and name HD1%)
      2.100     0.500     0.500 peak   902 spectrum    1 weight  0.11000E+01 volume  0.11612E-01 ppm1      1.543 ppm2      0.786 CV     1
 ASSI {  903}
   (( segid "    " and resid 108  and name HG  ))
   (  segid "    " and resid 108  and name HD2%)
      2.300     0.600     0.600 peak   903 spectrum    1 weight  0.11000E+01 volume  0.56041E-02 ppm1      1.529 ppm2      1.172 CV     1
 ASSI {  904}
   (( segid "    " and resid 122  and name HB2 ))
   (  segid "    " and resid 122  and name HD2%)
      2.100     2.100     3.900 peak   904 spectrum    1 weight  0.11000E+01 volume  0.15528E-01 ppm1      1.680 ppm2      0.818 CV     1
 ASSI {  905}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 133  and name HD1 ))
      2.100     2.100     3.900 peak   905 spectrum    1 weight  0.11000E+01 volume  0.74526E-01 ppm1      1.765 ppm2      2.000 CV     1
 ASSI {  906}
   (( segid "    " and resid 132  and name HG1 ))
   (( segid "    " and resid 132  and name HA  ))
      4.600     2.700     1.400 peak   906 spectrum    1 weight  0.11000E+01 volume  0.14236E-03 ppm1      1.740 ppm2      2.648 CV     1
 ASSI {  908}
   (( segid "    " and resid 132  and name HG1 ))
   (( segid "    " and resid 132  and name HD1 ))
      2.500     0.800     0.800 peak   908 spectrum    1 weight  0.11000E+01 volume  0.20796E-02 ppm1      1.736 ppm2      3.197 CV     1
 ASSI {  909}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HD1 ))
      3.300     1.400     1.400 peak   909 spectrum    1 weight  0.11000E+01 volume  0.13550E-02 ppm1      1.869 ppm2      3.099 CV     1
 ASSI {  911}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HG1 ))
      1.400     0.200     0.800 peak   911 spectrum    1 weight  0.11000E+01 volume  0.22693E-01 ppm1      1.860 ppm2      1.236 CV     1
 ASSI {  914}
   (( segid "    " and resid 39   and name HG12))
   (  segid "    " and resid 39   and name HD1%)
      2.500     0.800     0.800 peak   914 spectrum    1 weight  0.11000E+01 volume  0.51396E-02 ppm1      1.344 ppm2      0.786 CV     1
 ASSI {  915}
   (( segid "    " and resid 56   and name HG11))
   (( segid "    " and resid 56   and name HB  ))
      2.700     0.900     0.900 peak   915 spectrum    1 weight  0.11000E+01 volume  0.14628E-02 ppm1      1.318 ppm2      2.415 CV     1
 ASSI {  916}
   (( segid "    " and resid 56   and name HG11))
   (( segid "    " and resid 55   and name HB1 ))
      6.000     5.200     0.000 peak   916 spectrum    1 weight  0.11000E+01 volume  0.16214E-03 ppm1      1.312 ppm2      2.183 CV     1
 ASSI {  919}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HD2 ))
      2.900     1.000     1.000 peak   919 spectrum    1 weight  0.11000E+01 volume  0.15652E-02 ppm1      1.555 ppm2      3.131 CV     1
 ASSI {  920}
   (( segid "    " and resid 137  and name HG1 ))
   (( segid "    " and resid 137  and name HD2 ))
      3.200     1.200     1.200 peak   920 spectrum    1 weight  0.11000E+01 volume  0.21722E-02 ppm1      1.492 ppm2      3.135 CV     1
 ASSI {  926}
   (( segid "    " and resid 56   and name HG11))
   (( segid "    " and resid 56   and name HA  ))
      3.300     1.300     1.300 peak   926 spectrum    1 weight  0.11000E+01 volume  0.74724E-03 ppm1      1.325 ppm2      3.926 CV     1
 ASSI {  928}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HA  ))
      3.800     1.800     1.800 peak   928 spectrum    1 weight  0.11000E+01 volume  0.11194E-02 ppm1      1.249 ppm2      4.173 CV     1
 ASSI {  929}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 58   and name HA  ))
      2.600     0.900     0.900 peak   929 spectrum    1 weight  0.11000E+01 volume  0.16020E-02 ppm1      1.251 ppm2      3.992 CV     1
 ASSI {  931}
   (  segid "    " and resid 108  and name HD1%)
   (( segid "    " and resid 132  and name HD2 ))
      4.500     2.600     1.500 peak   931 spectrum    1 weight  0.11000E+01 volume  0.56156E-03 ppm1      1.195 ppm2      4.310 CV     1
 ASSI {  932}
   (( segid "    " and resid 39   and name HG11))
   (( segid "    " and resid 39   and name HA  ))
      4.300     2.300     1.700 peak   932 spectrum    1 weight  0.11000E+01 volume  0.61528E-03 ppm1      1.067 ppm2      4.123 CV     1
 ASSI {  933}
   (( segid "    " and resid 39   and name HG11))
   (( segid "    " and resid 36   and name HA2 ))
      4.300     2.400     1.700 peak   933 spectrum    1 weight  0.11000E+01 volume  0.70971E-04 ppm1      1.053 ppm2      3.896 CV     1
 ASSI {  934}
   (  segid "    " and resid 108  and name HD1%)
   (( segid "    " and resid 131  and name HA  ))
      5.600     5.600     0.400 peak   934 spectrum    1 weight  0.11000E+01 volume  0.97319E-04 ppm1      1.193 ppm2      3.742 CV     1
 ASSI {  935}
   (  segid "    " and resid 108  and name HD1%)
   (( segid "    " and resid 132  and name HD1 ))
      3.800     3.800     2.200 peak   935 spectrum    1 weight  0.11000E+01 volume  0.28077E-03 ppm1      1.195 ppm2      3.230 CV     1
 ASSI {  936}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HD1 ))
      2.800     1.000     1.000 peak   936 spectrum    1 weight  0.11000E+01 volume  0.10491E-02 ppm1      1.251 ppm2      3.103 CV     1
 ASSI {  938}
   (  segid "    " and resid 108  and name HD1%)
   (( segid "    " and resid 108  and name HB2 ))
      4.900     3.000     1.100 peak   938 spectrum    1 weight  0.11000E+01 volume  0.60256E-04 ppm1      1.196 ppm2      2.583 CV     1
 ASSI {  941}
   (  segid "    " and resid 108  and name HD1%)
   (( segid "    " and resid 108  and name HG  ))
      2.700     0.900     0.900 peak   941 spectrum    1 weight  0.11000E+01 volume  0.21390E-02 ppm1      1.199 ppm2      1.534 CV     1
 ASSI {  942}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HB2 ))
      2.800     1.000     1.000 peak   942 spectrum    1 weight  0.11000E+01 volume  0.33297E-02 ppm1      1.256 ppm2      1.529 CV     1
 ASSI {  945}
   (( segid "    " and resid 39   and name HG11))
   (  segid "    " and resid 39   and name HD1%)
      2.300     0.700     0.700 peak   945 spectrum    1 weight  0.11000E+01 volume  0.86263E-02 ppm1      1.069 ppm2      0.795 CV     1
 ASSI {  946}
   (( segid "    " and resid 122  and name HB1 ))
   (  segid "    " and resid 122  and name HD2%)
      2.800     1.000     1.000 peak   946 spectrum    1 weight  0.11000E+01 volume  0.83868E-02 ppm1      1.195 ppm2      0.864 CV     1
 ASSI {  947}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 67   and name HD1%)
      4.000     2.000     2.000 peak   947 spectrum    1 weight  0.11000E+01 volume  0.51574E-03 ppm1      0.824 ppm2      0.448 CV     1
 ASSI {  949}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 105  and name HG1 ))
      5.300     3.600     0.700 peak   949 spectrum    1 weight  0.11000E+01 volume  0.60295E-03 ppm1      0.806 ppm2      2.281 CV     1
 ASSI {  950}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 98   and name HB2 ))
      4.600     2.600     1.400 peak   950 spectrum    1 weight  0.11000E+01 volume  0.14739E-03 ppm1      0.831 ppm2      2.967 CV     1
 ASSI {  951}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 106  and name HB2 ))
      4.500     2.500     1.500 peak   951 spectrum    1 weight  0.11000E+01 volume  0.34627E-03 ppm1      0.836 ppm2      3.211 CV     1
 ASSI {  952}
   (  segid "    " and resid 92   and name HD1%)
   (( segid "    " and resid 89   and name HA  ))
      4.500     2.600     1.500 peak   952 spectrum    1 weight  0.11000E+01 volume  0.54359E-03 ppm1      0.814 ppm2      3.477 CV     1
 ASSI {  954}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 112  and name HA  ))
      4.900     3.000     1.100 peak   954 spectrum    1 weight  0.11000E+01 volume  0.53025E-03 ppm1      0.821 ppm2      3.834 CV     1
 ASSI {  955}
   (  segid "    " and resid 92   and name HD1%)
   (( segid "    " and resid 92   and name HA  ))
      3.200     1.300     1.300 peak   955 spectrum    1 weight  0.11000E+01 volume  0.98312E-03 ppm1      0.813 ppm2      4.041 CV     1
 ASSI {  956}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 106  and name HA  ))
      3.300     1.400     1.400 peak   956 spectrum    1 weight  0.11000E+01 volume  0.10737E-02 ppm1      0.829 ppm2      4.198 CV     1
 ASSI {  957}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 85   and name HA  ))
      6.000     6.000     0.000 peak   957 spectrum    1 weight  0.11000E+01 volume  0.61581E-04 ppm1      0.854 ppm2      3.649 CV     1
 ASSI {  958}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 101  and name HD2%)
      2.600     0.800     0.800 peak   958 spectrum    1 weight  0.11000E+01 volume  0.37042E-02 ppm1      0.830 ppm2      0.062 CV     1
 ASSI {  959}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 67   and name HG2%)
      3.300     3.300     2.700 peak   959 spectrum    1 weight  0.11000E+01 volume  0.12187E-02 ppm1      0.472 ppm2     -0.032 CV     1
 ASSI {  960}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 60   and name HD2%)
      2.800     1.000     1.000 peak   960 spectrum    1 weight  0.11000E+01 volume  0.26409E-02 ppm1      0.474 ppm2      0.687 CV     1
 ASSI {  964}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 75   and name HB2 ))
      3.400     1.400     1.400 peak   964 spectrum    1 weight  0.11000E+01 volume  0.17874E-02 ppm1      0.475 ppm2      2.217 CV     1
 ASSI {  965}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 75   and name HG2 ))
      2.500     0.800     0.800 peak   965 spectrum    1 weight  0.11000E+01 volume  0.22567E-02 ppm1      0.475 ppm2      2.388 CV     1
 ASSI {  966}
   (( segid "    " and resid 62   and name HG1 ))
   (  segid "    " and resid 67   and name HG2%)
      3.900     1.900     1.900 peak   966 spectrum    1 weight  0.11000E+01 volume  0.74647E-03 ppm1      1.255 ppm2     -0.045 CV     1
 ASSI {  967}
   (  segid "    " and resid 108  and name HD1%)
   (  segid "    " and resid 46   and name HG1%)
      6.000     6.000     0.000 peak   967 spectrum    1 weight  0.11000E+01 volume  0.42742E-04 ppm1      1.201 ppm2     -0.212 CV     1
 ASSI {  968}
   (( segid "    " and resid 62   and name HG2 ))
   (  segid "    " and resid 67   and name HG2%)
      5.200     3.400     0.800 peak   968 spectrum    1 weight  0.11000E+01 volume  0.47529E-03 ppm1      1.868 ppm2     -0.047 CV     1
 ASSI {  969}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 57   and name HA  ))
      3.800     1.800     1.800 peak   969 spectrum    1 weight  0.11000E+01 volume  0.94833E-03 ppm1      0.473 ppm2      3.075 CV     1
 ASSI {  970}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 72   and name HA  ))
      3.700     1.700     1.700 peak   970 spectrum    1 weight  0.11000E+01 volume  0.56243E-03 ppm1      0.477 ppm2      4.093 CV     1
 ASSI {  972}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 106  and name HE% )
      4.000     2.000     2.000 peak   972 spectrum    1 weight  0.11000E+01 volume  0.12578E-03 ppm1      0.474 ppm2      6.005 CV     1
 ASSI {  974}
   (( segid "    " and resid 39   and name HG11))
   (( segid "    " and resid 41   and name HN  ))
      4.400     2.400     1.600 peak   974 spectrum    1 weight  0.11000E+01 volume  0.33420E-03 ppm1      1.060 ppm2      8.015 CV     1
 ASSI {  976}
   (  segid "    " and resid 108  and name HD1%)
   (( segid "    " and resid 44   and name HZ2 ))
      3.900     1.900     1.900 peak   976 spectrum    1 weight  0.11000E+01 volume  0.62670E-03 ppm1      1.198 ppm2      7.277 CV     1
 ASSI {  980}
   (( segid "    " and resid 56   and name HG11))
   (( segid "    " and resid 55   and name HN  ))
      4.300     2.300     1.700 peak   980 spectrum    1 weight  0.11000E+01 volume  0.98615E-03 ppm1      1.325 ppm2      7.323 CV     1
 ASSI {  983}
   (  segid "    " and resid 108  and name HD1%)
   (( segid "    " and resid 109  and name HN  ))
      6.000     4.700     0.000 peak   983 spectrum    1 weight  0.11000E+01 volume  0.14562E-03 ppm1      1.196 ppm2      8.718 CV     1
 ASSI {  984}
   (( segid "    " and resid 39   and name HG12))
   (( segid "    " and resid 41   and name HN  ))
      5.200     3.400     0.800 peak   984 spectrum    1 weight  0.11000E+01 volume  0.15917E-03 ppm1      1.341 ppm2      8.008 CV     1
 ASSI {  985}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HH22))
      5.600     3.900     0.400 peak   985 spectrum    1 weight  0.11000E+01 volume  0.48414E-03 ppm1      1.433 ppm2      7.161 CV     1
 ASSI {  987}
   (( segid "    " and resid 117  and name HG  ))
   (( segid "    " and resid 118  and name HN  ))
      3.800     1.800     1.800 peak   987 spectrum    1 weight  0.11000E+01 volume  0.90194E-03 ppm1      1.539 ppm2      7.789 CV     1
 ASSI {  989}
   (( segid "    " and resid 108  and name HG  ))
   (( segid "    " and resid 112  and name HN  ))
      4.000     2.000     2.000 peak   989 spectrum    1 weight  0.11000E+01 volume  0.73447E-03 ppm1      1.533 ppm2      8.280 CV     1
 ASSI {  996}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 58   and name HN  ))
      5.700     4.100     0.300 peak   996 spectrum    1 weight  0.11000E+01 volume  0.26205E-03 ppm1      1.857 ppm2      7.762 CV     1
 ASSI {  997}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 61   and name HN  ))
      6.000     5.000     0.000 peak   997 spectrum    1 weight  0.11000E+01 volume  0.29210E-03 ppm1      1.849 ppm2      7.931 CV     1
 ASSI {  999}
   (( segid "    " and resid 123  and name HG1 ))
   (( segid "    " and resid 126  and name HN  ))
      5.500     3.800     0.500 peak   999 spectrum    1 weight  0.11000E+01 volume  0.50606E-03 ppm1      1.844 ppm2      8.887 CV     1
 ASSI { 1001}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 130  and name HN  ))
      3.600     1.600     1.600 peak  1001 spectrum    1 weight  0.11000E+01 volume  0.11089E-02 ppm1      2.122 ppm2      7.799 CV     1
 ASSI { 1003}
   (( segid "    " and resid 56   and name HG12))
   (( segid "    " and resid 55   and name HN  ))
      4.700     2.800     1.300 peak  1003 spectrum    1 weight  0.11000E+01 volume  0.23715E-02 ppm1      1.921 ppm2      7.313 CV     1
 ASSI { 1005}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 58   and name HA  ))
      3.200     1.300     1.300 peak  1005 spectrum    1 weight  0.11000E+01 volume  0.34894E-02 ppm1      1.862 ppm2      3.972 CV     1
 ASSI { 1006}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HA  ))
      3.400     1.400     1.400 peak  1006 spectrum    1 weight  0.11000E+01 volume  0.29588E-02 ppm1      1.860 ppm2      4.203 CV     1
 ASSI { 1007}
   (( segid "    " and resid 132  and name HG1 ))
   (( segid "    " and resid 132  and name HD2 ))
      3.800     1.800     1.800 peak  1007 spectrum    1 weight  0.11000E+01 volume  0.70494E-03 ppm1      1.726 ppm2      4.287 CV     1
 ASSI { 1008}
   (( segid "    " and resid 112  and name HG  ))
   (( segid "    " and resid 112  and name HA  ))
      3.100     1.200     1.200 peak  1008 spectrum    1 weight  0.11000E+01 volume  0.15889E-02 ppm1      1.969 ppm2      3.846 CV     1
 ASSI { 1009}
   (( segid "    " and resid 112  and name HG  ))
   (( segid "    " and resid 108  and name HA  ))
      3.600     1.600     1.600 peak  1009 spectrum    1 weight  0.11000E+01 volume  0.61104E-03 ppm1      1.968 ppm2      4.059 CV     1
 ASSI { 1011}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HA  ))
      4.100     2.100     1.900 peak  1011 spectrum    1 weight  0.11000E+01 volume  0.15519E-02 ppm1      2.236 ppm2      4.204 CV     1
 ASSI { 1013}
   (( segid "    " and resid 114  and name HD2 ))
   (( segid "    " and resid 114  and name HE2 ))
      3.100     1.200     1.200 peak  1013 spectrum    1 weight  0.11000E+01 volume  0.24420E-02 ppm1      1.998 ppm2      2.941 CV     1
 ASSI { 1014}
   (( segid "    " and resid 116  and name HD1 ))
   (( segid "    " and resid 113  and name HA  ))
      4.300     2.300     1.700 peak  1014 spectrum    1 weight  0.11000E+01 volume  0.24203E-03 ppm1      1.682 ppm2      3.259 CV     1
 ASSI { 1015}
   (( segid "    " and resid 116  and name HD1 ))
   (( segid "    " and resid 85   and name HA  ))
      5.700     5.700     0.300 peak  1015 spectrum    1 weight  0.11000E+01 volume  0.13688E-04 ppm1      1.746 ppm2      3.634 CV     1
 ASSI { 1016}
   (( segid "    " and resid 112  and name HB2 ))
   (  segid "    " and resid 112  and name HD1%)
      2.200     2.200     3.800 peak  1016 spectrum    1 weight  0.11000E+01 volume  0.74685E-02 ppm1      2.002 ppm2      0.815 CV     1
 ASSI { 1017}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 81   and name HB1 ))
      3.900     1.900     1.900 peak  1017 spectrum    1 weight  0.11000E+01 volume  0.30623E-02 ppm1      2.067 ppm2      1.081 CV     1
 ASSI { 1018}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 81   and name HB2 ))
      5.200     3.400     0.800 peak  1018 spectrum    1 weight  0.11000E+01 volume  0.14607E-02 ppm1      2.071 ppm2      1.540 CV     1
 ASSI { 1019}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 81   and name HB1 ))
      3.500     1.500     1.500 peak  1019 spectrum    1 weight  0.11000E+01 volume  0.31059E-02 ppm1      2.149 ppm2      1.082 CV     1
 ASSI { 1020}
   (( segid "    " and resid 56   and name HG12))
   (  segid "    " and resid 56   and name HG2%)
      1.800     1.800     4.200 peak  1020 spectrum    1 weight  0.11000E+01 volume  0.23572E-01 ppm1      1.924 ppm2      1.064 CV     1
 ASSI { 1021}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HB2 ))
      2.800     1.000     1.000 peak  1021 spectrum    1 weight  0.11000E+01 volume  0.27788E-02 ppm1      2.068 ppm2      2.541 CV     1
 ASSI { 1023}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HB2 ))
      2.400     0.700     0.700 peak  1023 spectrum    1 weight  0.11000E+01 volume  0.25909E-02 ppm1      2.155 ppm2      2.535 CV     1
 ASSI { 1024}
   (( segid "    " and resid 56   and name HG12))
   (( segid "    " and resid 56   and name HB  ))
      3.300     1.300     1.300 peak  1024 spectrum    1 weight  0.11000E+01 volume  0.13904E-02 ppm1      1.923 ppm2      2.418 CV     1
 ASSI { 1025}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 100  and name HA  ))
      4.200     2.200     1.800 peak  1025 spectrum    1 weight  0.11000E+01 volume  0.34647E-03 ppm1      1.535 ppm2      5.126 CV     1
 ASSI { 1026}
   (( segid "    " and resid 56   and name HG11))
   (( segid "    " and resid 59   and name HB  ))
      5.500     5.500     0.500 peak  1026 spectrum    1 weight  0.11000E+01 volume  0.33935E-03 ppm1      1.354 ppm2      4.473 CV     1
 ASSI { 1027}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 135  and name HA  ))
      4.000     2.000     2.000 peak  1027 spectrum    1 weight  0.11000E+01 volume  0.55857E-03 ppm1      1.486 ppm2      4.454 CV     1
 ASSI { 1028}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 101  and name HN  ))
      5.800     4.300     0.200 peak  1028 spectrum    1 weight  0.11000E+01 volume  0.12923E-03 ppm1      1.530 ppm2      8.650 CV     1
 ASSI { 1034}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HE2 ))
      2.100     2.100     3.900 peak  1034 spectrum    1 weight  0.11000E+01 volume  0.16234E-01 ppm1      1.695 ppm2      2.938 CV     1
 ASSI { 1035}
   (( segid "    " and resid 91   and name HD2 ))
   (( segid "    " and resid 91   and name HE2 ))
      1.900     1.900     4.100 peak  1035 spectrum    1 weight  0.11000E+01 volume  0.26139E-01 ppm1      1.753 ppm2      3.047 CV     1
 ASSI { 1037}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HE2 ))
      3.900     1.900     1.900 peak  1037 spectrum    1 weight  0.11000E+01 volume  0.11422E-02 ppm1      1.992 ppm2      3.091 CV     1
 ASSI { 1038}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HE1 ))
      4.900     2.900     1.100 peak  1038 spectrum    1 weight  0.11000E+01 volume  0.27865E-03 ppm1      1.924 ppm2      3.068 CV     1
 ASSI { 1039}
   (( segid "    " and resid 88   and name HD1 ))
   (( segid "    " and resid 88   and name HE1 ))
      3.500     1.500     1.500 peak  1039 spectrum    1 weight  0.11000E+01 volume  0.90623E-03 ppm1      2.198 ppm2      2.983 CV     1
 ASSI { 1041}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name HG2 ))
      2.600     0.900     0.900 peak  1041 spectrum    1 weight  0.11000E+01 volume  0.84205E-02 ppm1      2.155 ppm2      2.533 CV     1
 ASSI { 1042}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 51   and name HD2 ))
      2.900     2.900     3.100 peak  1042 spectrum    1 weight  0.11000E+01 volume  0.84032E-03 ppm1      1.679 ppm2      3.705 CV     1
 ASSI { 1043}
   (( segid "    " and resid 78   and name HD2 ))
   (( segid "    " and resid 75   and name HA  ))
      3.200     1.300     1.300 peak  1043 spectrum    1 weight  0.11000E+01 volume  0.74049E-03 ppm1      1.794 ppm2      4.369 CV     1
 ASSI { 1045}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 73   and name HA  ))
      4.600     2.700     1.400 peak  1045 spectrum    1 weight  0.11000E+01 volume  0.46119E-03 ppm1      1.159 ppm2      3.931 CV     1
 ASSI { 1048}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 115  and name HA  ))
      4.300     2.300     1.700 peak  1048 spectrum    1 weight  0.11000E+01 volume  0.19270E-02 ppm1      2.143 ppm2      3.733 CV     1
 ASSI { 1051}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 51   and name HA  ))
      3.200     3.200     2.800 peak  1051 spectrum    1 weight  0.11000E+01 volume  0.16393E-02 ppm1      2.212 ppm2      4.375 CV     1
 ASSI { 1053}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HA  ))
      3.800     1.800     1.800 peak  1053 spectrum    1 weight  0.11000E+01 volume  0.24877E-02 ppm1      1.643 ppm2      4.056 CV     1
 ASSI { 1054}
   (( segid "    " and resid 78   and name HD1 ))
   (( segid "    " and resid 78   and name HA  ))
      3.800     3.800     2.200 peak  1054 spectrum    1 weight  0.11000E+01 volume  0.27982E-02 ppm1      1.790 ppm2      4.059 CV     1
 ASSI { 1055}
   (( segid "    " and resid 66   and name HD1 ))
   (( segid "    " and resid 102  and name HB1 ))
      6.000     6.000     0.000 peak  1055 spectrum    1 weight  0.11000E+01 volume  0.35001E-04 ppm1      1.580 ppm2      2.570 CV     1
 ASSI { 1058}
   (( segid "    " and resid 97   and name HD1 ))
   (( segid "    " and resid 97   and name HN  ))
      2.500     2.500     3.500 peak  1058 spectrum    1 weight  0.11000E+01 volume  0.20061E-02 ppm1      1.688 ppm2      7.481 CV     1
 ASSI { 1059}
   (( segid "    " and resid 48   and name HD1 ))
   (( segid "    " and resid 48   and name HN  ))
      4.400     2.400     1.600 peak  1059 spectrum    1 weight  0.11000E+01 volume  0.10469E-02 ppm1      1.651 ppm2      7.606 CV     1
 ASSI { 1062}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 119  and name HN  ))
      2.500     2.500     3.500 peak  1062 spectrum    1 weight  0.11000E+01 volume  0.82418E-02 ppm1      2.150 ppm2      7.901 CV     1
 ASSI { 1065}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 77   and name HN  ))
      4.400     2.400     1.600 peak  1065 spectrum    1 weight  0.11000E+01 volume  0.60945E-03 ppm1      2.172 ppm2      8.572 CV     1
 ASSI { 1066}
   (( segid "    " and resid 12   and name HB1 ))
   (( segid "    " and resid 12   and name HN  ))
      3.200     1.300     1.300 peak  1066 spectrum    1 weight  0.11000E+01 volume  0.13185E-02 ppm1      2.002 ppm2      8.428 CV     1
 ASSI { 1068}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HN  ))
      3.500     3.500     2.500 peak  1068 spectrum    1 weight  0.11000E+01 volume  0.93778E-03 ppm1      2.008 ppm2      8.622 CV     1
 ASSI { 1069}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 72   and name HN  ))
      4.600     2.600     1.400 peak  1069 spectrum    1 weight  0.11000E+01 volume  0.37014E-03 ppm1      1.329 ppm2      8.894 CV     1
 ASSI { 1070}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HN  ))
      3.300     1.400     1.400 peak  1070 spectrum    1 weight  0.11000E+01 volume  0.23193E-03 ppm1      1.331 ppm2      8.718 CV     1
 ASSI { 1071}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 73   and name HN  ))
      6.000     4.800     0.000 peak  1071 spectrum    1 weight  0.11000E+01 volume  0.98938E-04 ppm1      1.154 ppm2      8.748 CV     1
 ASSI { 1072}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 72   and name HN  ))
      6.000     5.000     0.000 peak  1072 spectrum    1 weight  0.11000E+01 volume  0.22728E-03 ppm1      1.149 ppm2      8.884 CV     1
 ASSI { 1073}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 90   and name HE3 ))
      6.000     5.400     0.000 peak  1073 spectrum    1 weight  0.11000E+01 volume  0.95171E-04 ppm1      1.152 ppm2      7.336 CV     1
 ASSI { 1074}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HN  ))
      4.100     2.100     1.900 peak  1074 spectrum    1 weight  0.11000E+01 volume  0.55482E-03 ppm1      2.008 ppm2      7.449 CV     1
 ASSI { 1075}
   (( segid "    " and resid 114  and name HD1 ))
   (( segid "    " and resid 114  and name HA  ))
      2.900     2.900     3.100 peak  1075 spectrum    1 weight  0.11000E+01 volume  0.42263E-02 ppm1      2.002 ppm2      3.796 CV     1
 ASSI { 1076}
   (( segid "    " and resid 56   and name HG12))
   (( segid "    " and resid 56   and name HA  ))
      2.500     0.800     0.800 peak  1076 spectrum    1 weight  0.11000E+01 volume  0.24889E-02 ppm1      1.930 ppm2      3.886 CV     1
 ASSI { 1080}
   (( segid "    " and resid 116  and name HD1 ))
   (( segid "    " and resid 116  and name HE1 ))
      1.900     0.500     0.500 peak  1080 spectrum    1 weight  0.11000E+01 volume  0.12764E-01 ppm1      1.692 ppm2      2.967 CV     1
 ASSI { 1081}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HE2 ))
      2.300     0.600     0.600 peak  1081 spectrum    1 weight  0.11000E+01 volume  0.75846E-02 ppm1      1.642 ppm2      2.999 CV     1
 ASSI { 1083}
   (( segid "    " and resid 48   and name HD1 ))
   (( segid "    " and resid 48   and name HA  ))
      4.600     2.600     1.400 peak  1083 spectrum    1 weight  0.11000E+01 volume  0.12553E-02 ppm1      1.642 ppm2      4.077 CV     1
 ASSI { 1085}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HA  ))
      3.800     3.800     2.200 peak  1085 spectrum    1 weight  0.11000E+01 volume  0.33646E-02 ppm1      1.686 ppm2      4.098 CV     1
 ASSI { 1089}
   (( segid "    " and resid 116  and name HD2 ))
   (( segid "    " and resid 116  and name HB2 ))
      2.600     2.600     3.400 peak  1089 spectrum    1 weight  0.11000E+01 volume  0.35610E-02 ppm1      1.701 ppm2      2.026 CV     1
 ASSI { 1090}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 132  and name HA  ))
      2.800     2.800     3.200 peak  1090 spectrum    1 weight  0.11000E+01 volume  0.10335E-02 ppm1      1.490 ppm2      2.697 CV     1
 ASSI { 1091}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 135  and name HE2 ))
      3.700     1.700     1.700 peak  1091 spectrum    1 weight  0.11000E+01 volume  0.59172E-03 ppm1      1.491 ppm2      3.008 CV     1
 ASSI { 1092}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 135  and name HE1 ))
      3.600     1.600     1.600 peak  1092 spectrum    1 weight  0.11000E+01 volume  0.64366E-03 ppm1      1.373 ppm2      3.001 CV     1
 ASSI { 1093}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 132  and name HA  ))
      2.800     2.800     3.200 peak  1093 spectrum    1 weight  0.11000E+01 volume  0.92805E-03 ppm1      1.358 ppm2      2.696 CV     1
 ASSI { 1096}
   (( segid "    " and resid 114  and name HD1 ))
   (( segid "    " and resid 114  and name HE1 ))
      3.800     1.800     1.800 peak  1096 spectrum    1 weight  0.11000E+01 volume  0.68784E-03 ppm1      1.994 ppm2      3.396 CV     1
 ASSI { 1098}
   (( segid "    " and resid 114  and name HD1 ))
   (( segid "    " and resid 111  and name HA  ))
      6.000     5.000     0.000 peak  1098 spectrum    1 weight  0.11000E+01 volume  0.63055E-04 ppm1      1.971 ppm2      4.088 CV     1
 ASSI { 1109}
   (( segid "    " and resid 82   and name HG2 ))
   (  segid "    " and resid 85   and name HG2%)
      2.600     0.900     0.900 peak  1109 spectrum    1 weight  0.11000E+01 volume  0.15571E-02 ppm1      2.138 ppm2      1.087 CV     1
 ASSI { 1110}
   (( segid "    " and resid 82   and name HG2 ))
   (  segid "    " and resid 81   and name HD2%)
      3.800     3.800     2.200 peak  1110 spectrum    1 weight  0.11000E+01 volume  0.41625E-02 ppm1      2.156 ppm2      0.891 CV     1
 ASSI { 1115}
   (( segid "    " and resid 56   and name HG12))
   (( segid "    " and resid 56   and name HG11))
      1.600     0.300     0.600 peak  1115 spectrum    1 weight  0.11000E+01 volume  0.10161E-01 ppm1      1.928 ppm2      1.333 CV     1
 ASSI { 1116}
   (( segid "    " and resid 114  and name HD2 ))
   (( segid "    " and resid 114  and name HG2 ))
      2.100     0.500     0.500 peak  1116 spectrum    1 weight  0.11000E+01 volume  0.13933E-01 ppm1      2.018 ppm2      1.426 CV     1
 ASSI { 1117}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HG2 ))
      2.600     0.900     0.900 peak  1117 spectrum    1 weight  0.11000E+01 volume  0.72787E-02 ppm1      1.890 ppm2      2.170 CV     1
 ASSI { 1122}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 135  and name HB2 ))
      3.900     1.900     1.900 peak  1122 spectrum    1 weight  0.11000E+01 volume  0.99796E-03 ppm1      1.499 ppm2      2.000 CV     1
 ASSI { 1123}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HE2 ))
      3.500     1.600     1.600 peak  1123 spectrum    1 weight  0.11000E+01 volume  0.18722E-02 ppm1      1.332 ppm2      2.316 CV     1
 ASSI { 1132}
   (( segid "    " and resid 80   and name HD2 ))
   (( segid "    " and resid 80   and name HB2 ))
      2.500     0.800     0.800 peak  1132 spectrum    1 weight  0.11000E+01 volume  0.35610E-02 ppm1      1.701 ppm2      2.026 CV     1
 ASSI { 1134}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 84   and name HN  ))
      5.100     3.300     0.900 peak  1134 spectrum    1 weight  0.11000E+01 volume  0.81570E-04 ppm1      2.151 ppm2      7.001 CV     1
 ASSI { 1136}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 85   and name HN  ))
      6.000     6.000     0.000 peak  1136 spectrum    1 weight  0.11000E+01 volume  0.68735E-04 ppm1      2.074 ppm2      6.856 CV     1
 ASSI { 1150}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name HE3 ))
      2.600     0.800     0.800 peak  1150 spectrum    1 weight  0.11000E+01 volume  0.27336E-02 ppm1      3.416 ppm2      7.326 CV     1
 ASSI { 1152}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HE3 ))
      3.200     1.300     1.300 peak  1152 spectrum    1 weight  0.11000E+01 volume  0.16505E-02 ppm1      3.525 ppm2      7.704 CV     1
 ASSI { 1153}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 91   and name HN  ))
      2.700     0.900     0.900 peak  1153 spectrum    1 weight  0.11000E+01 volume  0.83565E-03 ppm1      3.298 ppm2      7.523 CV     1
 ASSI { 1154}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HE3 ))
      4.000     2.000     2.000 peak  1154 spectrum    1 weight  0.11000E+01 volume  0.16249E-02 ppm1      3.291 ppm2      7.329 CV     1
 ASSI { 1156}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HN  ))
      2.900     1.000     1.000 peak  1156 spectrum    1 weight  0.11000E+01 volume  0.14844E-02 ppm1      3.299 ppm2      8.679 CV     1
 ASSI { 1159}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 44   and name HE3 ))
      3.600     1.600     1.600 peak  1159 spectrum    1 weight  0.11000E+01 volume  0.67459E-03 ppm1      2.841 ppm2      7.692 CV     1
 ASSI { 1163}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 88   and name HA  ))
      5.400     3.700     0.600 peak  1163 spectrum    1 weight  0.11000E+01 volume  0.19034E-03 ppm1      3.319 ppm2      4.098 CV     1
 ASSI { 1164}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      6.000     5.800     0.000 peak  1164 spectrum    1 weight  0.11000E+01 volume  0.12475E-03 ppm1      3.425 ppm2      4.122 CV     1
 ASSI { 1174}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 73   and name HA  ))
      2.600     0.800     0.800 peak  1174 spectrum    1 weight  0.11000E+01 volume  0.22725E-02 ppm1      2.969 ppm2      3.992 CV     1
 ASSI { 1175}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 110  and name HB1 ))
      3.800     1.900     1.900 peak  1175 spectrum    1 weight  0.11000E+01 volume  0.59370E-03 ppm1      3.273 ppm2      1.198 CV     1
 ASSI { 1176}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 110  and name HB1 ))
      4.700     2.800     1.300 peak  1176 spectrum    1 weight  0.11000E+01 volume  0.47914E-03 ppm1      3.009 ppm2      1.185 CV     1
 ASSI { 1177}
   (( segid "    " and resid 76   and name HG1 ))
   (  segid "    " and resid 113  and name HD1%)
      5.600     3.900     0.400 peak  1177 spectrum    1 weight  0.11000E+01 volume  0.28666E-03 ppm1      2.962 ppm2      0.759 CV     1
 ASSI { 1179}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 129  and name HN  ))
      4.900     2.900     1.100 peak  1179 spectrum    1 weight  0.11000E+01 volume  0.22746E-03 ppm1      3.404 ppm2      8.019 CV     1
 ASSI { 1180}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 130  and name HN  ))
      5.500     3.800     0.500 peak  1180 spectrum    1 weight  0.11000E+01 volume  0.95580E-04 ppm1      3.410 ppm2      7.848 CV     1
 ASSI { 1181}
   (( segid "    " and resid 129  and name HB1 ))
   (( segid "    " and resid 129  and name HD2 ))
      4.500     2.500     1.500 peak  1181 spectrum    1 weight  0.11000E+01 volume  0.58237E-03 ppm1      3.036 ppm2      6.905 CV     1
 ASSI { 1183}
   (( segid "    " and resid 138  and name HB1 ))
   (( segid "    " and resid 138  and name HD2 ))
      4.400     2.400     1.600 peak  1183 spectrum    1 weight  0.11000E+01 volume  0.28627E-03 ppm1      3.098 ppm2      7.158 CV     1
 ASSI { 1184}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 129  and name HD2 ))
      3.400     1.400     1.400 peak  1184 spectrum    1 weight  0.11000E+01 volume  0.81030E-03 ppm1      3.412 ppm2      6.911 CV     1
 ASSI { 1187}
   (( segid "    " and resid 129  and name HB1 ))
   (( segid "    " and resid 130  and name HN  ))
      4.500     2.500     1.500 peak  1187 spectrum    1 weight  0.11000E+01 volume  0.57096E-03 ppm1      3.044 ppm2      7.850 CV     1
 ASSI { 1189}
   (( segid "    " and resid 138  and name HB1 ))
   (( segid "    " and resid 139  and name HN  ))
      5.900     4.400     0.100 peak  1189 spectrum    1 weight  0.11000E+01 volume  0.12723E-03 ppm1      3.092 ppm2      8.058 CV     1
 ASSI { 1191}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 118  and name HN  ))
      3.900     1.900     1.900 peak  1191 spectrum    1 weight  0.11000E+01 volume  0.96394E-03 ppm1      2.857 ppm2      7.800 CV     1
 ASSI { 1192}
   (( segid "    " and resid 120  and name HB2 ))
   (( segid "    " and resid 118  and name HN  ))
      5.300     3.500     0.700 peak  1192 spectrum    1 weight  0.11000E+01 volume  0.65161E-03 ppm1      3.057 ppm2      7.782 CV     1
 ASSI { 1202}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 77   and name HN  ))
      3.400     1.400     1.400 peak  1202 spectrum    1 weight  0.11000E+01 volume  0.62265E-03 ppm1      2.947 ppm2      8.582 CV     1
 ASSI { 1205}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 75   and name HN  ))
      4.400     2.500     1.600 peak  1205 spectrum    1 weight  0.11000E+01 volume  0.44703E-03 ppm1      2.962 ppm2      7.271 CV     1
 ASSI { 1206}
   (( segid "    " and resid 111  and name HB1 ))
   (  segid "    " and resid 53   and name HD% )
      6.000     6.000     0.000 peak  1206 spectrum    1 weight  0.11000E+01 volume  0.75066E-05 ppm1      3.021 ppm2      6.759 CV     1
 ASSI { 1208}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 76   and name HN  ))
      2.700     0.900     0.900 peak  1208 spectrum    1 weight  0.11000E+01 volume  0.27213E-02 ppm1      2.967 ppm2      8.416 CV     1
 ASSI { 1209}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 77   and name HN  ))
      3.300     1.400     1.400 peak  1209 spectrum    1 weight  0.11000E+01 volume  0.24489E-02 ppm1      2.960 ppm2      8.577 CV     1
 ASSI { 1211}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 112  and name HN  ))
      3.700     1.700     1.700 peak  1211 spectrum    1 weight  0.11000E+01 volume  0.16332E-02 ppm1      3.268 ppm2      8.266 CV     1
 ASSI { 1228}
   (( segid "    " and resid 88   and name HD1 ))
   (( segid "    " and resid 88   and name HG1 ))
      2.400     2.400     3.600 peak  1228 spectrum    1 weight  0.11000E+01 volume  0.59206E-02 ppm1      2.199 ppm2      1.398 CV     1
 ASSI { 1230}
   (( segid "    " and resid 88   and name HD2 ))
   (( segid "    " and resid 88   and name HG2 ))
      2.100     0.600     0.600 peak  1230 spectrum    1 weight  0.11000E+01 volume  0.12323E-01 ppm1      2.169 ppm2      1.702 CV     1
 ASSI { 1233}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 80   and name HB2 ))
      2.100     0.500     0.500 peak  1233 spectrum    1 weight  0.11000E+01 volume  0.37326E-02 ppm1      2.233 ppm2      2.021 CV     1
 ASSI { 1236}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 75   and name HB1 ))
      3.000     1.100     1.100 peak  1236 spectrum    1 weight  0.11000E+01 volume  0.10738E-02 ppm1      2.362 ppm2      1.960 CV     1
 ASSI { 1238}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 80   and name HD1 ))
      2.400     0.700     0.700 peak  1238 spectrum    1 weight  0.11000E+01 volume  0.55530E-02 ppm1      2.219 ppm2      1.738 CV     1
 ASSI { 1239}
   (( segid "    " and resid 80   and name HB1 ))
   (  segid "    " and resid 81   and name HD1%)
      6.000     6.000     0.000 peak  1239 spectrum    1 weight  0.11000E+01 volume  0.36649E-04 ppm1      2.192 ppm2      0.866 CV     1
 ASSI { 1240}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 56   and name HD1%)
      4.600     4.600     1.400 peak  1240 spectrum    1 weight  0.11000E+01 volume  0.19120E-02 ppm1      2.214 ppm2      1.083 CV     1
 ASSI { 1242}
   (( segid "    " and resid 75   and name HB2 ))
   (  segid "    " and resid 60   and name HD2%)
      4.000     4.000     2.000 peak  1242 spectrum    1 weight  0.11000E+01 volume  0.13091E-02 ppm1      2.162 ppm2      0.675 CV     1
 ASSI { 1245}
   (( segid "    " and resid 91   and name HD2 ))
   (  segid "    " and resid 92   and name HD1%)
      2.300     2.300     3.700 peak  1245 spectrum    1 weight  0.11000E+01 volume  0.34627E-02 ppm1      1.756 ppm2      0.817 CV     1
 ASSI { 1246}
   (( segid "    " and resid 78   and name HD2 ))
   (  segid "    " and resid 77   and name HG1%)
      3.200     3.200     2.800 peak  1246 spectrum    1 weight  0.11000E+01 volume  0.42119E-03 ppm1      1.784 ppm2      1.032 CV     1
 ASSI { 1252}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HG1 ))
      3.400     1.500     1.500 peak  1252 spectrum    1 weight  0.11000E+01 volume  0.15491E-02 ppm1      1.945 ppm2      1.381 CV     1
 ASSI { 1254}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HD1 ))
      2.500     0.800     0.800 peak  1254 spectrum    1 weight  0.11000E+01 volume  0.59924E-02 ppm1      1.944 ppm2      1.697 CV     1
 ASSI { 1264}
   (( segid "    " and resid 129  and name HB2 ))
   (  segid "    " and resid 45   and name HG2%)
      2.300     2.300     3.700 peak  1264 spectrum    1 weight  0.11000E+01 volume  0.30705E-02 ppm1      3.417 ppm2      0.827 CV     1
 ASSI { 1265}
   (( segid "    " and resid 129  and name HB1 ))
   (  segid "    " and resid 45   and name HG2%)
      5.000     5.000     1.000 peak  1265 spectrum    1 weight  0.11000E+01 volume  0.31910E-04 ppm1      3.029 ppm2      0.822 CV     1
 ASSI { 1271}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name HG1 ))
      1.600     0.300     0.600 peak  1271 spectrum    1 weight  0.11000E+01 volume  0.10904E-01 ppm1      2.118 ppm2      1.533 CV     1
 ASSI { 1273}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HB2 ))
      2.100     0.600     0.600 peak  1273 spectrum    1 weight  0.11000E+01 volume  0.85704E-02 ppm1      2.230 ppm2      2.447 CV     1
 ASSI { 1274}
   (( segid "    " and resid 128  and name HG1 ))
   (  segid "    " and resid 131  and name HG2%)
      3.200     3.200     2.800 peak  1274 spectrum    1 weight  0.11000E+01 volume  0.50182E-02 ppm1      2.119 ppm2      0.915 CV     1
 ASSI { 1277}
   (( segid "    " and resid 112  and name HG  ))
   (  segid "    " and resid 112  and name HD1%)
      2.000     0.500     0.500 peak  1277 spectrum    1 weight  0.11000E+01 volume  0.89731E-02 ppm1      1.959 ppm2      0.780 CV     1
 ASSI { 1289}
   (( segid "    " and resid 78   and name HD2 ))
   (( segid "    " and resid 78   and name HA  ))
      3.500     1.600     1.600 peak  1289 spectrum    1 weight  0.11000E+01 volume  0.72667E-02 ppm1      1.799 ppm2      4.061 CV     1
 ASSI { 1292}
   (( segid "    " and resid 78   and name HB2 ))
   (( segid "    " and resid 78   and name HA  ))
      2.700     0.900     0.900 peak  1292 spectrum    1 weight  0.11000E+01 volume  0.37317E-02 ppm1      2.000 ppm2      4.092 CV     1
 ASSI { 1301}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 133  and name HA  ))
      6.000     4.600     0.000 peak  1301 spectrum    1 weight  0.11000E+01 volume  0.11436E-03 ppm1      1.747 ppm2      3.602 CV     1
 ASSI { 1303}
   (( segid "    " and resid 136  and name HB1 ))
   (( segid "    " and resid 133  and name HA  ))
      5.700     4.000     0.300 peak  1303 spectrum    1 weight  0.11000E+01 volume  0.10483E-03 ppm1      1.610 ppm2      3.612 CV     1
 ASSI { 1304}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HD2 ))
      5.600     3.900     0.400 peak  1304 spectrum    1 weight  0.11000E+01 volume  0.15825E-03 ppm1      1.198 ppm2      3.436 CV     1
 ASSI { 1310}
   (( segid "    " and resid 77   and name HB  ))
   (( segid "    " and resid 77   and name HA  ))
      2.400     0.700     0.700 peak  1310 spectrum    1 weight  0.11000E+01 volume  0.76853E-02 ppm1      2.304 ppm2      3.997 CV     1
 ASSI { 1311}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 128  and name HD2 ))
      2.700     0.900     0.900 peak  1311 spectrum    1 weight  0.11000E+01 volume  0.17997E-02 ppm1      2.476 ppm2      3.891 CV     1
 ASSI { 1312}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HD2 ))
      2.800     1.000     1.000 peak  1312 spectrum    1 weight  0.11000E+01 volume  0.33359E-02 ppm1      2.474 ppm2      4.067 CV     1
 ASSI { 1316}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 82   and name HA  ))
      4.200     2.200     1.800 peak  1316 spectrum    1 weight  0.11000E+01 volume  0.91196E-04 ppm1      2.137 ppm2      4.523 CV     1
 ASSI { 1319}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 26   and name HA  ))
      2.200     2.200     3.800 peak  1319 spectrum    1 weight  0.11000E+01 volume  0.78140E-02 ppm1      2.003 ppm2      4.090 CV     1
 ASSI { 1320}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 127  and name HD2 ))
      2.800     1.000     1.000 peak  1320 spectrum    1 weight  0.11000E+01 volume  0.11277E-01 ppm1      1.933 ppm2      4.095 CV     1
 ASSI { 1322}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HA  ))
      2.800     1.000     1.000 peak  1322 spectrum    1 weight  0.11000E+01 volume  0.24194E-02 ppm1      1.765 ppm2      4.272 CV     1
 ASSI { 1324}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 116  and name HA  ))
      4.000     2.000     2.000 peak  1324 spectrum    1 weight  0.11000E+01 volume  0.39678E-03 ppm1      1.738 ppm2      4.535 CV     1
 ASSI { 1334}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 127  and name HD1 ))
      3.800     1.800     1.800 peak  1334 spectrum    1 weight  0.11000E+01 volume  0.15869E-02 ppm1      1.913 ppm2      3.480 CV     1
 ASSI { 1338}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HD1 ))
      5.000     3.100     1.000 peak  1338 spectrum    1 weight  0.11000E+01 volume  0.36584E-03 ppm1      1.533 ppm2      3.106 CV     1
 ASSI { 1340}
   (( segid "    " and resid 137  and name HB1 ))
   (( segid "    " and resid 137  and name HD2 ))
      3.100     1.200     1.200 peak  1340 spectrum    1 weight  0.11000E+01 volume  0.13333E-02 ppm1      1.668 ppm2      3.156 CV     1
 ASSI { 1342}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 113  and name HA  ))
      4.100     2.100     1.900 peak  1342 spectrum    1 weight  0.11000E+01 volume  0.21972E-03 ppm1      1.742 ppm2      3.311 CV     1
 ASSI { 1344}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 114  and name HE2 ))
      3.700     1.700     1.700 peak  1344 spectrum    1 weight  0.11000E+01 volume  0.51613E-03 ppm1      1.966 ppm2      2.966 CV     1
 ASSI { 1345}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 114  and name HE2 ))
      6.000     5.100     0.000 peak  1345 spectrum    1 weight  0.11000E+01 volume  0.34588E-04 ppm1      1.835 ppm2      2.961 CV     1
 ASSI { 1346}
   (( segid "    " and resid 77   and name HB  ))
   (( segid "    " and resid 74   and name HE2 ))
      2.600     2.600     3.400 peak  1346 spectrum    1 weight  0.11000E+01 volume  0.14229E-02 ppm1      2.324 ppm2      2.966 CV     1
 ASSI { 1351}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 127  and name HA  ))
      5.000     3.100     1.000 peak  1351 spectrum    1 weight  0.11000E+01 volume  0.39799E-04 ppm1      1.928 ppm2      4.837 CV     1
 ASSI { 1354}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HD1 ))
      4.200     2.200     1.800 peak  1354 spectrum    1 weight  0.11000E+01 volume  0.43935E-03 ppm1      1.195 ppm2      3.104 CV     1
 ASSI { 1356}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 129  and name HN  ))
      4.900     3.000     1.100 peak  1356 spectrum    1 weight  0.11000E+01 volume  0.40976E-04 ppm1      2.476 ppm2      8.008 CV     1
 ASSI { 1359}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 107  and name HN  ))
      3.800     1.800     1.800 peak  1359 spectrum    1 weight  0.11000E+01 volume  0.15599E-02 ppm1      2.098 ppm2      8.034 CV     1
 ASSI { 1362}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 129  and name HE1 ))
      2.800     1.000     1.000 peak  1362 spectrum    1 weight  0.11000E+01 volume  0.27247E-02 ppm1      1.932 ppm2      7.815 CV     1
 ASSI { 1363}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 129  and name HN  ))
      3.900     1.900     1.900 peak  1363 spectrum    1 weight  0.11000E+01 volume  0.17178E-02 ppm1      1.927 ppm2      8.034 CV     1
 ASSI { 1365}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 121  and name HN  ))
      3.800     1.800     1.800 peak  1365 spectrum    1 weight  0.11000E+01 volume  0.11587E-02 ppm1      1.990 ppm2      8.430 CV     1
 ASSI { 1369}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 105  and name HN  ))
      4.900     3.000     1.100 peak  1369 spectrum    1 weight  0.11000E+01 volume  0.57813E-04 ppm1      2.092 ppm2      8.787 CV     1
 ASSI { 1372}
   (( segid "    " and resid 51   and name HB1 ))
   (( segid "    " and resid 53   and name HN  ))
      4.400     2.500     1.600 peak  1372 spectrum    1 weight  0.11000E+01 volume  0.13358E-02 ppm1      1.810 ppm2      7.170 CV     1
 ASSI { 1373}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HH22))
      5.100     3.300     0.900 peak  1373 spectrum    1 weight  0.11000E+01 volume  0.10453E-02 ppm1      1.782 ppm2      7.172 CV     1
 ASSI { 1374}
   (( segid "    " and resid 136  and name HB1 ))
   (( segid "    " and resid 136  and name HH22))
      4.900     3.000     1.100 peak  1374 spectrum    1 weight  0.11000E+01 volume  0.98500E-03 ppm1      1.600 ppm2      7.141 CV     1
 ASSI { 1376}
   (( segid "    " and resid 51   and name HB1 ))
   (( segid "    " and resid 52   and name HN  ))
      3.300     1.400     1.400 peak  1376 spectrum    1 weight  0.11000E+01 volume  0.35833E-02 ppm1      1.805 ppm2      7.349 CV     1
 ASSI { 1384}
   (( segid "    " and resid 137  and name HB1 ))
   (( segid "    " and resid 137  and name HN  ))
      6.000     5.000     0.000 peak  1384 spectrum    1 weight  0.11000E+01 volume  0.35590E-04 ppm1      1.672 ppm2      8.161 CV     1
 ASSI { 1389}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 122  and name HN  ))
      4.100     2.100     1.900 peak  1389 spectrum    1 weight  0.11000E+01 volume  0.13989E-02 ppm1      1.839 ppm2      8.591 CV     1
 ASSI { 1398}
   (( segid "    " and resid 113  and name HG11))
   (( segid "    " and resid 113  and name HN  ))
      3.500     1.500     1.500 peak  1398 spectrum    1 weight  0.11000E+01 volume  0.26838E-03 ppm1      0.749 ppm2      7.697 CV     1
 ASSI { 1399}
   (( segid "    " and resid 113  and name HG12))
   (( segid "    " and resid 113  and name HN  ))
      5.400     3.700     0.600 peak  1399 spectrum    1 weight  0.11000E+01 volume  0.16635E-03 ppm1      0.717 ppm2      7.701 CV     1
 ASSI { 1400}
   (( segid "    " and resid 113  and name HG12))
   (( segid "    " and resid 116  and name HN  ))
      5.500     3.800     0.500 peak  1400 spectrum    1 weight  0.11000E+01 volume  0.17774E-03 ppm1      0.751 ppm2      7.855 CV     1
 ASSI { 1402}
   (( segid "    " and resid 113  and name HG11))
   (( segid "    " and resid 112  and name HN  ))
      4.400     2.400     1.600 peak  1402 spectrum    1 weight  0.11000E+01 volume  0.49228E-03 ppm1      0.748 ppm2      8.223 CV     1
 ASSI { 1403}
   (( segid "    " and resid 120  and name HB2 ))
   (  segid "    " and resid 115  and name HG1%)
      4.100     2.100     1.900 peak  1403 spectrum    1 weight  0.11000E+01 volume  0.32390E-02 ppm1      3.051 ppm2      0.656 CV     1
 ASSI { 1406}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HG1 ))
      3.200     1.300     1.300 peak  1406 spectrum    1 weight  0.11000E+01 volume  0.22248E-02 ppm1      2.474 ppm2      1.537 CV     1
 ASSI { 1409}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 51   and name HB1 ))
      1.600     0.300     0.600 peak  1409 spectrum    1 weight  0.11000E+01 volume  0.17977E-01 ppm1      2.392 ppm2      1.812 CV     1
 ASSI { 1410}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 51   and name HG2 ))
      2.000     0.500     0.500 peak  1410 spectrum    1 weight  0.11000E+01 volume  0.10370E-01 ppm1      2.388 ppm2      2.062 CV     1
 ASSI { 1411}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HG2 ))
      1.800     0.400     0.400 peak  1411 spectrum    1 weight  0.11000E+01 volume  0.15824E-01 ppm1      2.475 ppm2      2.118 CV     1
 ASSI { 1419}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 113  and name HG12))
      2.200     0.600     0.600 peak  1419 spectrum    1 weight  0.11000E+01 volume  0.15927E-01 ppm1      1.936 ppm2      0.740 CV     1
 ASSI { 1430}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 127  and name HB2 ))
      1.600     0.300     0.600 peak  1430 spectrum    1 weight  0.11000E+01 volume  0.94520E-02 ppm1      1.927 ppm2      2.471 CV     1
 ASSI { 1436}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HG2 ))
      2.700     0.900     0.900 peak  1436 spectrum    1 weight  0.11000E+01 volume  0.33114E-02 ppm1      1.993 ppm2      1.507 CV     1
 ASSI { 1437}
   (( segid "    " and resid 45   and name HB  ))
   (  segid "    " and resid 46   and name HG1%)
      6.000     6.000     0.000 peak  1437 spectrum    1 weight  0.11000E+01 volume  0.23461E-04 ppm1      2.118 ppm2     -0.207 CV     1
 ASSI { 1438}
   (( segid "    " and resid 111  and name HB1 ))
   (  segid "    " and resid 112  and name HD2%)
      3.700     3.700     2.300 peak  1438 spectrum    1 weight  0.11000E+01 volume  0.10244E-02 ppm1      2.962 ppm2      0.757 CV     1
 ASSI { 1439}
   (( segid "    " and resid 77   and name HB  ))
   (  segid "    " and resid 86   and name HD1%)
      2.900     2.900     3.100 peak  1439 spectrum    1 weight  0.11000E+01 volume  0.86070E-02 ppm1      2.312 ppm2      0.807 CV     1
 ASSI { 1440}
   (( segid "    " and resid 77   and name HB  ))
   (  segid "    " and resid 77   and name HG2%)
      1.900     0.500     0.500 peak  1440 spectrum    1 weight  0.11000E+01 volume  0.16115E-01 ppm1      2.308 ppm2      1.039 CV     1
 ASSI { 1441}
   (( segid "    " and resid 45   and name HB  ))
   (  segid "    " and resid 45   and name HG2%)
      2.100     0.500     0.500 peak  1441 spectrum    1 weight  0.11000E+01 volume  0.15196E-01 ppm1      2.122 ppm2      0.798 CV     1
 ASSI { 1444}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HG1 ))
      2.300     0.700     0.700 peak  1444 spectrum    1 weight  0.11000E+01 volume  0.29944E-02 ppm1      2.303 ppm2      1.497 CV     1
 ASSI { 1445}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HG1 ))
      3.000     1.100     1.100 peak  1445 spectrum    1 weight  0.11000E+01 volume  0.12282E-02 ppm1      2.097 ppm2      1.287 CV     1
 ASSI { 1446}
   (( segid "    " and resid 128  and name HB2 ))
   (  segid "    " and resid 131  and name HG2%)
      3.800     3.800     2.200 peak  1446 spectrum    1 weight  0.11000E+01 volume  0.24707E-02 ppm1      2.425 ppm2      0.938 CV     1
 ASSI { 1450}
   (( segid "    " and resid 131  and name HB  ))
   (  segid "    " and resid 131  and name HG1%)
      2.100     0.600     0.600 peak  1450 spectrum    1 weight  0.11000E+01 volume  0.14975E-01 ppm1      1.951 ppm2      0.819 CV     1
 ASSI { 1451}
   (( segid "    " and resid 131  and name HB  ))
   (  segid "    " and resid 131  and name HG2%)
      2.000     0.500     0.500 peak  1451 spectrum    1 weight  0.11000E+01 volume  0.22057E-01 ppm1      1.976 ppm2      0.973 CV     1
 ASSI { 1455}
   (( segid "    " and resid 73   and name HE2 ))
   (( segid "    " and resid 73   and name HB1 ))
      2.300     0.700     0.700 peak  1455 spectrum    1 weight  0.11000E+01 volume  0.51454E-02 ppm1      2.268 ppm2      1.667 CV     1
 ASSI { 1458}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HG1 ))
      1.800     1.800     4.200 peak  1458 spectrum    1 weight  0.11000E+01 volume  0.36972E-01 ppm1      1.974 ppm2      1.461 CV     1
 ASSI { 1459}
   (( segid "    " and resid 78   and name HB1 ))
   (( segid "    " and resid 78   and name HD1 ))
      1.600     1.600     4.400 peak  1459 spectrum    1 weight  0.11000E+01 volume  0.76323E-01 ppm1      1.967 ppm2      1.709 CV     1
 ASSI { 1463}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HG2 ))
      2.000     0.500     0.500 peak  1463 spectrum    1 weight  0.11000E+01 volume  0.10330E-01 ppm1      1.797 ppm2      1.324 CV     1
 ASSI { 1464}
   (( segid "    " and resid 135  and name HB1 ))
   (  segid "    " and resid 95   and name HG1%)
      3.500     3.500     2.500 peak  1464 spectrum    1 weight  0.11000E+01 volume  0.17854E-02 ppm1      1.509 ppm2      0.873 CV     1
 ASSI { 1465}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HG1 ))
      2.900     1.100     1.100 peak  1465 spectrum    1 weight  0.11000E+01 volume  0.12569E-02 ppm1      1.513 ppm2      1.071 CV     1
 ASSI { 1467}
   (( segid "    " and resid 77   and name HB  ))
   (( segid "    " and resid 78   and name HE2 ))
      3.600     1.600     1.600 peak  1467 spectrum    1 weight  0.11000E+01 volume  0.14490E-02 ppm1      2.336 ppm2      2.965 CV     1
 ASSI { 1469}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HE2 ))
      3.400     1.400     1.400 peak  1469 spectrum    1 weight  0.11000E+01 volume  0.19967E-02 ppm1      1.959 ppm2      2.968 CV     1
 ASSI { 1470}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name HG2 ))
      3.600     1.700     1.700 peak  1470 spectrum    1 weight  0.11000E+01 volume  0.12685E-02 ppm1      2.056 ppm2      2.596 CV     1
 ASSI { 1472}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HB2 ))
      1.900     0.400     0.400 peak  1472 spectrum    1 weight  0.11000E+01 volume  0.61774E-02 ppm1      1.885 ppm2      2.551 CV     1
 ASSI { 1473}
   (( segid "    " and resid 133  and name HB1 ))
   (( segid "    " and resid 133  and name HB2 ))
      2.200     0.600     0.600 peak  1473 spectrum    1 weight  0.11000E+01 volume  0.28413E-02 ppm1      1.854 ppm2      2.176 CV     1
 ASSI { 1475}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 132  and name HD2 ))
      6.000     4.700     0.000 peak  1475 spectrum    1 weight  0.11000E+01 volume  0.27259E-04 ppm1      1.505 ppm2      4.318 CV     1
 ASSI { 1478}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HA  ))
      4.100     2.100     1.900 peak  1478 spectrum    1 weight  0.11000E+01 volume  0.19431E-03 ppm1      1.939 ppm2      4.410 CV     1
 ASSI { 1479}
   (( segid "    " and resid 23   and name HB1 ))
   (( segid "    " and resid 23   and name HA  ))
      4.000     2.000     2.000 peak  1479 spectrum    1 weight  0.11000E+01 volume  0.29096E-03 ppm1      1.948 ppm2      4.522 CV     1
 ASSI { 1483}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HA  ))
      2.600     0.800     0.800 peak  1483 spectrum    1 weight  0.11000E+01 volume  0.18052E-02 ppm1      1.677 ppm2      3.939 CV     1
 ASSI { 1486}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 116  and name HE2 ))
      4.600     4.600     1.400 peak  1486 spectrum    1 weight  0.11000E+01 volume  0.32057E-03 ppm1      1.788 ppm2      2.955 CV     1
 ASSI { 1488}
   (( segid "    " and resid 128  and name HB1 ))
   (( segid "    " and resid 128  and name HD1 ))
      5.200     3.400     0.800 peak  1488 spectrum    1 weight  0.11000E+01 volume  0.14383E-03 ppm1      2.049 ppm2      3.420 CV     1
 ASSI { 1489}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
      3.700     1.700     1.700 peak  1489 spectrum    1 weight  0.11000E+01 volume  0.79672E-03 ppm1      2.045 ppm2      3.647 CV     1
 ASSI { 1491}
   (( segid "    " and resid 131  and name HB  ))
   (( segid "    " and resid 131  and name HA  ))
      2.900     1.000     1.000 peak  1491 spectrum    1 weight  0.11000E+01 volume  0.17317E-02 ppm1      1.942 ppm2      3.684 CV     1
 ASSI { 1493}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HA  ))
      3.600     1.600     1.600 peak  1493 spectrum    1 weight  0.11000E+01 volume  0.18908E-02 ppm1      2.171 ppm2      3.613 CV     1
 ASSI { 1499}
   (( segid "    " and resid 135  and name HB1 ))
   (  segid "    " and resid 135  and name HZ% )
      4.300     2.300     1.700 peak  1499 spectrum    1 weight  0.11000E+01 volume  0.51917E-03 ppm1      1.502 ppm2      7.955 CV     1
 ASSI { 1500}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HN  ))
      5.200     3.400     0.800 peak  1500 spectrum    1 weight  0.11000E+01 volume  0.13441E-03 ppm1      1.498 ppm2      7.765 CV     1
 ASSI { 1501}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 72   and name HN  ))
      4.600     2.600     1.400 peak  1501 spectrum    1 weight  0.11000E+01 volume  0.15837E-02 ppm1      1.661 ppm2      8.876 CV     1
 ASSI { 1502}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HN  ))
      3.900     1.900     1.900 peak  1502 spectrum    1 weight  0.11000E+01 volume  0.11802E-02 ppm1      1.667 ppm2      8.738 CV     1
 ASSI { 1503}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 72   and name HN  ))
      3.900     1.900     1.900 peak  1503 spectrum    1 weight  0.11000E+01 volume  0.14724E-02 ppm1      1.785 ppm2      8.889 CV     1
 ASSI { 1504}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
      3.500     1.600     1.600 peak  1504 spectrum    1 weight  0.11000E+01 volume  0.39584E-03 ppm1      1.790 ppm2      8.724 CV     1
 ASSI { 1505}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 76   and name HN  ))
      4.700     2.800     1.300 peak  1505 spectrum    1 weight  0.11000E+01 volume  0.68133E-03 ppm1      1.789 ppm2      8.430 CV     1
 ASSI { 1507}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 135  and name HZ% )
      3.900     1.900     1.900 peak  1507 spectrum    1 weight  0.11000E+01 volume  0.56970E-03 ppm1      1.788 ppm2      7.991 CV     1
 ASSI { 1511}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
      6.000     4.900     0.000 peak  1511 spectrum    1 weight  0.11000E+01 volume  0.73712E-04 ppm1      1.781 ppm2      7.282 CV     1
 ASSI { 1514}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 13   and name HN  ))
      3.300     1.400     1.400 peak  1514 spectrum    1 weight  0.11000E+01 volume  0.14818E-02 ppm1      1.950 ppm2      8.055 CV     1
 ASSI { 1515}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.800     1.800     1.800 peak  1515 spectrum    1 weight  0.11000E+01 volume  0.14331E-02 ppm1      1.943 ppm2      8.228 CV     1
 ASSI { 1516}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 14   and name HN  ))
      3.500     1.600     1.600 peak  1516 spectrum    1 weight  0.11000E+01 volume  0.18711E-02 ppm1      1.985 ppm2      8.212 CV     1
 ASSI { 1518}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 27   and name HN  ))
      3.700     1.700     1.700 peak  1518 spectrum    1 weight  0.11000E+01 volume  0.17775E-02 ppm1      2.032 ppm2      8.058 CV     1
 ASSI { 1528}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 85   and name HG2%)
      4.300     2.300     1.700 peak  1528 spectrum    1 weight  0.11000E+01 volume  0.15620E-02 ppm1      2.542 ppm2      1.098 CV     1
 ASSI { 1531}
   (( segid "    " and resid 23   and name HG2 ))
   (( segid "    " and resid 23   and name HB2 ))
      2.400     0.700     0.700 peak  1531 spectrum    1 weight  0.11000E+01 volume  0.13201E-01 ppm1      2.541 ppm2      2.122 CV     1
 ASSI { 1532}
   (( segid "    " and resid 23   and name HG1 ))
   (( segid "    " and resid 23   and name HB1 ))
      2.500     0.800     0.800 peak  1532 spectrum    1 weight  0.11000E+01 volume  0.10572E-01 ppm1      2.507 ppm2      2.013 CV     1
 ASSI { 1534}
   (( segid "    " and resid 82   and name HB1 ))
   (  segid "    " and resid 85   and name HG2%)
      4.300     2.300     1.700 peak  1534 spectrum    1 weight  0.11000E+01 volume  0.29253E-02 ppm1      1.897 ppm2      1.087 CV     1
 ASSI { 1537}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 42   and name HG1%)
      2.300     0.600     0.600 peak  1537 spectrum    1 weight  0.11000E+01 volume  0.10451E-01 ppm1      2.089 ppm2      0.900 CV     1
 ASSI { 1539}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HG1 ))
      2.600     0.800     0.800 peak  1539 spectrum    1 weight  0.11000E+01 volume  0.21203E-02 ppm1      1.890 ppm2      2.121 CV     1
 ASSI { 1543}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HD2 ))
      3.800     1.800     1.800 peak  1543 spectrum    1 weight  0.11000E+01 volume  0.13284E-02 ppm1      1.894 ppm2      3.992 CV     1
 ASSI { 1546}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 42   and name HA  ))
      2.500     0.800     0.800 peak  1546 spectrum    1 weight  0.11000E+01 volume  0.43781E-02 ppm1      2.073 ppm2      4.122 CV     1
 ASSI { 1547}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HD1 ))
      3.700     1.700     1.700 peak  1547 spectrum    1 weight  0.11000E+01 volume  0.57919E-03 ppm1      1.893 ppm2      3.343 CV     1
 ASSI { 1548}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HA  ))
      3.600     1.600     1.600 peak  1548 spectrum    1 weight  0.11000E+01 volume  0.41286E-03 ppm1      1.892 ppm2      4.511 CV     1
 ASSI { 1549}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 84   and name HN  ))
      6.000     4.800     0.000 peak  1549 spectrum    1 weight  0.11000E+01 volume  0.15487E-03 ppm1      1.889 ppm2      6.983 CV     1
 ASSI { 1552}
   (( segid "    " and resid 78   and name HB1 ))
   (( segid "    " and resid 78   and name HN  ))
      2.600     0.800     0.800 peak  1552 spectrum    1 weight  0.11000E+01 volume  0.40919E-02 ppm1      1.937 ppm2      7.364 CV     1
 ASSI { 1555}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 92   and name HN  ))
      3.800     1.800     1.800 peak  1555 spectrum    1 weight  0.11000E+01 volume  0.88262E-03 ppm1      1.938 ppm2      7.689 CV     1
 ASSI { 1559}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 43   and name HN  ))
      5.400     3.600     0.600 peak  1559 spectrum    1 weight  0.11000E+01 volume  0.35259E-03 ppm1      2.081 ppm2      8.426 CV     1
 ASSI { 1560}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      4.700     2.800     1.300 peak  1560 spectrum    1 weight  0.11000E+01 volume  0.55038E-03 ppm1      2.091 ppm2      8.577 CV     1
 ASSI { 1561}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 84   and name HN  ))
      3.600     1.600     1.600 peak  1561 spectrum    1 weight  0.11000E+01 volume  0.38480E-03 ppm1      2.540 ppm2      7.010 CV     1
 ASSI { 1562}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 85   and name HN  ))
      5.100     3.300     0.900 peak  1562 spectrum    1 weight  0.11000E+01 volume  0.16120E-03 ppm1      2.543 ppm2      6.833 CV     1
 ASSI { 1563}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
      3.000     1.100     1.100 peak  1563 spectrum    1 weight  0.11000E+01 volume  0.22153E-02 ppm1      2.228 ppm2      0.760 CV     1
 ASSI { 1564}
   (( segid "    " and resid 76   and name HB1 ))
   (  segid "    " and resid 86   and name HD1%)
      4.000     2.000     2.000 peak  1564 spectrum    1 weight  0.11000E+01 volume  0.12221E-02 ppm1      2.157 ppm2      0.765 CV     1
 ASSI { 1565}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 109  and name HB% )
      4.700     4.700     1.300 peak  1565 spectrum    1 weight  0.11000E+01 volume  0.60087E-03 ppm1      2.260 ppm2      1.187 CV     1
 ASSI { 1566}
   (( segid "    " and resid 76   and name HB1 ))
   (  segid "    " and resid 109  and name HB% )
      4.800     4.800     1.200 peak  1566 spectrum    1 weight  0.11000E+01 volume  0.13853E-03 ppm1      2.187 ppm2      1.191 CV     1
 ASSI { 1567}
   (( segid "    " and resid 76   and name HB1 ))
   (  segid "    " and resid 77   and name HG2%)
      6.000     5.900     0.000 peak  1567 spectrum    1 weight  0.11000E+01 volume  0.79980E-04 ppm1      2.181 ppm2      1.050 CV     1
 ASSI { 1568}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 63   and name HG2%)
      2.200     0.600     0.600 peak  1568 spectrum    1 weight  0.11000E+01 volume  0.10853E-01 ppm1      1.948 ppm2      0.924 CV     1
 ASSI { 1569}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 77   and name HG2%)
      5.700     5.700     0.300 peak  1569 spectrum    1 weight  0.11000E+01 volume  0.92757E-04 ppm1      2.244 ppm2      1.073 CV     1
 ASSI { 1570}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HA  ))
      2.900     1.100     1.100 peak  1570 spectrum    1 weight  0.11000E+01 volume  0.17662E-02 ppm1      2.225 ppm2      3.980 CV     1
 ASSI { 1572}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HG2 ))
      3.300     1.400     1.400 peak  1572 spectrum    1 weight  0.11000E+01 volume  0.13228E-02 ppm1      2.237 ppm2      3.007 CV     1
 ASSI { 1574}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 76   and name HG2 ))
      2.700     0.900     0.900 peak  1574 spectrum    1 weight  0.11000E+01 volume  0.12155E-02 ppm1      2.153 ppm2      2.987 CV     1
 ASSI { 1575}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 64   and name HB2 ))
      6.000     6.000     0.000 peak  1575 spectrum    1 weight  0.11000E+01 volume  0.14248E-04 ppm1      1.945 ppm2      3.118 CV     1
 ASSI { 1576}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 77   and name HN  ))
      3.600     1.600     1.600 peak  1576 spectrum    1 weight  0.11000E+01 volume  0.89269E-03 ppm1      2.208 ppm2      8.579 CV     1
 ASSI { 1577}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 76   and name HN  ))
      3.700     1.700     1.700 peak  1577 spectrum    1 weight  0.11000E+01 volume  0.50553E-03 ppm1      2.205 ppm2      8.431 CV     1
 ASSI { 1579}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 65   and name HN  ))
      3.600     1.600     1.600 peak  1579 spectrum    1 weight  0.11000E+01 volume  0.18541E-02 ppm1      1.949 ppm2      8.827 CV     1
 ASSI { 1582}
   (( segid "    " and resid 121  and name HG2 ))
   (( segid "    " and resid 121  and name HA  ))
      4.300     2.300     1.700 peak  1582 spectrum    1 weight  0.11000E+01 volume  0.62959E-03 ppm1      2.392 ppm2      4.318 CV     1
 ASSI { 1586}
   (( segid "    " and resid 37   and name HG1 ))
   (( segid "    " and resid 37   and name HA  ))
      3.200     1.300     1.300 peak  1586 spectrum    1 weight  0.11000E+01 volume  0.28838E-02 ppm1      2.196 ppm2      4.264 CV     1
 ASSI { 1587}
   (( segid "    " and resid 118  and name HG1 ))
   (( segid "    " and resid 116  and name HA  ))
      5.600     3.900     0.400 peak  1587 spectrum    1 weight  0.11000E+01 volume  0.95701E-04 ppm1      2.203 ppm2      4.518 CV     1
 ASSI { 1589}
   (( segid "    " and resid 55   and name HG1 ))
   (  segid "    " and resid 56   and name HD1%)
      4.500     2.500     1.500 peak  1589 spectrum    1 weight  0.11000E+01 volume  0.82852E-03 ppm1      2.350 ppm2      1.094 CV     1
 ASSI { 1592}
   (( segid "    " and resid 118  and name HG1 ))
   (  segid "    " and resid 117  and name HD1%)
      4.300     4.300     1.700 peak  1592 spectrum    1 weight  0.11000E+01 volume  0.77774E-04 ppm1      2.252 ppm2      0.862 CV     1
 ASSI { 1594}
   (( segid "    " and resid 75   and name HG1 ))
   (  segid "    " and resid 60   and name HD2%)
      6.000     6.000     0.000 peak  1594 spectrum    1 weight  0.11000E+01 volume  0.73447E-04 ppm1      2.345 ppm2      0.671 CV     1
 ASSI { 1595}
   (( segid "    " and resid 75   and name HG2 ))
   (  segid "    " and resid 60   and name HD2%)
      4.800     2.900     1.200 peak  1595 spectrum    1 weight  0.11000E+01 volume  0.24503E-03 ppm1      2.419 ppm2      0.696 CV     1
 ASSI { 1597}
   (( segid "    " and resid 75   and name HG1 ))
   (  segid "    " and resid 60   and name HD1%)
      3.600     1.600     1.600 peak  1597 spectrum    1 weight  0.11000E+01 volume  0.78530E-03 ppm1      2.348 ppm2      0.468 CV     1
 ASSI { 1600}
   (( segid "    " and resid 75   and name HG2 ))
   (  segid "    " and resid 106  and name HD% )
      5.000     3.100     1.000 peak  1600 spectrum    1 weight  0.11000E+01 volume  0.43214E-03 ppm1      2.439 ppm2      7.443 CV     1
 ASSI { 1601}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 75   and name HN  ))
      4.400     2.400     1.600 peak  1601 spectrum    1 weight  0.11000E+01 volume  0.35115E-03 ppm1      2.434 ppm2      7.232 CV     1
 ASSI { 1602}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 75   and name HN  ))
      4.700     2.700     1.300 peak  1602 spectrum    1 weight  0.11000E+01 volume  0.71467E-03 ppm1      2.338 ppm2      7.255 CV     1
 ASSI { 1603}
   (( segid "    " and resid 75   and name HG1 ))
   (  segid "    " and resid 106  and name HD% )
      4.200     2.200     1.800 peak  1603 spectrum    1 weight  0.11000E+01 volume  0.46343E-03 ppm1      2.338 ppm2      7.439 CV     1
 ASSI { 1607}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 76   and name HN  ))
      6.000     6.000     0.000 peak  1607 spectrum    1 weight  0.11000E+01 volume  0.40093E-04 ppm1      2.395 ppm2      8.427 CV     1
 ASSI { 1609}
   (( segid "    " and resid 121  and name HG1 ))
   (( segid "    " and resid 122  and name HN  ))
      4.600     2.600     1.400 peak  1609 spectrum    1 weight  0.11000E+01 volume  0.40491E-03 ppm1      2.279 ppm2      8.616 CV     1
 ASSI { 1617}
   (( segid "    " and resid 121  and name HG2 ))
   (( segid "    " and resid 120  and name HE1 ))
      5.300     3.500     0.700 peak  1617 spectrum    1 weight  0.11000E+01 volume  0.17727E-03 ppm1      2.391 ppm2      8.758 CV     1
 ASSI { 1618}
   (( segid "    " and resid 121  and name HG2 ))
   (( segid "    " and resid 122  and name HN  ))
      4.600     2.600     1.400 peak  1618 spectrum    1 weight  0.11000E+01 volume  0.67179E-03 ppm1      2.389 ppm2      8.589 CV     1
 ASSI { 1619}
   (( segid "    " and resid 121  and name HG2 ))
   (( segid "    " and resid 121  and name HN  ))
      4.900     3.000     1.100 peak  1619 spectrum    1 weight  0.11000E+01 volume  0.76155E-04 ppm1      2.380 ppm2      8.432 CV     1
 ASSI { 1624}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
      3.900     1.900     1.900 peak  1624 spectrum    1 weight  0.11000E+01 volume  0.16031E-03 ppm1      3.240 ppm2      7.171 CV     1
 ASSI { 1628}
   (( segid "    " and resid 55   and name HG1 ))
   (( segid "    " and resid 56   and name HN  ))
      2.700     0.900     0.900 peak  1628 spectrum    1 weight  0.11000E+01 volume  0.10262E-02 ppm1      2.373 ppm2      7.208 CV     1
 ASSI { 1629}
   (( segid "    " and resid 55   and name HG1 ))
   (( segid "    " and resid 55   and name HN  ))
      3.500     1.600     1.600 peak  1629 spectrum    1 weight  0.11000E+01 volume  0.13310E-02 ppm1      2.370 ppm2      7.360 CV     1
 ASSI { 1630}
   (( segid "    " and resid 55   and name HG2 ))
   (( segid "    " and resid 55   and name HA  ))
      3.500     1.600     1.600 peak  1630 spectrum    1 weight  0.11000E+01 volume  0.22308E-02 ppm1      2.561 ppm2      4.145 CV     1
 ASSI { 1632}
   (( segid "    " and resid 118  and name HG2 ))
   (( segid "    " and resid 115  and name HA  ))
      5.500     3.700     0.500 peak  1632 spectrum    1 weight  0.11000E+01 volume  0.32322E-03 ppm1      2.516 ppm2      3.734 CV     1
 ASSI { 1633}
   (( segid "    " and resid 55   and name HG1 ))
   (( segid "    " and resid 52   and name HA  ))
      5.100     3.200     0.900 peak  1633 spectrum    1 weight  0.11000E+01 volume  0.23185E-03 ppm1      2.361 ppm2      3.942 CV     1
 ASSI { 1637}
   (( segid "    " and resid 118  and name HG1 ))
   (( segid "    " and resid 115  and name HA  ))
      2.900     1.000     1.000 peak  1637 spectrum    1 weight  0.11000E+01 volume  0.72773E-03 ppm1      2.237 ppm2      3.757 CV     1
 ASSI { 1642}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 90   and name HE3 ))
      3.800     1.800     1.800 peak  1642 spectrum    1 weight  0.11000E+01 volume  0.55279E-03 ppm1      2.231 ppm2      7.328 CV     1
 ASSI { 1643}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 97   and name HN  ))
      3.900     1.900     1.900 peak  1643 spectrum    1 weight  0.11000E+01 volume  0.99415E-03 ppm1      2.218 ppm2      7.488 CV     1
 ASSI { 1646}
   (( segid "    " and resid 55   and name HG2 ))
   (( segid "    " and resid 56   and name HN  ))
      3.100     1.200     1.200 peak  1646 spectrum    1 weight  0.11000E+01 volume  0.99935E-03 ppm1      2.571 ppm2      7.190 CV     1
 ASSI { 1649}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
      4.300     2.300     1.700 peak  1649 spectrum    1 weight  0.11000E+01 volume  0.11639E-03 ppm1      3.246 ppm2      4.031 CV     1
 ASSI { 1650}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 107  and name HA  ))
      4.100     2.100     1.900 peak  1650 spectrum    1 weight  0.11000E+01 volume  0.92463E-04 ppm1      3.131 ppm2      3.785 CV     1
 ASSI { 1656}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 55   and name HG2 ))
      5.300     3.500     0.700 peak  1656 spectrum    1 weight  0.11000E+01 volume  0.24265E-03 ppm1      3.286 ppm2      2.588 CV     1
 ASSI { 1657}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 107  and name HB% )
      3.500     1.500     1.500 peak  1657 spectrum    1 weight  0.11000E+01 volume  0.93383E-03 ppm1      3.246 ppm2      1.811 CV     1
 ASSI { 1659}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 50   and name HG1 ))
      5.400     3.700     0.600 peak  1659 spectrum    1 weight  0.11000E+01 volume  0.32996E-03 ppm1      3.134 ppm2      1.535 CV     1
 ASSI { 1660}
   (( segid "    " and resid 53   and name HB1 ))
   (  segid "    " and resid 56   and name HD1%)
      5.000     3.100     1.000 peak  1660 spectrum    1 weight  0.11000E+01 volume  0.34983E-03 ppm1      3.127 ppm2      1.069 CV     1
 ASSI { 1664}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name HB1 ))
      1.800     0.400     0.400 peak  1664 spectrum    1 weight  0.11000E+01 volume  0.71597E-02 ppm1      2.227 ppm2      1.190 CV     1
 ASSI { 1666}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 75   and name HB1 ))
      3.400     1.400     1.400 peak  1666 spectrum    1 weight  0.11000E+01 volume  0.16793E-02 ppm1      2.393 ppm2      1.953 CV     1
 ASSI { 1685}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HA  ))
      5.200     3.400     0.800 peak  1685 spectrum    1 weight  0.11000E+01 volume  0.12475E-03 ppm1      2.150 ppm2      4.101 CV     1
 ASSI { 1689}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 107  and name HN  ))
      4.700     2.700     1.300 peak  1689 spectrum    1 weight  0.11000E+01 volume  0.54793E-03 ppm1      1.983 ppm2      8.065 CV     1
 ASSI { 1690}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 44   and name HH2 ))
      4.900     3.000     1.100 peak  1690 spectrum    1 weight  0.11000E+01 volume  0.20538E-03 ppm1      2.000 ppm2      7.333 CV     1
 ASSI { 1692}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 87   and name HN  ))
      4.600     2.600     1.400 peak  1692 spectrum    1 weight  0.11000E+01 volume  0.36434E-03 ppm1      1.870 ppm2      8.526 CV     1
 ASSI { 1693}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HN  ))
      3.800     1.800     1.800 peak  1693 spectrum    1 weight  0.11000E+01 volume  0.59056E-03 ppm1      1.717 ppm2      7.589 CV     1
 ASSI { 1697}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 111  and name HA  ))
      5.200     3.300     0.800 peak  1697 spectrum    1 weight  0.11000E+01 volume  0.14827E-03 ppm1      1.896 ppm2      4.087 CV     1
 ASSI { 1699}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
      4.600     2.600     1.400 peak  1699 spectrum    1 weight  0.11000E+01 volume  0.73915E-04 ppm1      1.701 ppm2      8.644 CV     1
 ASSI { 1702}
   (( segid "    " and resid 118  and name HG1 ))
   (( segid "    " and resid 114  and name HA  ))
      3.700     1.700     1.700 peak  1702 spectrum    1 weight  0.11000E+01 volume  0.51305E-03 ppm1      2.237 ppm2      3.825 CV     1
 ASSI { 1705}
   (( segid "    " and resid 58   and name HB2 ))
   (  segid "    " and resid 59   and name HG2%)
      6.000     6.000     0.000 peak  1705 spectrum    1 weight  0.11000E+01 volume  0.77330E-04 ppm1      3.392 ppm2      1.446 CV     1
 ASSI { 1706}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 62   and name HG2 ))
      6.000     6.000     0.000 peak  1706 spectrum    1 weight  0.11000E+01 volume  0.63730E-04 ppm1      3.384 ppm2      1.906 CV     1
 ASSI { 1722}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HB2 ))
      2.200     0.600     0.600 peak  1722 spectrum    1 weight  0.11000E+01 volume  0.25056E-02 ppm1      2.526 ppm2      2.854 CV     1
 ASSI { 1724}
   (( segid "    " and resid 118  and name HG2 ))
   (( segid "    " and resid 118  and name HG1 ))
      1.400     0.200     0.800 peak  1724 spectrum    1 weight  0.11000E+01 volume  0.32590E-01 ppm1      2.523 ppm2      2.213 CV     1
 ASSI { 1725}
   (( segid "    " and resid 55   and name HG2 ))
   (( segid "    " and resid 55   and name HG1 ))
      1.600     0.300     0.600 peak  1725 spectrum    1 weight  0.11000E+01 volume  0.10146E-01 ppm1      2.579 ppm2      2.342 CV     1
 ASSI { 1728}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 67   and name HD1%)
      4.100     2.100     1.900 peak  1728 spectrum    1 weight  0.11000E+01 volume  0.88556E-03 ppm1      2.532 ppm2      0.454 CV     1
 ASSI { 1729}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 60   and name HD2%)
      4.600     2.700     1.400 peak  1729 spectrum    1 weight  0.11000E+01 volume  0.27017E-03 ppm1      2.541 ppm2      0.670 CV     1
 ASSI { 1730}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 60   and name HB1 ))
      2.700     0.900     0.900 peak  1730 spectrum    1 weight  0.11000E+01 volume  0.16205E-02 ppm1      2.531 ppm2      1.296 CV     1
 ASSI { 1731}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 60   and name HB2 ))
      4.400     2.400     1.600 peak  1731 spectrum    1 weight  0.11000E+01 volume  0.62178E-03 ppm1      2.530 ppm2      1.498 CV     1
 ASSI { 1732}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 50   and name HG2 ))
      3.800     3.800     2.200 peak  1732 spectrum    1 weight  0.11000E+01 volume  0.42289E-02 ppm1      2.499 ppm2      1.808 CV     1
 ASSI { 1733}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 104  and name HG1 ))
      1.900     0.400     0.400 peak  1733 spectrum    1 weight  0.11000E+01 volume  0.76694E-02 ppm1      2.493 ppm2      1.990 CV     1
 ASSI { 1734}
   (( segid "    " and resid 105  and name HG1 ))
   (  segid "    " and resid 101  and name HD2%)
      4.500     2.500     1.500 peak  1734 spectrum    1 weight  0.11000E+01 volume  0.96153E-03 ppm1      2.297 ppm2      0.071 CV     1
 ASSI { 1735}
   (( segid "    " and resid 105  and name HG1 ))
   (  segid "    " and resid 95   and name HG2%)
      3.500     3.500     2.500 peak  1735 spectrum    1 weight  0.11000E+01 volume  0.13904E-02 ppm1      2.302 ppm2      1.077 CV     1
 ASSI { 1737}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 132  and name HB1 ))
      4.300     2.300     1.700 peak  1737 spectrum    1 weight  0.11000E+01 volume  0.16747E-03 ppm1      2.302 ppm2      1.416 CV     1
 ASSI { 1743}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HG2 ))
      2.000     0.500     0.500 peak  1743 spectrum    1 weight  0.11000E+01 volume  0.35590E-02 ppm1      2.298 ppm2      2.894 CV     1
 ASSI { 1746}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HG2 ))
      2.900     1.000     1.000 peak  1746 spectrum    1 weight  0.11000E+01 volume  0.23163E-02 ppm1      2.466 ppm2      2.959 CV     1
 ASSI { 1748}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 50   and name HE2 ))
      3.200     1.300     1.300 peak  1748 spectrum    1 weight  0.11000E+01 volume  0.68538E-03 ppm1      1.987 ppm2      3.159 CV     1
 ASSI { 1751}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 104  and name HA  ))
      3.600     1.600     1.600 peak  1751 spectrum    1 weight  0.11000E+01 volume  0.14887E-02 ppm1      2.494 ppm2      4.052 CV     1
 ASSI { 1752}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HA  ))
      2.900     1.000     1.000 peak  1752 spectrum    1 weight  0.11000E+01 volume  0.10209E-02 ppm1      2.295 ppm2      4.017 CV     1
 ASSI { 1754}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 86   and name HA  ))
      3.000     1.100     1.100 peak  1754 spectrum    1 weight  0.11000E+01 volume  0.10672E-02 ppm1      1.873 ppm2      3.878 CV     1
 ASSI { 1755}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HN  ))
      5.300     3.500     0.700 peak  1755 spectrum    1 weight  0.11000E+01 volume  0.10924E-03 ppm1      2.296 ppm2      8.819 CV     1
 ASSI { 1756}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 73   and name HN  ))
      5.600     3.900     0.400 peak  1756 spectrum    1 weight  0.11000E+01 volume  0.21780E-03 ppm1      2.540 ppm2      8.740 CV     1
 ASSI { 1757}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 107  and name HN  ))
      4.300     2.300     1.700 peak  1757 spectrum    1 weight  0.11000E+01 volume  0.82596E-03 ppm1      2.493 ppm2      8.064 CV     1
 ASSI { 1758}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 104  and name HN  ))
      4.700     2.800     1.300 peak  1758 spectrum    1 weight  0.11000E+01 volume  0.90517E-03 ppm1      2.494 ppm2      7.908 CV     1
 ASSI { 1761}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 74   and name HN  ))
      5.900     4.300     0.100 peak  1761 spectrum    1 weight  0.11000E+01 volume  0.13577E-03 ppm1      2.535 ppm2      7.495 CV     1
 ASSI { 1762}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 44   and name HH2 ))
      5.400     3.600     0.600 peak  1762 spectrum    1 weight  0.11000E+01 volume  0.47864E-04 ppm1      2.481 ppm2      7.319 CV     1
 ASSI { 1765}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HA  ))
      2.800     1.000     1.000 peak  1765 spectrum    1 weight  0.11000E+01 volume  0.23184E-02 ppm1      2.802 ppm2      4.355 CV     1
 ASSI { 1766}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 68   and name HB  ))
      6.000     5.600     0.000 peak  1766 spectrum    1 weight  0.11000E+01 volume  0.72623E-04 ppm1      2.831 ppm2      4.717 CV     1
 ASSI { 1769}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 74   and name HN  ))
      4.000     2.000     2.000 peak  1769 spectrum    1 weight  0.11000E+01 volume  0.98485E-03 ppm1      2.843 ppm2      7.491 CV     1
 ASSI { 1772}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 61   and name HN  ))
      3.900     1.900     1.900 peak  1772 spectrum    1 weight  0.11000E+01 volume  0.10604E-02 ppm1      2.896 ppm2      8.010 CV     1
 ASSI { 1773}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 68   and name HN  ))
      4.600     2.600     1.400 peak  1773 spectrum    1 weight  0.11000E+01 volume  0.51507E-03 ppm1      2.855 ppm2      8.186 CV     1
 ASSI { 1776}
   (( segid "    " and resid 64   and name HB2 ))
   (  segid "    " and resid 63   and name HG1%)
      3.700     1.700     1.700 peak  1776 spectrum    1 weight  0.11000E+01 volume  0.69429E-03 ppm1      3.097 ppm2      0.916 CV     1
 ASSI { 1783}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HA  ))
      3.800     1.800     1.800 peak  1783 spectrum    1 weight  0.11000E+01 volume  0.74960E-03 ppm1      3.025 ppm2      4.514 CV     1
 ASSI { 1784}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 31   and name HA  ))
      3.300     1.400     1.400 peak  1784 spectrum    1 weight  0.11000E+01 volume  0.83656E-03 ppm1      2.907 ppm2      4.520 CV     1
 ASSI { 1786}
   (( segid "    " and resid 56   and name HB  ))
   (( segid "    " and resid 56   and name HA  ))
      3.400     1.400     1.400 peak  1786 spectrum    1 weight  0.11000E+01 volume  0.65170E-03 ppm1      2.396 ppm2      3.944 CV     1
 ASSI { 1791}
   (( segid "    " and resid 57   and name HB2 ))
   (  segid "    " and resid 56   and name HD1%)
      6.000     6.000     0.000 peak  1791 spectrum    1 weight  0.11000E+01 volume  0.58257E-04 ppm1      3.252 ppm2      1.075 CV     1
 ASSI { 1794}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HA  ))
      3.200     1.300     1.300 peak  1794 spectrum    1 weight  0.11000E+01 volume  0.12406E-02 ppm1      3.123 ppm2      4.525 CV     1
 ASSI { 1797}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 96   and name HB2 ))
      2.000     0.500     0.500 peak  1797 spectrum    1 weight  0.11000E+01 volume  0.77277E-02 ppm1      2.290 ppm2      3.121 CV     1
 ASSI { 1800}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 97   and name HG2 ))
      4.200     2.200     1.800 peak  1800 spectrum    1 weight  0.11000E+01 volume  0.13646E-02 ppm1      2.288 ppm2      1.353 CV     1
 ASSI { 1811}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HB1 ))
      2.000     0.500     0.500 peak  1811 spectrum    1 weight  0.11000E+01 volume  0.50746E-02 ppm1      2.051 ppm2      1.701 CV     1
 ASSI { 1814}
   (( segid "    " and resid 56   and name HB  ))
   (  segid "    " and resid 60   and name HD1%)
      5.900     4.400     0.100 peak  1814 spectrum    1 weight  0.11000E+01 volume  0.15940E-03 ppm1      2.398 ppm2      0.460 CV     1
 ASSI { 1823}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 95   and name HG1%)
      4.000     2.000     2.000 peak  1823 spectrum    1 weight  0.11000E+01 volume  0.12181E-03 ppm1      2.275 ppm2      0.915 CV     1
 ASSI { 1825}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 54   and name HB1 ))
      5.400     5.400     0.600 peak  1825 spectrum    1 weight  0.11000E+01 volume  0.31524E-03 ppm1      3.032 ppm2      2.747 CV     1
 ASSI { 1829}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HB1 ))
      4.800     2.900     1.200 peak  1829 spectrum    1 weight  0.11000E+01 volume  0.22075E-03 ppm1      2.150 ppm2      1.822 CV     1
 ASSI { 1832}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 58   and name HB2 ))
      1.800     0.400     0.400 peak  1832 spectrum    1 weight  0.11000E+01 volume  0.82264E-02 ppm1      2.889 ppm2      3.377 CV     1
 ASSI { 1833}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HB2 ))
      1.600     0.300     0.600 peak  1833 spectrum    1 weight  0.11000E+01 volume  0.19755E-01 ppm1      2.807 ppm2      3.106 CV     1
 ASSI { 1834}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 58   and name HA  ))
      2.500     0.800     0.800 peak  1834 spectrum    1 weight  0.11000E+01 volume  0.26508E-02 ppm1      2.895 ppm2      3.986 CV     1
 ASSI { 1836}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 72   and name HN  ))
      4.600     2.600     1.400 peak  1836 spectrum    1 weight  0.11000E+01 volume  0.35993E-03 ppm1      2.530 ppm2      8.887 CV     1
 ASSI { 1837}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 109  and name HN  ))
      4.900     3.000     1.100 peak  1837 spectrum    1 weight  0.11000E+01 volume  0.22808E-03 ppm1      2.894 ppm2      8.667 CV     1
 ASSI { 1839}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
      3.300     1.400     1.400 peak  1839 spectrum    1 weight  0.11000E+01 volume  0.50804E-03 ppm1      1.712 ppm2      9.298 CV     1
 ASSI { 1840}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 102  and name HN  ))
      4.200     2.200     1.800 peak  1840 spectrum    1 weight  0.11000E+01 volume  0.21880E-03 ppm1      1.717 ppm2      9.163 CV     1
 ASSI { 1844}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 60   and name HD2%)
      6.000     6.000     0.000 peak  1844 spectrum    1 weight  0.11000E+01 volume  0.59755E-04 ppm1      2.842 ppm2      0.711 CV     1
 ASSI { 1846}
   (( segid "    " and resid 66   and name HE2 ))
   (( segid "    " and resid 66   and name HB2 ))
      4.400     2.400     1.600 peak  1846 spectrum    1 weight  0.11000E+01 volume  0.10948E-02 ppm1      2.906 ppm2      1.728 CV     1
 ASSI { 1863}
   (( segid "    " and resid 113  and name HB  ))
   (  segid "    " and resid 113  and name HG2%)
      2.000     0.500     0.500 peak  1863 spectrum    1 weight  0.11000E+01 volume  0.11957E-01 ppm1      1.890 ppm2      0.886 CV     1
 ASSI { 1864}
   (( segid "    " and resid 39   and name HB  ))
   (  segid "    " and resid 39   and name HG2%)
      2.200     0.600     0.600 peak  1864 spectrum    1 weight  0.11000E+01 volume  0.10967E-01 ppm1      1.799 ppm2      0.816 CV     1
 ASSI { 1869}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 39   and name HG12))
      3.000     1.100     1.100 peak  1869 spectrum    1 weight  0.11000E+01 volume  0.18694E-02 ppm1      1.784 ppm2      1.336 CV     1
 ASSI { 1870}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HG1 ))
      2.300     0.700     0.700 peak  1870 spectrum    1 weight  0.11000E+01 volume  0.40613E-02 ppm1      1.708 ppm2      1.304 CV     1
 ASSI { 1878}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HG2 ))
      2.000     2.000     4.000 peak  1878 spectrum    1 weight  0.11000E+01 volume  0.10381E-01 ppm1      1.707 ppm2      1.494 CV     1
 ASSI { 1885}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HE1 ))
      3.800     1.800     1.800 peak  1885 spectrum    1 weight  0.11000E+01 volume  0.94467E-03 ppm1      1.694 ppm2      3.071 CV     1
 ASSI { 1905}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 41   and name HN  ))
      3.400     1.400     1.400 peak  1905 spectrum    1 weight  0.11000E+01 volume  0.11538E-02 ppm1      1.799 ppm2      8.008 CV     1
 ASSI { 1907}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 116  and name HN  ))
      3.900     1.900     1.900 peak  1907 spectrum    1 weight  0.11000E+01 volume  0.10991E-02 ppm1      1.906 ppm2      7.855 CV     1
 ASSI { 1909}
   (( segid "    " and resid 31   and name HB1 ))
   (  segid "    " and resid 31   and name HD% )
      2.900     1.000     1.000 peak  1909 spectrum    1 weight  0.11000E+01 volume  0.25346E-02 ppm1      2.906 ppm2      7.079 CV     1
 ASSI { 1912}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 86   and name HN  ))
      3.900     1.900     1.900 peak  1912 spectrum    1 weight  0.11000E+01 volume  0.64159E-03 ppm1      1.866 ppm2      8.067 CV     1
 ASSI { 1915}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 61   and name HN  ))
      4.300     2.300     1.700 peak  1915 spectrum    1 weight  0.11000E+01 volume  0.10991E-02 ppm1      3.386 ppm2      7.976 CV     1
 ASSI { 1923}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 135  and name HZ% )
      2.900     2.900     3.100 peak  1923 spectrum    1 weight  0.11000E+01 volume  0.82317E-03 ppm1      3.117 ppm2      7.992 CV     1
 ASSI { 1930}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 106  and name HD% )
      5.100     3.300     0.900 peak  1930 spectrum    1 weight  0.11000E+01 volume  0.38212E-03 ppm1      3.081 ppm2      7.428 CV     1
 ASSI { 1934}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      4.500     2.500     1.500 peak  1934 spectrum    1 weight  0.11000E+01 volume  0.12339E-02 ppm1      2.911 ppm2      7.215 CV     1
 ASSI { 1935}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 56   and name HN  ))
      4.400     2.400     1.600 peak  1935 spectrum    1 weight  0.11000E+01 volume  0.73659E-03 ppm1      2.805 ppm2      7.176 CV     1
 ASSI { 1936}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 55   and name HN  ))
      3.100     1.200     1.200 peak  1936 spectrum    1 weight  0.11000E+01 volume  0.98331E-03 ppm1      2.788 ppm2      7.385 CV     1
 ASSI { 1937}
   (( segid "    " and resid 54   and name HB1 ))
   (  segid "    " and resid 58   and name HE% )
      4.200     2.300     1.800 peak  1937 spectrum    1 weight  0.11000E+01 volume  0.34971E-03 ppm1      2.786 ppm2      6.869 CV     1
 ASSI { 1938}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 58   and name HE% )
      4.200     2.300     1.800 peak  1938 spectrum    1 weight  0.11000E+01 volume  0.33505E-03 ppm1      2.911 ppm2      6.888 CV     1
 ASSI { 1947}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HN  ))
      3.800     1.800     1.800 peak  1947 spectrum    1 weight  0.11000E+01 volume  0.54431E-03 ppm1      2.899 ppm2      9.675 CV     1
 ASSI { 1951}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
      4.500     2.500     1.500 peak  1951 spectrum    1 weight  0.11000E+01 volume  0.37959E-03 ppm1      3.195 ppm2      9.327 CV     1
 ASSI { 1955}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HN  ))
      3.700     1.700     1.700 peak  1955 spectrum    1 weight  0.11000E+01 volume  0.41730E-03 ppm1      3.255 ppm2      9.165 CV     1
 ASSI { 1956}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
      3.200     1.200     1.200 peak  1956 spectrum    1 weight  0.11000E+01 volume  0.51097E-03 ppm1      1.481 ppm2      7.432 CV     1
 ASSI { 1957}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 106  and name HZ  ))
      5.100     3.300     0.900 peak  1957 spectrum    1 weight  0.11000E+01 volume  0.36072E-03 ppm1      1.483 ppm2      7.279 CV     1
 ASSI { 1958}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 106  and name HZ  ))
      6.000     6.000     0.000 peak  1958 spectrum    1 weight  0.11000E+01 volume  0.12190E-03 ppm1      1.283 ppm2      7.286 CV     1
 ASSI { 1959}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
      4.800     2.800     1.200 peak  1959 spectrum    1 weight  0.11000E+01 volume  0.41536E-03 ppm1      1.297 ppm2      7.432 CV     1
 ASSI { 1964}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 38   and name HA2 ))
      6.000     6.000     0.000 peak  1964 spectrum    1 weight  0.11000E+01 volume  0.54870E-04 ppm1      1.798 ppm2      3.893 CV     1
 ASSI { 1973}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 39   and name HG11))
      3.100     1.200     1.200 peak  1973 spectrum    1 weight  0.11000E+01 volume  0.12484E-02 ppm1      1.791 ppm2      1.078 CV     1
 ASSI { 1983}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HA  ))
      5.300     3.500     0.700 peak  1983 spectrum    1 weight  0.11000E+01 volume  0.83926E-04 ppm1      1.486 ppm2      4.447 CV     1
 ASSI { 1984}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 60   and name HA  ))
      3.800     1.800     1.800 peak  1984 spectrum    1 weight  0.11000E+01 volume  0.25336E-03 ppm1      1.292 ppm2      4.447 CV     1
 ASSI { 1985}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 61   and name HA  ))
      6.000     5.300     0.000 peak  1985 spectrum    1 weight  0.11000E+01 volume  0.80394E-04 ppm1      1.300 ppm2      3.947 CV     1
 ASSI { 1989}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 67   and name HG2%)
      2.800     1.000     1.000 peak  1989 spectrum    1 weight  0.11000E+01 volume  0.12360E-02 ppm1      1.487 ppm2     -0.043 CV     1
 ASSI { 1992}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HB1 ))
      1.800     0.400     0.400 peak  1992 spectrum    1 weight  0.11000E+01 volume  0.53058E-02 ppm1      1.490 ppm2      1.290 CV     1
 ASSI { 2001}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 98   and name HB1 ))
      2.000     0.500     0.500 peak  2001 spectrum    1 weight  0.11000E+01 volume  0.74878E-02 ppm1      3.000 ppm2      2.439 CV     1
 ASSI { 2012}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 66   and name HG1 ))
      4.300     2.300     1.700 peak  2012 spectrum    1 weight  0.11000E+01 volume  0.57645E-03 ppm1      3.282 ppm2      1.292 CV     1
 ASSI { 2013}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 66   and name HG2 ))
      2.800     2.800     3.200 peak  2013 spectrum    1 weight  0.11000E+01 volume  0.99945E-03 ppm1      3.269 ppm2      1.446 CV     1
 ASSI { 2014}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 66   and name HB1 ))
      3.700     1.700     1.700 peak  2014 spectrum    1 weight  0.11000E+01 volume  0.71559E-03 ppm1      3.274 ppm2      1.732 CV     1
 ASSI { 2054}
   (( segid "    " and resid 86   and name HB1 ))
   (  segid "    " and resid 86   and name HD2%)
      2.400     0.700     0.700 peak  2054 spectrum    1 weight  0.11000E+01 volume  0.11540E-01 ppm1      1.155 ppm2      0.749 CV     1
 ASSI { 2057}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 60   and name HD2%)
      3.000     1.100     1.100 peak  2057 spectrum    1 weight  0.11000E+01 volume  0.17459E-02 ppm1      1.295 ppm2      0.694 CV     1
 ASSI { 2062}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HB2 ))
      1.700     0.300     0.500 peak  2062 spectrum    1 weight  0.11000E+01 volume  0.94901E-02 ppm1      1.152 ppm2      1.733 CV     1
 ASSI { 2063}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 85   and name HB  ))
      4.300     2.300     1.700 peak  2063 spectrum    1 weight  0.11000E+01 volume  0.15172E-02 ppm1      1.157 ppm2      2.105 CV     1
 ASSI { 2078}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HG  ))
      2.400     0.700     0.700 peak  2078 spectrum    1 weight  0.11000E+01 volume  0.45144E-02 ppm1      1.150 ppm2      1.513 CV     1
 ASSI { 2084}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 86   and name HB2 ))
      4.200     2.200     1.800 peak  2084 spectrum    1 weight  0.11000E+01 volume  0.38486E-03 ppm1      0.809 ppm2      1.797 CV     1
 ASSI { 2095}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
      3.200     1.300     1.300 peak  2095 spectrum    1 weight  0.11000E+01 volume  0.12339E-02 ppm1      1.753 ppm2      3.892 CV     1
 ASSI { 2097}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
      2.800     1.000     1.000 peak  2097 spectrum    1 weight  0.11000E+01 volume  0.89837E-03 ppm1      1.749 ppm2      4.276 CV     1
 ASSI { 2105}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 83   and name HB1 ))
      6.000     4.500     0.000 peak  2105 spectrum    1 weight  0.11000E+01 volume  0.85073E-04 ppm1      1.149 ppm2      2.895 CV     1
 ASSI { 2106}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
      2.700     0.900     0.900 peak  2106 spectrum    1 weight  0.11000E+01 volume  0.27032E-02 ppm1      1.153 ppm2      3.887 CV     1
 ASSI { 2109}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 61   and name HB1 ))
      4.400     2.400     1.600 peak  2109 spectrum    1 weight  0.11000E+01 volume  0.20424E-03 ppm1      1.300 ppm2      3.919 CV     1
 ASSI { 2147}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 71   and name HB2 ))
      2.800     1.000     1.000 peak  2147 spectrum    1 weight  0.11000E+01 volume  0.14159E-02 ppm1      1.776 ppm2      2.857 CV     1
 ASSI { 2151}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HE1 ))
      4.200     2.200     1.800 peak  2151 spectrum    1 weight  0.11000E+01 volume  0.81310E-03 ppm1      1.322 ppm2      2.081 CV     1
 ASSI { 2153}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 117  and name HB2 ))
      1.900     0.400     0.400 peak  2153 spectrum    1 weight  0.11000E+01 volume  0.54817E-02 ppm1      1.435 ppm2      2.059 CV     1
 ASSI { 2158}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HE2 ))
      4.500     2.500     1.500 peak  2158 spectrum    1 weight  0.11000E+01 volume  0.67921E-03 ppm1      1.779 ppm2      2.265 CV     1
 ASSI { 2188}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HA  ))
      3.000     1.100     1.100 peak  2188 spectrum    1 weight  0.11000E+01 volume  0.92357E-03 ppm1      1.158 ppm2      4.349 CV     1
 ASSI { 2199}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 81   and name HA  ))
      4.100     2.100     1.900 peak  2199 spectrum    1 weight  0.11000E+01 volume  0.12717E-03 ppm1      1.065 ppm2      4.482 CV     1
 ASSI { 2205}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 67   and name HG12))
      2.600     0.800     0.800 peak  2205 spectrum    1 weight  0.11000E+01 volume  0.33663E-02 ppm1      1.783 ppm2      1.445 CV     1
 ASSI { 2207}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HB1 ))
      1.800     0.400     0.400 peak  2207 spectrum    1 weight  0.11000E+01 volume  0.70610E-02 ppm1      1.661 ppm2      1.169 CV     1
 ASSI { 2208}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 62   and name HB1 ))
      4.300     4.300     1.700 peak  2208 spectrum    1 weight  0.11000E+01 volume  0.94930E-03 ppm1      1.840 ppm2      1.170 CV     1
 ASSI { 2210}
   (( segid "    " and resid 122  and name HG  ))
   (( segid "    " and resid 122  and name HB1 ))
      4.400     2.400     1.600 peak  2210 spectrum    1 weight  0.11000E+01 volume  0.11003E-03 ppm1      1.992 ppm2      1.125 CV     1
 ASSI { 2218}
   (( segid "    " and resid 67   and name HB  ))
   (  segid "    " and resid 67   and name HD1%)
      2.700     0.900     0.900 peak  2218 spectrum    1 weight  0.11000E+01 volume  0.22881E-02 ppm1      1.775 ppm2      0.438 CV     1
 ASSI { 2225}
   (( segid "    " and resid 73   and name HE1 ))
   (( segid "    " and resid 73   and name HD1 ))
      2.200     0.600     0.600 peak  2225 spectrum    1 weight  0.11000E+01 volume  0.10204E-01 ppm1      2.091 ppm2      1.283 CV     1
 ASSI { 2235}
   (( segid "    " and resid 73   and name HE2 ))
   (( segid "    " and resid 73   and name HE1 ))
      1.800     0.400     0.400 peak  2235 spectrum    1 weight  0.11000E+01 volume  0.72681E-02 ppm1      2.281 ppm2      2.073 CV     1
 ASSI { 2239}
   (( segid "    " and resid 73   and name HE1 ))
   (( segid "    " and resid 73   and name HB2 ))
      4.500     2.500     1.500 peak  2239 spectrum    1 weight  0.11000E+01 volume  0.97599E-03 ppm1      2.045 ppm2      1.824 CV     1
 ASSI { 2258}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HN  ))
      6.000     5.600     0.000 peak  2258 spectrum    1 weight  0.11000E+01 volume  0.50336E-05 ppm1      1.753 ppm2      8.050 CV     1
 ASSI { 2261}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HN  ))
      4.600     2.700     1.400 peak  2261 spectrum    1 weight  0.11000E+01 volume  0.46743E-03 ppm1      1.152 ppm2      8.046 CV     1
 ASSI { 2262}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 89   and name HN  ))
      5.600     4.000     0.400 peak  2262 spectrum    1 weight  0.11000E+01 volume  0.12673E-03 ppm1      1.145 ppm2      8.209 CV     1
 ASSI { 2263}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 88   and name HN  ))
      5.900     4.300     0.100 peak  2263 spectrum    1 weight  0.11000E+01 volume  0.14403E-03 ppm1      1.158 ppm2      7.282 CV     1
 ASSI { 2265}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 102  and name HA  ))
      2.900     1.000     1.000 peak  2265 spectrum    1 weight  0.11000E+01 volume  0.16806E-02 ppm1      2.573 ppm2      5.601 CV     1
 ASSI { 2266}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 102  and name HA  ))
      2.600     0.800     0.800 peak  2266 spectrum    1 weight  0.11000E+01 volume  0.17533E-02 ppm1      3.273 ppm2      5.602 CV     1
 ASSI { 2269}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 85   and name HN  ))
      5.300     3.500     0.700 peak  2269 spectrum    1 weight  0.11000E+01 volume  0.17709E-03 ppm1      1.786 ppm2      6.865 CV     1
 ASSI { 2270}
   (( segid "    " and resid 73   and name HE1 ))
   (( segid "    " and resid 90   and name HE3 ))
      4.500     2.500     1.500 peak  2270 spectrum    1 weight  0.11000E+01 volume  0.36678E-03 ppm1      2.095 ppm2      7.291 CV     1
 ASSI { 2273}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      3.700     1.700     1.700 peak  2273 spectrum    1 weight  0.11000E+01 volume  0.56638E-03 ppm1      2.652 ppm2      8.097 CV     1
 ASSI { 2274}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HN  ))
      3.200     1.300     1.300 peak  2274 spectrum    1 weight  0.11000E+01 volume  0.12270E-02 ppm1      2.662 ppm2      8.285 CV     1
 ASSI { 2280}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 103  and name HN  ))
      3.000     1.100     1.100 peak  2280 spectrum    1 weight  0.11000E+01 volume  0.10386E-02 ppm1      3.275 ppm2      8.475 CV     1
 ASSI { 2281}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
      4.200     2.200     1.800 peak  2281 spectrum    1 weight  0.11000E+01 volume  0.17254E-02 ppm1      3.274 ppm2      8.651 CV     1
 ASSI { 2282}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
      6.000     4.900     0.000 peak  2282 spectrum    1 weight  0.11000E+01 volume  0.19187E-03 ppm1      3.287 ppm2      9.309 CV     1
 ASSI { 2284}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 70   and name HN  ))
      4.000     2.000     2.000 peak  2284 spectrum    1 weight  0.11000E+01 volume  0.87674E-03 ppm1      1.791 ppm2      8.366 CV     1
 ASSI { 2292}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 124  and name HN  ))
      4.800     2.900     1.200 peak  2292 spectrum    1 weight  0.11000E+01 volume  0.88016E-04 ppm1      1.121 ppm2      8.371 CV     1
 ASSI { 2295}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 81   and name HN  ))
      4.200     2.200     1.800 peak  2295 spectrum    1 weight  0.11000E+01 volume  0.72127E-03 ppm1      1.048 ppm2      7.434 CV     1
 ASSI { 2296}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 83   and name HN  ))
      4.200     2.200     1.800 peak  2296 spectrum    1 weight  0.11000E+01 volume  0.87549E-03 ppm1      1.048 ppm2      7.589 CV     1
 ASSI { 2299}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HN  ))
      3.500     1.500     1.500 peak  2299 spectrum    1 weight  0.11000E+01 volume  0.51184E-03 ppm1      1.549 ppm2      7.439 CV     1
 ASSI { 2300}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 83   and name HN  ))
      3.700     3.700     2.300 peak  2300 spectrum    1 weight  0.11000E+01 volume  0.12279E-02 ppm1      1.553 ppm2      7.595 CV     1
 ASSI { 2302}
   (( segid "    " and resid 73   and name HE2 ))
   (( segid "    " and resid 90   and name HE3 ))
      4.000     2.000     2.000 peak  2302 spectrum    1 weight  0.11000E+01 volume  0.84894E-03 ppm1      2.275 ppm2      7.324 CV     1
 ASSI { 2307}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HN  ))
      3.100     1.200     1.200 peak  2307 spectrum    1 weight  0.11000E+01 volume  0.51305E-03 ppm1      2.023 ppm2      8.207 CV     1
 ASSI { 2309}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 111  and name HN  ))
      4.400     2.400     1.600 peak  2309 spectrum    1 weight  0.11000E+01 volume  0.77017E-03 ppm1      2.570 ppm2      8.321 CV     1
 ASSI { 2314}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 111  and name HN  ))
      5.500     3.800     0.500 peak  2314 spectrum    1 weight  0.11000E+01 volume  0.57900E-03 ppm1      1.101 ppm2      8.369 CV     1
 ASSI { 2316}
   (( segid "    " and resid 50   and name HE1 ))
   (( segid "    " and resid 50   and name HA  ))
      6.000     6.000     0.000 peak  2316 spectrum    1 weight  0.11000E+01 volume  0.42772E-04 ppm1      2.811 ppm2      4.054 CV     1
 ASSI { 2318}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 108  and name HA  ))
      2.900     1.000     1.000 peak  2318 spectrum    1 weight  0.11000E+01 volume  0.11257E-02 ppm1      2.582 ppm2      4.050 CV     1
 ASSI { 2319}
   (( segid "    " and resid 88   and name HE2 ))
   (( segid "    " and resid 88   and name HD2 ))
      5.200     5.200     0.800 peak  2319 spectrum    1 weight  0.11000E+01 volume  0.86455E-04 ppm1      3.288 ppm2      2.116 CV     1
 ASSI { 2321}
   (( segid "    " and resid 108  and name HB2 ))
   (  segid "    " and resid 108  and name HD2%)
      3.000     1.100     1.100 peak  2321 spectrum    1 weight  0.11000E+01 volume  0.47336E-02 ppm1      2.585 ppm2      1.175 CV     1
 ASSI { 2325}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 108  and name HB1 ))
      2.100     0.500     0.500 peak  2325 spectrum    1 weight  0.11000E+01 volume  0.21430E-02 ppm1      2.584 ppm2      1.781 CV     1
 ASSI { 2330}
   (( segid "    " and resid 50   and name HE1 ))
   (( segid "    " and resid 50   and name HG2 ))
      3.000     1.100     1.100 peak  2330 spectrum    1 weight  0.11000E+01 volume  0.33271E-02 ppm1      2.811 ppm2      1.803 CV     1
 ASSI { 2333}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HB1 ))
      1.900     0.400     0.400 peak  2333 spectrum    1 weight  0.11000E+01 volume  0.38921E-02 ppm1      2.043 ppm2      1.114 CV     1
 ASSI { 2334}
   (( segid "    " and resid 112  and name HB2 ))
   (  segid "    " and resid 112  and name HD2%)
      3.100     1.200     1.200 peak  2334 spectrum    1 weight  0.11000E+01 volume  0.50572E-02 ppm1      2.026 ppm2      0.708 CV     1
 ASSI { 2339}
   (( segid "    " and resid 108  and name HB1 ))
   (  segid "    " and resid 108  and name HD1%)
      2.700     0.900     0.900 peak  2339 spectrum    1 weight  0.11000E+01 volume  0.42549E-02 ppm1      1.778 ppm2      1.180 CV     1
 ASSI { 2341}
   (( segid "    " and resid 126  and name HB2 ))
   (  segid "    " and resid 126  and name HD2%)
      2.000     2.000     4.000 peak  2341 spectrum    1 weight  0.11000E+01 volume  0.28860E-01 ppm1      1.542 ppm2      0.926 CV     1
 ASSI { 2343}
   (( segid "    " and resid 112  and name HB1 ))
   (  segid "    " and resid 112  and name HD1%)
      1.900     1.900     4.100 peak  2343 spectrum    1 weight  0.11000E+01 volume  0.16015E-01 ppm1      1.093 ppm2      0.782 CV     1
 ASSI { 2353}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HA  ))
      3.400     1.500     1.500 peak  2353 spectrum    1 weight  0.11000E+01 volume  0.80790E-03 ppm1      2.050 ppm2      3.820 CV     1
 ASSI { 2356}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 127  and name HD1 ))
      4.900     3.100     1.100 peak  2356 spectrum    1 weight  0.11000E+01 volume  0.52239E-03 ppm1      1.536 ppm2      3.477 CV     1
 ASSI { 2364}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 112  and name HA  ))
      2.600     0.800     0.800 peak  2364 spectrum    1 weight  0.11000E+01 volume  0.21117E-02 ppm1      1.092 ppm2      3.821 CV     1
 ASSI { 2369}
   (( segid "    " and resid 108  and name HB1 ))
   (  segid "    " and resid 46   and name HG1%)
      6.000     6.000     0.000 peak  2369 spectrum    1 weight  0.11000E+01 volume  0.47482E-04 ppm1      1.749 ppm2     -0.215 CV     1
 ASSI { 2370}
   (( segid "    " and resid 108  and name HB1 ))
   (( segid "    " and resid 108  and name HN  ))
      3.300     1.400     1.400 peak  2370 spectrum    1 weight  0.11000E+01 volume  0.79498E-03 ppm1      1.771 ppm2      8.522 CV     1
 ASSI { 2372}
   (( segid "    " and resid 108  and name HB1 ))
   (( segid "    " and resid 111  and name HN  ))
      5.800     4.200     0.200 peak  2372 spectrum    1 weight  0.11000E+01 volume  0.99319E-04 ppm1      1.785 ppm2      8.322 CV     1
 ASSI { 2376}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 111  and name HN  ))
      4.700     2.700     1.300 peak  2376 spectrum    1 weight  0.11000E+01 volume  0.44497E-03 ppm1      2.028 ppm2      8.369 CV     1
 ASSI { 2381}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HN  ))
      4.200     2.200     1.800 peak  2381 spectrum    1 weight  0.11000E+01 volume  0.15611E-03 ppm1      1.665 ppm2      8.582 CV     1
 ASSI { 2382}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 120  and name HE1 ))
      6.000     4.700     0.000 peak  2382 spectrum    1 weight  0.11000E+01 volume  0.16417E-03 ppm1      1.668 ppm2      8.793 CV     1
 ASSI { 2385}
   (( segid "    " and resid 101  and name HB2 ))
   (  segid "    " and resid 67   and name HD1%)
      3.800     1.800     1.800 peak  2385 spectrum    1 weight  0.11000E+01 volume  0.21409E-03 ppm1      1.873 ppm2      0.440 CV     1
 ASSI { 2386}
   (( segid "    " and resid 92   and name HB2 ))
   (  segid "    " and resid 92   and name HD1%)
      2.400     0.700     0.700 peak  2386 spectrum    1 weight  0.11000E+01 volume  0.44323E-02 ppm1      1.933 ppm2      0.829 CV     1
 ASSI { 2388}
   (( segid "    " and resid 101  and name HB2 ))
   (  segid "    " and resid 101  and name HD1%)
      3.000     1.100     1.100 peak  2388 spectrum    1 weight  0.11000E+01 volume  0.14889E-02 ppm1      1.866 ppm2      0.843 CV     1
 ASSI { 2389}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HB1 ))
      1.900     0.400     0.400 peak  2389 spectrum    1 weight  0.11000E+01 volume  0.36284E-02 ppm1      1.937 ppm2      1.104 CV     1
 ASSI { 2390}
   (( segid "    " and resid 101  and name HB2 ))
   (  segid "    " and resid 109  and name HB% )
      5.200     3.400     0.800 peak  2390 spectrum    1 weight  0.11000E+01 volume  0.18486E-03 ppm1      1.859 ppm2      1.168 CV     1
 ASSI { 2392}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HG  ))
      2.900     1.000     1.000 peak  2392 spectrum    1 weight  0.11000E+01 volume  0.18796E-02 ppm1      1.682 ppm2      0.965 CV     1
 ASSI { 2395}
   (( segid "    " and resid 101  and name HB1 ))
   (  segid "    " and resid 101  and name HD1%)
      3.300     1.400     1.400 peak  2395 spectrum    1 weight  0.11000E+01 volume  0.70846E-03 ppm1      1.589 ppm2      0.814 CV     1
 ASSI { 2396}
   (( segid "    " and resid 130  and name HB2 ))
   (  segid "    " and resid 108  and name HD2%)
      4.400     2.400     1.600 peak  2396 spectrum    1 weight  0.11000E+01 volume  0.67589E-04 ppm1      1.672 ppm2      1.175 CV     1
 ASSI { 2397}
   (( segid "    " and resid 101  and name HB1 ))
   (  segid "    " and resid 101  and name HD2%)
      3.000     1.100     1.100 peak  2397 spectrum    1 weight  0.11000E+01 volume  0.14472E-02 ppm1      1.582 ppm2      0.069 CV     1
 ASSI { 2400}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 130  and name HG  ))
      3.300     1.400     1.400 peak  2400 spectrum    1 weight  0.11000E+01 volume  0.11162E-02 ppm1      1.454 ppm2      0.985 CV     1
 ASSI { 2401}
   (( segid "    " and resid 130  and name HB1 ))
   (  segid "    " and resid 108  and name HD2%)
      2.700     2.700     3.300 peak  2401 spectrum    1 weight  0.11000E+01 volume  0.11143E-02 ppm1      1.443 ppm2      1.166 CV     1
 ASSI { 2408}
   (( segid "    " and resid 92   and name HB1 ))
   (  segid "    " and resid 92   and name HD1%)
      3.200     1.300     1.300 peak  2408 spectrum    1 weight  0.11000E+01 volume  0.41922E-02 ppm1      1.058 ppm2      0.819 CV     1
 ASSI { 2411}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 89   and name HA  ))
      4.000     2.000     2.000 peak  2411 spectrum    1 weight  0.11000E+01 volume  0.37935E-03 ppm1      1.067 ppm2      3.475 CV     1
 ASSI { 2417}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HA  ))
      5.100     3.200     0.900 peak  2417 spectrum    1 weight  0.11000E+01 volume  0.40897E-03 ppm1      3.128 ppm2      4.119 CV     1
 ASSI { 2418}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HA  ))
      4.600     2.700     1.400 peak  2418 spectrum    1 weight  0.11000E+01 volume  0.59760E-03 ppm1      3.133 ppm2      4.264 CV     1
 ASSI { 2419}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 91   and name HN  ))
      3.900     1.900     1.900 peak  2419 spectrum    1 weight  0.11000E+01 volume  0.97112E-03 ppm1      1.925 ppm2      7.527 CV     1
 ASSI { 2422}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 89   and name HN  ))
      3.900     1.900     1.900 peak  2422 spectrum    1 weight  0.11000E+01 volume  0.54995E-03 ppm1      1.938 ppm2      8.208 CV     1
 ASSI { 2423}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.100     1.200     1.200 peak  2423 spectrum    1 weight  0.11000E+01 volume  0.36138E-02 ppm1      2.323 ppm2      7.390 CV     1
 ASSI { 2424}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
      4.600     2.600     1.400 peak  2424 spectrum    1 weight  0.11000E+01 volume  0.62964E-04 ppm1      1.849 ppm2      8.644 CV     1
 ASSI { 2426}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
      5.200     3.400     0.800 peak  2426 spectrum    1 weight  0.11000E+01 volume  0.99646E-04 ppm1      1.857 ppm2      9.303 CV     1
 ASSI { 2427}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 101  and name HN  ))
      4.800     2.900     1.200 peak  2427 spectrum    1 weight  0.11000E+01 volume  0.20894E-03 ppm1      1.546 ppm2      8.649 CV     1
 ASSI { 2428}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 67   and name HN  ))
      5.000     3.200     1.000 peak  2428 spectrum    1 weight  0.11000E+01 volume  0.21869E-03 ppm1      1.586 ppm2      9.308 CV     1
 ASSI { 2430}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 44   and name HE3 ))
      4.700     2.800     1.300 peak  2430 spectrum    1 weight  0.11000E+01 volume  0.37550E-03 ppm1      1.459 ppm2      7.642 CV     1
 ASSI { 2434}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 90   and name HZ3 ))
      4.800     2.900     1.200 peak  2434 spectrum    1 weight  0.11000E+01 volume  0.22266E-03 ppm1      1.867 ppm2      6.847 CV     1
 ASSI { 2435}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 44   and name HE3 ))
      6.000     4.500     0.000 peak  2435 spectrum    1 weight  0.11000E+01 volume  0.10612E-03 ppm1      1.669 ppm2      7.637 CV     1
 ASSI { 2436}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HN  ))
      3.500     1.500     1.500 peak  2436 spectrum    1 weight  0.11000E+01 volume  0.39528E-03 ppm1      1.676 ppm2      7.808 CV     1
 ASSI { 2440}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 127  and name HD1 ))
      5.400     3.700     0.600 peak  2440 spectrum    1 weight  0.11000E+01 volume  0.32589E-03 ppm1      1.444 ppm2      3.477 CV     1
 ASSI { 2441}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 130  and name HB2 ))
      1.800     0.400     0.400 peak  2441 spectrum    1 weight  0.11000E+01 volume  0.63918E-02 ppm1      1.452 ppm2      1.676 CV     1
 ASSI { 2443}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 89   and name HA  ))
      4.100     2.100     1.900 peak  2443 spectrum    1 weight  0.11000E+01 volume  0.11780E-03 ppm1      1.931 ppm2      3.465 CV     1
 ASSI { 2446}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HH22))
      6.000     4.700     0.000 peak  2446 spectrum    1 weight  0.11000E+01 volume  0.24247E-03 ppm1      3.163 ppm2      7.164 CV     1
 ASSI { 2447}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 136  and name HH11))
      3.300     1.400     1.400 peak  2447 spectrum    1 weight  0.11000E+01 volume  0.34765E-03 ppm1      3.157 ppm2      6.386 CV     1
 ASSI { 2448}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HN  ))
      5.200     3.400     0.800 peak  2448 spectrum    1 weight  0.11000E+01 volume  0.29878E-03 ppm1      3.157 ppm2      7.015 CV     1
 ASSI { 2449}
   (( segid "    " and resid 137  and name HD1 ))
   (( segid "    " and resid 137  and name HH22))
      5.500     3.800     0.500 peak  2449 spectrum    1 weight  0.11000E+01 volume  0.42831E-03 ppm1      2.957 ppm2      7.162 CV     1
 ASSI { 2456}
   (( segid "    " and resid 130  and name HB2 ))
   (  segid "    " and resid 130  and name HD1%)
      2.600     0.900     0.900 peak  2456 spectrum    1 weight  0.11000E+01 volume  0.29452E-02 ppm1      1.670 ppm2      0.782 CV     1
 ASSI { 2459}
   (( segid "    " and resid 92   and name HB2 ))
   (  segid "    " and resid 92   and name HD2%)
      2.700     0.900     0.900 peak  2459 spectrum    1 weight  0.11000E+01 volume  0.28659E-02 ppm1      1.936 ppm2      0.681 CV     1
 ASSI { 2463}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HG2 ))
      3.700     1.700     1.700 peak  2463 spectrum    1 weight  0.11000E+01 volume  0.41842E-03 ppm1      2.947 ppm2      1.405 CV     1
 ASSI { 2464}
   (( segid "    " and resid 137  and name HD1 ))
   (( segid "    " and resid 137  and name HB2 ))
      4.500     2.600     1.500 peak  2464 spectrum    1 weight  0.11000E+01 volume  0.42460E-03 ppm1      2.963 ppm2      1.794 CV     1
 ASSI { 2465}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HB1 ))
      4.600     2.600     1.400 peak  2465 spectrum    1 weight  0.11000E+01 volume  0.33446E-03 ppm1      2.947 ppm2      1.560 CV     1
 ASSI { 2466}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HG2 ))
      2.500     0.800     0.800 peak  2466 spectrum    1 weight  0.11000E+01 volume  0.40244E-02 ppm1      3.158 ppm2      1.458 CV     1
 ASSI { 2467}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HB2 ))
      3.000     1.100     1.100 peak  2467 spectrum    1 weight  0.11000E+01 volume  0.45799E-02 ppm1      3.162 ppm2      1.742 CV     1
 ASSI { 2485}
   (( segid "    " and resid 38   and name HA2 ))
   (  segid "    " and resid 39   and name HD1%)
      3.500     3.500     2.500 peak  2485 spectrum    1 weight  0.11000E+01 volume  0.29875E-02 ppm1      3.923 ppm2      0.810 CV     1
 ASSI { 2486}
   (( segid "    " and resid 38   and name HA2 ))
   (( segid "    " and resid 39   and name HG11))
      4.600     2.700     1.400 peak  2486 spectrum    1 weight  0.11000E+01 volume  0.64313E-03 ppm1      3.929 ppm2      1.075 CV     1
 ASSI { 2487}
   (( segid "    " and resid 38   and name HA2 ))
   (( segid "    " and resid 39   and name HG12))
      3.900     1.900     1.900 peak  2487 spectrum    1 weight  0.11000E+01 volume  0.18627E-02 ppm1      3.921 ppm2      1.332 CV     1
 ASSI { 2488}
   (( segid "    " and resid 38   and name HA2 ))
   (( segid "    " and resid 37   and name HB2 ))
      3.000     3.000     3.000 peak  2488 spectrum    1 weight  0.11000E+01 volume  0.67579E-03 ppm1      3.935 ppm2      1.851 CV     1
 ASSI { 2489}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 118  and name HB2 ))
      4.500     2.600     1.500 peak  2489 spectrum    1 weight  0.11000E+01 volume  0.45830E-03 ppm1      3.636 ppm2      2.159 CV     1
 ASSI { 2499}
   (( segid "    " and resid 16   and name HA1 ))
   (( segid "    " and resid 16   and name HN  ))
      3.100     1.200     1.200 peak  2499 spectrum    1 weight  0.11000E+01 volume  0.12053E-02 ppm1      3.914 ppm2      8.487 CV     1
 ASSI { 2501}
   (( segid "    " and resid 65   and name HA2 ))
   (( segid "    " and resid 65   and name HN  ))
      2.900     1.100     1.100 peak  2501 spectrum    1 weight  0.11000E+01 volume  0.13535E-02 ppm1      4.254 ppm2      8.796 CV     1
 ASSI { 2505}
   (( segid "    " and resid 65   and name HA2 ))
   (( segid "    " and resid 62   and name HB2 ))
      3.200     3.200     2.800 peak  2505 spectrum    1 weight  0.11000E+01 volume  0.79999E-03 ppm1      4.257 ppm2      1.503 CV     1
 ASSI { 2518}
   (( segid "    " and resid 65   and name HA1 ))
   (( segid "    " and resid 62   and name HG2 ))
      5.700     4.100     0.300 peak  2518 spectrum    1 weight  0.11000E+01 volume  0.21310E-03 ppm1      3.744 ppm2      1.825 CV     1
 ASSI { 2519}
   (( segid "    " and resid 65   and name HA1 ))
   (( segid "    " and resid 62   and name HB2 ))
      4.400     2.400     1.600 peak  2519 spectrum    1 weight  0.11000E+01 volume  0.79257E-03 ppm1      3.746 ppm2      1.517 CV     1
 ASSI { 2520}
   (( segid "    " and resid 65   and name HA1 ))
   (( segid "    " and resid 62   and name HB1 ))
      5.200     3.400     0.800 peak  2520 spectrum    1 weight  0.11000E+01 volume  0.70879E-03 ppm1      3.762 ppm2      1.233 CV     1
 ASSI { 2525}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
      4.500     2.500     1.500 peak  2525 spectrum    1 weight  0.11000E+01 volume  0.67998E-04 ppm1      1.670 ppm2      8.638 CV     1
 ASSI { 2526}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 68   and name HN  ))
      4.800     2.900     1.200 peak  2526 spectrum    1 weight  0.11000E+01 volume  0.21969E-03 ppm1      1.669 ppm2      8.216 CV     1
 ASSI { 2527}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 100  and name HN  ))
      3.700     1.700     1.700 peak  2527 spectrum    1 weight  0.11000E+01 volume  0.10297E-02 ppm1      1.673 ppm2      8.080 CV     1
 ASSI { 2529}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 68   and name HN  ))
      5.700     4.000     0.300 peak  2529 spectrum    1 weight  0.11000E+01 volume  0.96732E-04 ppm1      1.522 ppm2      8.220 CV     1
 ASSI { 2530}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 101  and name HN  ))
      6.000     4.800     0.000 peak  2530 spectrum    1 weight  0.11000E+01 volume  0.70971E-04 ppm1      1.528 ppm2      8.646 CV     1
 ASSI { 2534}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 66   and name HE1 ))
      5.700     4.100     0.300 peak  2534 spectrum    1 weight  0.11000E+01 volume  0.15869E-03 ppm1      1.530 ppm2      3.102 CV     1
 ASSI { 2539}
   (( segid "    " and resid 87   and name HA2 ))
   (  segid "    " and resid 84   and name HG2%)
      3.200     3.200     2.800 peak  2539 spectrum    1 weight  0.11000E+01 volume  0.44529E-03 ppm1      3.914 ppm2      1.243 CV     1
 ASSI { 2541}
   (( segid "    " and resid 87   and name HA1 ))
   (( segid "    " and resid 86   and name HB2 ))
      4.900     2.900     1.100 peak  2541 spectrum    1 weight  0.11000E+01 volume  0.64024E-03 ppm1      3.914 ppm2      1.739 CV     1
 ASSI { 2543}
   (( segid "    " and resid 87   and name HA2 ))
   (( segid "    " and resid 88   and name HB2 ))
      4.600     4.600     1.400 peak  2543 spectrum    1 weight  0.11000E+01 volume  0.98683E-03 ppm1      3.913 ppm2      2.053 CV     1
 ASSI { 2545}
   (( segid "    " and resid 87   and name HA2 ))
   (( segid "    " and resid 91   and name HE1 ))
      3.800     3.800     2.200 peak  2545 spectrum    1 weight  0.11000E+01 volume  0.13937E-02 ppm1      3.916 ppm2      2.857 CV     1
 ASSI { 2547}
   (( segid "    " and resid 47   and name HA2 ))
   (( segid "    " and resid 48   and name HN  ))
      3.200     3.200     2.800 peak  2547 spectrum    1 weight  0.11000E+01 volume  0.13105E-02 ppm1      4.159 ppm2      7.697 CV     1
 ASSI { 2548}
   (( segid "    " and resid 47   and name HA2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.000     1.100     1.100 peak  2548 spectrum    1 weight  0.11000E+01 volume  0.20859E-02 ppm1      4.159 ppm2      7.434 CV     1
 ASSI { 2549}
   (( segid "    " and resid 47   and name HA2 ))
   (( segid "    " and resid 49   and name HN  ))
      3.300     1.400     1.400 peak  2549 spectrum    1 weight  0.11000E+01 volume  0.19978E-02 ppm1      4.153 ppm2      7.233 CV     1
 ASSI { 2551}
   (( segid "    " and resid 87   and name HA2 ))
   (( segid "    " and resid 91   and name HN  ))
      3.800     1.800     1.800 peak  2551 spectrum    1 weight  0.11000E+01 volume  0.80197E-03 ppm1      3.954 ppm2      7.442 CV     1
 ASSI { 2552}
   (( segid "    " and resid 87   and name HA1 ))
   (( segid "    " and resid 88   and name HN  ))
      3.400     1.400     1.400 peak  2552 spectrum    1 weight  0.11000E+01 volume  0.78491E-03 ppm1      3.931 ppm2      7.288 CV     1
 ASSI { 2554}
   (( segid "    " and resid 87   and name HA1 ))
   (( segid "    " and resid 91   and name HN  ))
      4.500     2.600     1.500 peak  2554 spectrum    1 weight  0.11000E+01 volume  0.64631E-03 ppm1      3.915 ppm2      7.441 CV     1
 ASSI { 2555}
   (( segid "    " and resid 87   and name HA1 ))
   (( segid "    " and resid 87   and name HN  ))
      3.000     1.100     1.100 peak  2555 spectrum    1 weight  0.11000E+01 volume  0.12057E-02 ppm1      3.925 ppm2      8.548 CV     1
 ASSI { 2557}
   (( segid "    " and resid 47   and name HA1 ))
   (( segid "    " and resid 49   and name HN  ))
      4.300     2.300     1.700 peak  2557 spectrum    1 weight  0.11000E+01 volume  0.12361E-02 ppm1      3.567 ppm2      7.237 CV     1
 ASSI { 2558}
   (( segid "    " and resid 47   and name HA1 ))
   (( segid "    " and resid 50   and name HN  ))
      4.200     2.200     1.800 peak  2558 spectrum    1 weight  0.11000E+01 volume  0.16503E-02 ppm1      3.564 ppm2      7.424 CV     1
 ASSI { 2560}
   (( segid "    " and resid 47   and name HA1 ))
   (( segid "    " and resid 47   and name HA2 ))
      2.100     0.600     0.600 peak  2560 spectrum    1 weight  0.11000E+01 volume  0.41703E-02 ppm1      3.569 ppm2      4.155 CV     1
 ASSI { 2561}
   (( segid "    " and resid 47   and name HA1 ))
   (( segid "    " and resid 50   and name HD1 ))
      4.700     2.800     1.300 peak  2561 spectrum    1 weight  0.11000E+01 volume  0.91991E-03 ppm1      3.552 ppm2      1.660 CV     1
 ASSI { 2562}
   (( segid "    " and resid 69   and name HA1 ))
   (( segid "    " and resid 67   and name HB  ))
      3.500     3.500     2.500 peak  2562 spectrum    1 weight  0.11000E+01 volume  0.22833E-02 ppm1      3.566 ppm2      1.798 CV     1
 ASSI { 2563}
   (( segid "    " and resid 47   and name HA1 ))
   (( segid "    " and resid 50   and name HB2 ))
      4.600     2.600     1.400 peak  2563 spectrum    1 weight  0.11000E+01 volume  0.92988E-03 ppm1      3.563 ppm2      2.237 CV     1
 ASSI { 2565}
   (( segid "    " and resid 69   and name HA2 ))
   (( segid "    " and resid 67   and name HB  ))
      3.400     1.500     1.500 peak  2565 spectrum    1 weight  0.11000E+01 volume  0.91919E-03 ppm1      3.805 ppm2      1.768 CV     1
 ASSI { 2567}
   (( segid "    " and resid 47   and name HA2 ))
   (( segid "    " and resid 50   and name HB1 ))
      3.800     1.800     1.800 peak  2567 spectrum    1 weight  0.11000E+01 volume  0.85352E-03 ppm1      4.145 ppm2      2.243 CV     1
 ASSI { 2581}
   (( segid "    " and resid 123  and name HD1 ))
   (( segid "    " and resid 123  and name HG2 ))
      2.900     1.000     1.000 peak  2581 spectrum    1 weight  0.11000E+01 volume  0.38221E-02 ppm1      3.304 ppm2      1.898 CV     1
 ASSI { 2582}
   (( segid "    " and resid 69   and name HA1 ))
   (( segid "    " and resid 73   and name HG2 ))
      3.300     1.400     1.400 peak  2582 spectrum    1 weight  0.11000E+01 volume  0.68172E-03 ppm1      3.573 ppm2      1.292 CV     1
 ASSI { 2583}
   (( segid "    " and resid 69   and name HA1 ))
   (  segid "    " and resid 101  and name HD1%)
      6.000     6.000     0.000 peak  2583 spectrum    1 weight  0.11000E+01 volume  0.13002E-03 ppm1      3.576 ppm2      0.860 CV     1
 ASSI { 2584}
   (( segid "    " and resid 69   and name HA1 ))
   (  segid "    " and resid 72   and name HB% )
      4.200     2.200     1.800 peak  2584 spectrum    1 weight  0.11000E+01 volume  0.14159E-02 ppm1      3.576 ppm2      1.787 CV     1
 ASSI { 2585}
   (( segid "    " and resid 69   and name HA2 ))
   (( segid "    " and resid 73   and name HG2 ))
      3.300     1.400     1.400 peak  2585 spectrum    1 weight  0.11000E+01 volume  0.51729E-03 ppm1      3.792 ppm2      1.299 CV     1
 ASSI { 2586}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 123  and name HG2 ))
      2.000     0.500     0.500 peak  2586 spectrum    1 weight  0.11000E+01 volume  0.74671E-02 ppm1      3.728 ppm2      1.856 CV     1
 ASSI { 2587}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 44   and name HH2 ))
      3.300     3.300     2.700 peak  2587 spectrum    1 weight  0.11000E+01 volume  0.35734E-03 ppm1      2.168 ppm2      7.299 CV     1
 ASSI { 2588}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 135  and name HN  ))
      4.900     3.000     1.100 peak  2588 spectrum    1 weight  0.11000E+01 volume  0.26879E-03 ppm1      2.171 ppm2      7.753 CV     1
 ASSI { 2595}
   (( segid "    " and resid 123  and name HD1 ))
   (( segid "    " and resid 123  and name HB1 ))
      4.200     2.200     1.800 peak  2595 spectrum    1 weight  0.11000E+01 volume  0.31680E-03 ppm1      3.314 ppm2      2.300 CV     1
 ASSI { 2597}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 122  and name HA  ))
      3.300     1.400     1.400 peak  2597 spectrum    1 weight  0.11000E+01 volume  0.11538E-02 ppm1      3.727 ppm2      4.410 CV     1
 ASSI { 2599}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 122  and name HB1 ))
      3.600     1.600     1.600 peak  2599 spectrum    1 weight  0.11000E+01 volume  0.57727E-03 ppm1      3.728 ppm2      1.163 CV     1
 ASSI { 2603}
   (( segid "    " and resid 51   and name HD1 ))
   (( segid "    " and resid 51   and name HB1 ))
      3.500     1.500     1.500 peak  2603 spectrum    1 weight  0.11000E+01 volume  0.16230E-02 ppm1      3.418 ppm2      1.855 CV     1
 ASSI { 2605}
   (( segid "    " and resid 123  and name HD1 ))
   (( segid "    " and resid 123  and name HG1 ))
      2.200     0.600     0.600 peak  2605 spectrum    1 weight  0.11000E+01 volume  0.44569E-02 ppm1      3.309 ppm2      1.855 CV     1
 ASSI { 2606}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 123  and name HD1 ))
      1.600     0.300     0.600 peak  2606 spectrum    1 weight  0.11000E+01 volume  0.12090E-01 ppm1      3.741 ppm2      3.324 CV     1
 ASSI { 2614}
   (( segid "    " and resid 123  and name HD1 ))
   (( segid "    " and resid 122  and name HB1 ))
      3.200     1.300     1.300 peak  2614 spectrum    1 weight  0.11000E+01 volume  0.38566E-02 ppm1      3.320 ppm2      1.123 CV     1
 ASSI { 2627}
   (( segid "    " and resid 62   and name HD2 ))
   (  segid "    " and resid 57   and name HD% )
      3.100     3.100     2.900 peak  2627 spectrum    1 weight  0.11000E+01 volume  0.56248E-03 ppm1      3.392 ppm2      7.569 CV     1
 ASSI { 2630}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 58   and name HN  ))
      4.900     3.000     1.100 peak  2630 spectrum    1 weight  0.11000E+01 volume  0.35177E-04 ppm1      3.405 ppm2      7.800 CV     1
 ASSI { 2636}
   (( segid "    " and resid 51   and name HD2 ))
   (( segid "    " and resid 48   and name HN  ))
      3.000     3.000     3.000 peak  2636 spectrum    1 weight  0.11000E+01 volume  0.65483E-03 ppm1      3.753 ppm2      7.622 CV     1
 ASSI { 2639}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 123  and name HB2 ))
      3.400     1.500     1.500 peak  2639 spectrum    1 weight  0.11000E+01 volume  0.39477E-02 ppm1      3.744 ppm2      2.291 CV     1
 ASSI { 2641}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 122  and name HB2 ))
      3.300     1.400     1.400 peak  2641 spectrum    1 weight  0.11000E+01 volume  0.18752E-02 ppm1      3.739 ppm2      1.663 CV     1
 ASSI { 2667}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HG1 ))
      3.100     1.200     1.200 peak  2667 spectrum    1 weight  0.11000E+01 volume  0.24044E-02 ppm1      2.169 ppm2      1.528 CV     1
 ASSI { 2679}
   (( segid "    " and resid 51   and name HG1 ))
   (( segid "    " and resid 51   and name HD1 ))
      2.900     1.000     1.000 peak  2679 spectrum    1 weight  0.11000E+01 volume  0.94853E-03 ppm1      2.043 ppm2      3.392 CV     1
 ASSI { 2698}
   (( segid "    " and resid 51   and name HD2 ))
   (( segid "    " and resid 53   and name HN  ))
      6.000     4.400     0.000 peak  2698 spectrum    1 weight  0.11000E+01 volume  0.66909E-04 ppm1      3.740 ppm2      7.177 CV     1
 ASSI { 2699}
   (( segid "    " and resid 51   and name HD2 ))
   (( segid "    " and resid 51   and name HD1 ))
      1.900     0.500     0.500 peak  2699 spectrum    1 weight  0.11000E+01 volume  0.38762E-02 ppm1      3.750 ppm2      3.411 CV     1
 ASSI { 2700}
   (( segid "    " and resid 51   and name HD2 ))
   (( segid "    " and resid 50   and name HA  ))
      4.700     2.800     1.300 peak  2700 spectrum    1 weight  0.11000E+01 volume  0.21713E-03 ppm1      3.756 ppm2      4.000 CV     1
 ASSI { 2702}
   (( segid "    " and resid 51   and name HD2 ))
   (( segid "    " and resid 51   and name HB1 ))
      3.900     1.900     1.900 peak  2702 spectrum    1 weight  0.11000E+01 volume  0.14943E-02 ppm1      3.752 ppm2      1.818 CV     1
 ASSI { 2705}
   (( segid "    " and resid 127  and name HD1 ))
   (  segid "    " and resid 126  and name HD2%)
      2.200     2.200     3.800 peak  2705 spectrum    1 weight  0.11000E+01 volume  0.45657E-02 ppm1      3.477 ppm2      0.959 CV     1
 ASSI { 2708}
   (( segid "    " and resid 127  and name HD1 ))
   (( segid "    " and resid 127  and name HG1 ))
      2.300     0.700     0.700 peak  2708 spectrum    1 weight  0.11000E+01 volume  0.38539E-02 ppm1      3.477 ppm2      1.537 CV     1
 ASSI { 2710}
   (( segid "    " and resid 127  and name HD1 ))
   (( segid "    " and resid 127  and name HG2 ))
      3.200     1.300     1.300 peak  2710 spectrum    1 weight  0.11000E+01 volume  0.14818E-02 ppm1      3.479 ppm2      2.119 CV     1
 ASSI { 2712}
   (( segid "    " and resid 127  and name HD1 ))
   (( segid "    " and resid 127  and name HB2 ))
      6.000     5.700     0.000 peak  2712 spectrum    1 weight  0.11000E+01 volume  0.61080E-04 ppm1      3.484 ppm2      2.475 CV     1
 ASSI { 2713}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HD1 ))
      2.000     0.500     0.500 peak  2713 spectrum    1 weight  0.11000E+01 volume  0.29043E-02 ppm1      3.436 ppm2      3.098 CV     1
 ASSI { 2714}
   (( segid "    " and resid 51   and name HD1 ))
   (( segid "    " and resid 51   and name HB2 ))
      4.700     2.800     1.300 peak  2714 spectrum    1 weight  0.11000E+01 volume  0.49811E-03 ppm1      3.394 ppm2      2.333 CV     1
 ASSI { 2717}
   (( segid "    " and resid 62   and name HD2 ))
   (  segid "    " and resid 57   and name HE% )
      4.000     2.000     2.000 peak  2717 spectrum    1 weight  0.11000E+01 volume  0.11077E-03 ppm1      3.412 ppm2      7.226 CV     1
 ASSI { 2718}
   (( segid "    " and resid 51   and name HD1 ))
   (( segid "    " and resid 48   and name HN  ))
      3.000     3.000     3.000 peak  2718 spectrum    1 weight  0.11000E+01 volume  0.60661E-03 ppm1      3.383 ppm2      7.588 CV     1
 ASSI { 2719}
   (( segid "    " and resid 51   and name HD1 ))
   (( segid "    " and resid 52   and name HN  ))
      3.700     1.700     1.700 peak  2719 spectrum    1 weight  0.11000E+01 volume  0.13440E-02 ppm1      3.406 ppm2      7.399 CV     1
 ASSI { 2720}
   (( segid "    " and resid 51   and name HD1 ))
   (( segid "    " and resid 50   and name HN  ))
      3.000     1.100     1.100 peak  2720 spectrum    1 weight  0.11000E+01 volume  0.20941E-02 ppm1      3.406 ppm2      7.399 CV     1
 ASSI { 2724}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 58   and name HN  ))
      4.200     2.200     1.800 peak  2724 spectrum    1 weight  0.11000E+01 volume  0.79330E-03 ppm1      3.091 ppm2      7.781 CV     1
 ASSI { 2726}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 61   and name HA  ))
      2.400     0.700     0.700 peak  2726 spectrum    1 weight  0.11000E+01 volume  0.29901E-02 ppm1      3.099 ppm2      3.977 CV     1
 ASSI { 2729}
   (( segid "    " and resid 62   and name HD1 ))
   (  segid "    " and resid 67   and name HG2%)
      3.400     1.400     1.400 peak  2729 spectrum    1 weight  0.11000E+01 volume  0.97329E-03 ppm1      3.097 ppm2     -0.042 CV     1
 ASSI { 2730}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HD1 ))
      1.800     0.400     0.400 peak  2730 spectrum    1 weight  0.11000E+01 volume  0.37703E-02 ppm1      3.964 ppm2      3.348 CV     1
 ASSI { 2736}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 127  and name HG1 ))
      3.100     1.200     1.200 peak  2736 spectrum    1 weight  0.11000E+01 volume  0.26719E-02 ppm1      4.089 ppm2      1.538 CV     1
 ASSI { 2756}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
      3.500     3.500     2.500 peak  2756 spectrum    1 weight  0.11000E+01 volume  0.16455E-02 ppm1      4.531 ppm2      8.429 CV     1
 ASSI { 2758}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 95   and name HA  ))
      5.400     3.700     0.600 peak  2758 spectrum    1 weight  0.11000E+01 volume  0.24748E-03 ppm1      4.525 ppm2      3.474 CV     1
 ASSI { 2759}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 83   and name HB2 ))
      6.000     6.000     0.000 peak  2759 spectrum    1 weight  0.11000E+01 volume  0.63879E-05 ppm1      4.520 ppm2      2.884 CV     1
 ASSI { 2761}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      5.200     3.400     0.800 peak  2761 spectrum    1 weight  0.11000E+01 volume  0.47835E-03 ppm1      4.524 ppm2      1.762 CV     1
 ASSI { 2762}
   (( segid "    " and resid 94   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
      4.300     2.300     1.700 peak  2762 spectrum    1 weight  0.11000E+01 volume  0.12965E-02 ppm1      4.525 ppm2      1.052 CV     1
 ASSI { 2763}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB1 ))
      3.000     1.100     1.100 peak  2763 spectrum    1 weight  0.11000E+01 volume  0.28105E-02 ppm1      4.526 ppm2      1.185 CV     1
 ASSI { 2764}
   (( segid "    " and resid 94   and name HA  ))
   (  segid "    " and resid 101  and name HD2%)
      3.200     1.300     1.300 peak  2764 spectrum    1 weight  0.11000E+01 volume  0.15456E-02 ppm1      4.525 ppm2      0.075 CV     1
 ASSI { 2771}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.500     0.800     0.800 peak  2771 spectrum    1 weight  0.11000E+01 volume  0.30323E-02 ppm1      4.524 ppm2      2.210 CV     1
 ASSI { 2774}
   (( segid "    " and resid 132  and name HD2 ))
   (  segid "    " and resid 131  and name HG1%)
      3.500     1.500     1.500 peak  2774 spectrum    1 weight  0.11000E+01 volume  0.13782E-02 ppm1      4.284 ppm2      0.817 CV     1
 ASSI { 2776}
   (( segid "    " and resid 132  and name HD2 ))
   (  segid "    " and resid 131  and name HG2%)
      3.100     3.100     2.900 peak  2776 spectrum    1 weight  0.11000E+01 volume  0.20758E-02 ppm1      4.290 ppm2      0.968 CV     1
 ASSI { 2777}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HB1 ))
      4.000     2.000     2.000 peak  2777 spectrum    1 weight  0.11000E+01 volume  0.13883E-02 ppm1      4.285 ppm2      1.380 CV     1
 ASSI { 2778}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HG2 ))
      2.600     0.800     0.800 peak  2778 spectrum    1 weight  0.11000E+01 volume  0.19000E-02 ppm1      4.281 ppm2      1.772 CV     1
 ASSI { 2779}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HD1 ))
      2.800     1.000     1.000 peak  2779 spectrum    1 weight  0.11000E+01 volume  0.49614E-03 ppm1      4.292 ppm2      3.228 CV     1
 ASSI { 2780}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 131  and name HA  ))
      4.800     2.900     1.200 peak  2780 spectrum    1 weight  0.11000E+01 volume  0.79156E-04 ppm1      4.288 ppm2      3.728 CV     1
 ASSI { 2781}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HB2 ))
      2.500     0.800     0.800 peak  2781 spectrum    1 weight  0.11000E+01 volume  0.50351E-02 ppm1      4.624 ppm2      2.491 CV     1
 ASSI { 2783}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HB2 ))
      4.300     2.300     1.700 peak  2783 spectrum    1 weight  0.11000E+01 volume  0.90131E-03 ppm1      4.625 ppm2      1.528 CV     1
 ASSI { 2786}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HA  ))
      5.400     3.600     0.600 peak  2786 spectrum    1 weight  0.11000E+01 volume  0.18092E-03 ppm1      4.632 ppm2      4.112 CV     1
 ASSI { 2804}
   (( segid "    " and resid 132  and name HD1 ))
   (( segid "    " and resid 135  and name HD2 ))
      4.800     2.800     1.200 peak  2804 spectrum    1 weight  0.11000E+01 volume  0.52846E-03 ppm1      3.233 ppm2      1.443 CV     1
 ASSI { 2805}
   (( segid "    " and resid 132  and name HD1 ))
   (( segid "    " and resid 135  and name HG1 ))
      4.200     2.200     1.800 peak  2805 spectrum    1 weight  0.11000E+01 volume  0.73919E-03 ppm1      3.234 ppm2      1.140 CV     1
 ASSI { 2806}
   (( segid "    " and resid 132  and name HD1 ))
   (  segid "    " and resid 131  and name HG2%)
      3.700     1.700     1.700 peak  2806 spectrum    1 weight  0.11000E+01 volume  0.22734E-02 ppm1      3.234 ppm2      1.005 CV     1
 ASSI { 2808}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 66   and name HG1 ))
      3.800     1.800     1.800 peak  2808 spectrum    1 weight  0.11000E+01 volume  0.13602E-02 ppm1      5.592 ppm2      1.306 CV     1
 ASSI { 2809}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 66   and name HG2 ))
      4.000     2.000     2.000 peak  2809 spectrum    1 weight  0.11000E+01 volume  0.12837E-02 ppm1      5.590 ppm2      1.442 CV     1
 ASSI { 2810}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
      3.300     1.400     1.400 peak  2810 spectrum    1 weight  0.11000E+01 volume  0.11022E-02 ppm1      5.593 ppm2      1.711 CV     1
 ASSI { 2814}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 101  and name HA  ))
      5.200     3.400     0.800 peak  2814 spectrum    1 weight  0.11000E+01 volume  0.14053E-03 ppm1      5.597 ppm2      5.811 CV     1
 ASSI { 2815}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 57   and name HZ  ))
      4.200     2.200     1.800 peak  2815 spectrum    1 weight  0.11000E+01 volume  0.29785E-03 ppm1      5.594 ppm2      6.825 CV     1
 ASSI { 2818}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 101  and name HN  ))
      3.700     1.700     1.700 peak  2818 spectrum    1 weight  0.11000E+01 volume  0.10121E-02 ppm1      5.588 ppm2      8.630 CV     1
 ASSI { 2819}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HN  ))
      3.100     1.200     1.200 peak  2819 spectrum    1 weight  0.11000E+01 volume  0.62270E-03 ppm1      5.589 ppm2      9.145 CV     1
 ASSI { 2824}
   (( segid "    " and resid 125  and name HA  ))
   (  segid "    " and resid 92   and name HD1%)
      3.800     1.800     1.800 peak  2824 spectrum    1 weight  0.11000E+01 volume  0.45186E-03 ppm1      4.626 ppm2      0.870 CV     1
 ASSI { 2825}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HB1 ))
      4.300     2.400     1.700 peak  2825 spectrum    1 weight  0.11000E+01 volume  0.97671E-03 ppm1      4.625 ppm2      1.520 CV     1
 ASSI { 2827}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HB1 ))
      3.000     1.100     1.100 peak  2827 spectrum    1 weight  0.11000E+01 volume  0.34821E-02 ppm1      4.625 ppm2      2.327 CV     1
 ASSI { 2829}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 124  and name HA  ))
      6.000     6.000     0.000 peak  2829 spectrum    1 weight  0.11000E+01 volume  0.14336E-04 ppm1      4.626 ppm2      4.054 CV     1
 ASSI { 2836}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 97   and name HN  ))
      4.600     2.600     1.400 peak  2836 spectrum    1 weight  0.11000E+01 volume  0.23152E-03 ppm1      4.522 ppm2      7.490 CV     1
 ASSI { 2838}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HD1 ))
      2.400     0.700     0.700 peak  2838 spectrum    1 weight  0.11000E+01 volume  0.20532E-02 ppm1      4.408 ppm2      3.318 CV     1
 ASSI { 2840}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HG2 ))
      4.500     2.500     1.500 peak  2840 spectrum    1 weight  0.11000E+01 volume  0.18780E-02 ppm1      4.404 ppm2      1.866 CV     1
 ASSI { 2841}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 122  and name HB2 ))
      2.800     1.000     1.000 peak  2841 spectrum    1 weight  0.11000E+01 volume  0.24656E-02 ppm1      4.408 ppm2      1.663 CV     1
 ASSI { 2848}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      3.200     3.200     2.800 peak  2848 spectrum    1 weight  0.11000E+01 volume  0.21190E-02 ppm1      5.814 ppm2      9.288 CV     1
 ASSI { 2849}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 93   and name HN  ))
      4.400     2.400     1.600 peak  2849 spectrum    1 weight  0.11000E+01 volume  0.94226E-03 ppm1      4.525 ppm2      8.014 CV     1
 ASSI { 2850}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
      4.400     2.400     1.600 peak  2850 spectrum    1 weight  0.11000E+01 volume  0.55255E-03 ppm1      4.517 ppm2      8.399 CV     1
 ASSI { 2852}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HB2 ))
      2.800     1.000     1.000 peak  2852 spectrum    1 weight  0.11000E+01 volume  0.41486E-02 ppm1      4.524 ppm2      3.123 CV     1
 ASSI { 2859}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HB1 ))
      2.800     1.000     1.000 peak  2859 spectrum    1 weight  0.11000E+01 volume  0.27079E-02 ppm1      4.183 ppm2      1.504 CV     1
 ASSI { 2860}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HG  ))
      3.100     1.200     1.200 peak  2860 spectrum    1 weight  0.11000E+01 volume  0.21381E-02 ppm1      4.182 ppm2      1.684 CV     1
 ASSI { 2895}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HB1 ))
      2.600     0.900     0.900 peak  2895 spectrum    1 weight  0.11000E+01 volume  0.58021E-02 ppm1      4.525 ppm2      2.286 CV     1
 ASSI { 2896}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HB2 ))
      3.700     1.700     1.700 peak  2896 spectrum    1 weight  0.11000E+01 volume  0.76010E-03 ppm1      4.475 ppm2      2.005 CV     1
 ASSI { 2901}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HG2 ))
      4.000     2.000     2.000 peak  2901 spectrum    1 weight  0.11000E+01 volume  0.12996E-02 ppm1      4.524 ppm2      1.359 CV     1
 ASSI { 2902}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 101  and name HG  ))
      5.400     3.700     0.600 peak  2902 spectrum    1 weight  0.11000E+01 volume  0.17845E-03 ppm1      4.526 ppm2      1.551 CV     1
 ASSI { 2905}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 122  and name HN  ))
      4.400     2.500     1.600 peak  2905 spectrum    1 weight  0.11000E+01 volume  0.10995E-03 ppm1      4.397 ppm2      8.586 CV     1
 ASSI { 2911}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
      6.000     4.700     0.000 peak  2911 spectrum    1 weight  0.11000E+01 volume  0.27685E-03 ppm1      5.819 ppm2      8.798 CV     1
 ASSI { 2913}
   (( segid "    " and resid 101  and name HA  ))
   (  segid "    " and resid 101  and name HD1%)
      4.200     2.200     1.800 peak  2913 spectrum    1 weight  0.11000E+01 volume  0.68446E-03 ppm1      5.820 ppm2      0.828 CV     1
 ASSI { 2914}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HB1 ))
      2.500     0.800     0.800 peak  2914 spectrum    1 weight  0.11000E+01 volume  0.25323E-02 ppm1      5.817 ppm2      1.568 CV     1
 ASSI { 2915}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HB2 ))
      3.600     1.600     1.600 peak  2915 spectrum    1 weight  0.11000E+01 volume  0.64303E-03 ppm1      5.815 ppm2      1.858 CV     1
 ASSI { 2916}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 105  and name HB1 ))
      2.900     1.000     1.000 peak  2916 spectrum    1 weight  0.11000E+01 volume  0.10861E-02 ppm1      5.820 ppm2      2.223 CV     1
 ASSI { 2917}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 102  and name HB1 ))
      4.700     2.800     1.300 peak  2917 spectrum    1 weight  0.11000E+01 volume  0.58401E-03 ppm1      5.834 ppm2      2.525 CV     1
 ASSI { 2918}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 90   and name HH2 ))
      5.300     3.500     0.700 peak  2918 spectrum    1 weight  0.11000E+01 volume  0.12016E-03 ppm1      5.810 ppm2      6.804 CV     1
 ASSI { 2919}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB1 ))
      2.800     1.000     1.000 peak  2919 spectrum    1 weight  0.11000E+01 volume  0.28579E-02 ppm1      4.626 ppm2      2.441 CV     1
 ASSI { 2920}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
      2.800     1.000     1.000 peak  2920 spectrum    1 weight  0.11000E+01 volume  0.56142E-02 ppm1      4.632 ppm2      2.999 CV     1
 ASSI { 2930}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 18   and name HB% )
      3.700     1.700     1.700 peak  2930 spectrum    1 weight  0.11000E+01 volume  0.56253E-03 ppm1      4.230 ppm2      1.192 CV     1
 ASSI { 2939}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 68   and name HG2%)
      5.400     3.600     0.600 peak  2939 spectrum    1 weight  0.11000E+01 volume  0.50905E-03 ppm1      5.112 ppm2      1.333 CV     1
 ASSI { 2940}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB1 ))
      2.100     0.600     0.600 peak  2940 spectrum    1 weight  0.11000E+01 volume  0.54552E-02 ppm1      5.112 ppm2      1.545 CV     1
 ASSI { 2942}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 42   and name HG2%)
      3.300     3.300     2.700 peak  2942 spectrum    1 weight  0.11000E+01 volume  0.30625E-02 ppm1      4.597 ppm2      0.872 CV     1
 ASSI { 2943}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
      4.100     4.100     1.900 peak  2943 spectrum    1 weight  0.11000E+01 volume  0.16287E-02 ppm1      4.623 ppm2      0.829 CV     1
 ASSI { 2947}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB1 ))
      2.300     0.700     0.700 peak  2947 spectrum    1 weight  0.11000E+01 volume  0.11991E-01 ppm1      4.596 ppm2      2.637 CV     1
 ASSI { 2949}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 60   and name HD1%)
      4.700     2.800     1.300 peak  2949 spectrum    1 weight  0.11000E+01 volume  0.86340E-03 ppm1      4.446 ppm2      0.464 CV     1
 ASSI { 2953}
   (( segid "    " and resid 135  and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      3.000     3.000     3.000 peak  2953 spectrum    1 weight  0.11000E+01 volume  0.71462E-02 ppm1      4.483 ppm2      0.910 CV     1
 ASSI { 2954}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HG1 ))
      3.400     1.400     1.400 peak  2954 spectrum    1 weight  0.11000E+01 volume  0.30657E-02 ppm1      4.476 ppm2      1.067 CV     1
 ASSI { 2955}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HB1 ))
      2.000     0.500     0.500 peak  2955 spectrum    1 weight  0.11000E+01 volume  0.11777E-01 ppm1      4.465 ppm2      1.495 CV     1
 ASSI { 2956}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HB2 ))
      3.200     1.300     1.300 peak  2956 spectrum    1 weight  0.11000E+01 volume  0.22673E-02 ppm1      4.463 ppm2      1.987 CV     1
 ASSI { 2958}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.200     1.300     1.300 peak  2958 spectrum    1 weight  0.11000E+01 volume  0.20867E-02 ppm1      4.403 ppm2      3.104 CV     1
 ASSI { 2960}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 82   and name HD1 ))
      2.800     0.900     0.900 peak  2960 spectrum    1 weight  0.11000E+01 volume  0.11607E-02 ppm1      4.488 ppm2      3.335 CV     1
 ASSI { 2967}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 125  and name HB1 ))
      3.800     1.800     1.800 peak  2967 spectrum    1 weight  0.11000E+01 volume  0.50784E-03 ppm1      4.168 ppm2      2.271 CV     1
 ASSI { 2968}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 92   and name HG  ))
      3.000     1.100     1.100 peak  2968 spectrum    1 weight  0.11000E+01 volume  0.11312E-02 ppm1      4.181 ppm2      1.744 CV     1
 ASSI { 2974}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 108  and name HB1 ))
      3.000     1.100     1.100 peak  2974 spectrum    1 weight  0.11000E+01 volume  0.15206E-02 ppm1      4.089 ppm2      1.810 CV     1
 ASSI { 2975}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 92   and name HB2 ))
      5.700     4.000     0.300 peak  2975 spectrum    1 weight  0.11000E+01 volume  0.15684E-03 ppm1      4.095 ppm2      1.970 CV     1
 ASSI { 2976}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 125  and name HB1 ))
      4.700     2.800     1.300 peak  2976 spectrum    1 weight  0.11000E+01 volume  0.59326E-03 ppm1      4.055 ppm2      2.284 CV     1
 ASSI { 2980}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 90   and name HH2 ))
      3.500     1.500     1.500 peak  2980 spectrum    1 weight  0.11000E+01 volume  0.44959E-03 ppm1      5.115 ppm2      6.798 CV     1
 ASSI { 2983}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 68   and name HN  ))
      6.000     5.400     0.000 peak  2983 spectrum    1 weight  0.11000E+01 volume  0.66057E-04 ppm1      5.119 ppm2      8.259 CV     1
 ASSI { 2984}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      3.900     1.900     1.900 peak  2984 spectrum    1 weight  0.11000E+01 volume  0.84995E-03 ppm1      4.594 ppm2      7.866 CV     1
 ASSI { 2985}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      3.700     1.700     1.700 peak  2985 spectrum    1 weight  0.11000E+01 volume  0.28845E-02 ppm1      4.593 ppm2      8.074 CV     1
 ASSI { 2988}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HN  ))
      3.100     1.200     1.200 peak  2988 spectrum    1 weight  0.11000E+01 volume  0.14152E-02 ppm1      4.463 ppm2      7.792 CV     1
 ASSI { 2992}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 136  and name HH12))
      5.300     3.500     0.700 peak  2992 spectrum    1 weight  0.11000E+01 volume  0.15840E-03 ppm1      4.471 ppm2      7.139 CV     1
 ASSI { 2998}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 95   and name HN  ))
      3.700     1.700     1.700 peak  2998 spectrum    1 weight  0.11000E+01 volume  0.61754E-03 ppm1      4.097 ppm2      8.223 CV     1
 ASSI { 3006}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      5.300     3.500     0.700 peak  3006 spectrum    1 weight  0.11000E+01 volume  0.22481E-03 ppm1      5.398 ppm2     -0.045 CV     1
 ASSI { 3007}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
      5.500     5.500     0.500 peak  3007 spectrum    1 weight  0.11000E+01 volume  0.24760E-03 ppm1      5.406 ppm2      0.834 CV     1
 ASSI { 3008}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HG1 ))
      3.300     1.400     1.400 peak  3008 spectrum    1 weight  0.11000E+01 volume  0.22507E-02 ppm1      5.403 ppm2      1.309 CV     1
 ASSI { 3009}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HG2 ))
      3.000     1.100     1.100 peak  3009 spectrum    1 weight  0.11000E+01 volume  0.29699E-02 ppm1      5.403 ppm2      1.453 CV     1
 ASSI { 3010}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
      2.400     0.700     0.700 peak  3010 spectrum    1 weight  0.11000E+01 volume  0.32452E-02 ppm1      5.403 ppm2      1.714 CV     1
 ASSI { 3011}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 102  and name HA  ))
      2.000     0.500     0.500 peak  3011 spectrum    1 weight  0.11000E+01 volume  0.25613E-02 ppm1      5.405 ppm2      5.594 CV     1
 ASSI { 3012}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 57   and name HZ  ))
      3.300     1.300     1.300 peak  3012 spectrum    1 weight  0.11000E+01 volume  0.41138E-03 ppm1      5.406 ppm2      6.830 CV     1
 ASSI { 3017}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 102  and name HN  ))
      3.700     1.700     1.700 peak  3017 spectrum    1 weight  0.11000E+01 volume  0.13141E-02 ppm1      5.399 ppm2      9.156 CV     1
 ASSI { 3026}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      4.900     3.000     1.100 peak  3026 spectrum    1 weight  0.11000E+01 volume  0.60878E-03 ppm1      4.593 ppm2      8.472 CV     1
 ASSI { 3031}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 131  and name HN  ))
      4.400     2.400     1.600 peak  3031 spectrum    1 weight  0.11000E+01 volume  0.21277E-03 ppm1      4.665 ppm2      7.167 CV     1
 ASSI { 3035}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB2 ))
      2.900     1.100     1.100 peak  3035 spectrum    1 weight  0.11000E+01 volume  0.24688E-02 ppm1      4.631 ppm2      1.679 CV     1
 ASSI { 3036}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB1 ))
      3.700     1.700     1.700 peak  3036 spectrum    1 weight  0.11000E+01 volume  0.43578E-03 ppm1      4.628 ppm2      1.499 CV     1
 ASSI { 3037}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 42   and name HG2%)
      4.200     2.200     1.800 peak  3037 spectrum    1 weight  0.11000E+01 volume  0.21154E-02 ppm1      4.597 ppm2      0.877 CV     1
 ASSI { 3038}
   (( segid "    " and resid 130  and name HA  ))
   (  segid "    " and resid 130  and name HD2%)
      2.900     1.000     1.000 peak  3038 spectrum    1 weight  0.11000E+01 volume  0.40169E-02 ppm1      4.619 ppm2      0.593 CV     1
 ASSI { 3039}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 63   and name HG1%)
      6.000     5.200     0.000 peak  3039 spectrum    1 weight  0.11000E+01 volume  0.10123E-03 ppm1      4.412 ppm2      0.938 CV     1
 ASSI { 3044}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
      6.000     4.600     0.000 peak  3044 spectrum    1 weight  0.11000E+01 volume  0.11133E-03 ppm1      4.395 ppm2      7.574 CV     1
 ASSI { 3063}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 102  and name HB1 ))
      6.000     6.000     0.000 peak  3063 spectrum    1 weight  0.11000E+01 volume  0.53574E-04 ppm1      5.397 ppm2      2.573 CV     1
 ASSI { 3064}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HE1 ))
      6.000     6.000     0.000 peak  3064 spectrum    1 weight  0.11000E+01 volume  0.56667E-04 ppm1      5.404 ppm2      3.074 CV     1
 ASSI { 3065}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 102  and name HB2 ))
      6.000     5.700     0.000 peak  3065 spectrum    1 weight  0.11000E+01 volume  0.47688E-04 ppm1      5.401 ppm2      3.277 CV     1
 ASSI { 3066}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 45   and name HG2%)
      4.400     2.400     1.600 peak  3066 spectrum    1 weight  0.11000E+01 volume  0.10038E-02 ppm1      5.212 ppm2      0.800 CV     1
 ASSI { 3067}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 45   and name HB  ))
      5.000     3.100     1.000 peak  3067 spectrum    1 weight  0.11000E+01 volume  0.60309E-03 ppm1      5.217 ppm2      2.119 CV     1
 ASSI { 3068}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB1 ))
      3.400     1.500     1.500 peak  3068 spectrum    1 weight  0.11000E+01 volume  0.14189E-02 ppm1      5.213 ppm2      2.855 CV     1
 ASSI { 3069}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB2 ))
      3.100     1.200     1.200 peak  3069 spectrum    1 weight  0.11000E+01 volume  0.11258E-02 ppm1      5.215 ppm2      3.517 CV     1
 ASSI { 3070}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 45   and name HA  ))
      3.800     1.800     1.800 peak  3070 spectrum    1 weight  0.11000E+01 volume  0.18670E-02 ppm1      5.223 ppm2      3.889 CV     1
 ASSI { 3071}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 60   and name HD1%)
      4.600     2.700     1.400 peak  3071 spectrum    1 weight  0.11000E+01 volume  0.20335E-03 ppm1      4.629 ppm2      0.427 CV     1
 ASSI { 3073}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 70   and name HB% )
      5.300     3.500     0.700 peak  3073 spectrum    1 weight  0.11000E+01 volume  0.13933E-03 ppm1      4.634 ppm2      1.291 CV     1
 ASSI { 3074}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HG1 ))
      4.500     2.600     1.500 peak  3074 spectrum    1 weight  0.11000E+01 volume  0.62747E-03 ppm1      4.634 ppm2      1.471 CV     1
 ASSI { 3075}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HD1 ))
      4.000     2.000     2.000 peak  3075 spectrum    1 weight  0.11000E+01 volume  0.13629E-02 ppm1      4.638 ppm2      1.695 CV     1
 ASSI { 3076}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HB1 ))
      3.300     1.300     1.300 peak  3076 spectrum    1 weight  0.11000E+01 volume  0.15551E-02 ppm1      4.641 ppm2      1.959 CV     1
 ASSI { 3077}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.100     1.200     1.200 peak  3077 spectrum    1 weight  0.11000E+01 volume  0.11075E-02 ppm1      4.637 ppm2      2.550 CV     1
 ASSI { 3078}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.200     1.300     1.300 peak  3078 spectrum    1 weight  0.11000E+01 volume  0.16632E-02 ppm1      4.643 ppm2      2.847 CV     1
 ASSI { 3079}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB2 ))
      2.500     0.800     0.800 peak  3079 spectrum    1 weight  0.11000E+01 volume  0.57968E-02 ppm1      4.663 ppm2      3.122 CV     1
 ASSI { 3083}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 122  and name HD1%)
      4.500     2.600     1.500 peak  3083 spectrum    1 weight  0.11000E+01 volume  0.54157E-03 ppm1      4.289 ppm2      0.782 CV     1
 ASSI { 3087}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HN  ))
      3.200     3.200     2.800 peak  3087 spectrum    1 weight  0.11000E+01 volume  0.14679E-02 ppm1      4.669 ppm2      8.435 CV     1
 ASSI { 3090}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      3.900     1.900     1.900 peak  3090 spectrum    1 weight  0.11000E+01 volume  0.54499E-03 ppm1      4.618 ppm2      7.307 CV     1
 ASSI { 3094}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      3.700     1.700     1.700 peak  3094 spectrum    1 weight  0.11000E+01 volume  0.58160E-03 ppm1      4.086 ppm2      8.744 CV     1
 ASSI { 3096}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
      6.000     4.700     0.000 peak  3096 spectrum    1 weight  0.11000E+01 volume  0.10085E-03 ppm1      4.087 ppm2      7.629 CV     1
 ASSI { 3097}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      3.800     1.800     1.800 peak  3097 spectrum    1 weight  0.11000E+01 volume  0.82254E-03 ppm1      4.086 ppm2      7.437 CV     1
 ASSI { 3098}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      3.900     1.900     1.900 peak  3098 spectrum    1 weight  0.11000E+01 volume  0.39749E-03 ppm1      4.087 ppm2      7.225 CV     1
 ASSI { 3099}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      4.300     2.400     1.700 peak  3099 spectrum    1 weight  0.11000E+01 volume  0.29478E-03 ppm1      3.926 ppm2      7.490 CV     1
 ASSI { 3103}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      4.300     2.300     1.700 peak  3103 spectrum    1 weight  0.11000E+01 volume  0.30856E-03 ppm1      3.926 ppm2      8.750 CV     1
 ASSI { 3104}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      4.300     2.300     1.700 peak  3104 spectrum    1 weight  0.11000E+01 volume  0.45883E-03 ppm1      3.925 ppm2      8.900 CV     1
 ASSI { 3105}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 110  and name HN  ))
      4.700     2.700     1.300 peak  3105 spectrum    1 weight  0.11000E+01 volume  0.12714E-03 ppm1      3.767 ppm2      7.179 CV     1
 ASSI { 3109}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
      4.000     2.000     2.000 peak  3109 spectrum    1 weight  0.11000E+01 volume  0.29293E-03 ppm1      3.766 ppm2      8.402 CV     1
 ASSI { 3110}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 108  and name HN  ))
      4.600     2.600     1.400 peak  3110 spectrum    1 weight  0.11000E+01 volume  0.82543E-03 ppm1      3.636 ppm2      8.528 CV     1
 ASSI { 3114}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HD1 ))
      3.100     1.200     1.200 peak  3114 spectrum    1 weight  0.11000E+01 volume  0.23863E-02 ppm1      5.214 ppm2      7.484 CV     1
 ASSI { 3116}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HE3 ))
      5.700     4.000     0.300 peak  3116 spectrum    1 weight  0.11000E+01 volume  0.20777E-03 ppm1      5.210 ppm2      7.690 CV     1
 ASSI { 3117}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      3.300     1.400     1.400 peak  3117 spectrum    1 weight  0.11000E+01 volume  0.49368E-03 ppm1      5.211 ppm2      9.158 CV     1
 ASSI { 3118}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      4.200     2.200     1.800 peak  3118 spectrum    1 weight  0.11000E+01 volume  0.95161E-03 ppm1      5.211 ppm2      9.306 CV     1
 ASSI { 3120}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
      2.900     1.000     1.000 peak  3120 spectrum    1 weight  0.11000E+01 volume  0.13872E-02 ppm1      4.579 ppm2      3.076 CV     1
 ASSI { 3126}
   (( segid "    " and resid 75   and name HA  ))
   (  segid "    " and resid 60   and name HD1%)
      6.000     6.000     0.000 peak  3126 spectrum    1 weight  0.11000E+01 volume  0.12275E-04 ppm1      4.373 ppm2      0.457 CV     1
 ASSI { 3127}
   (( segid "    " and resid 75   and name HA  ))
   (  segid "    " and resid 56   and name HG2%)
      4.500     4.500     1.500 peak  3127 spectrum    1 weight  0.11000E+01 volume  0.45392E-03 ppm1      4.374 ppm2      1.079 CV     1
 ASSI { 3128}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 78   and name HG1 ))
      4.500     2.500     1.500 peak  3128 spectrum    1 weight  0.11000E+01 volume  0.25722E-03 ppm1      4.376 ppm2      1.422 CV     1
 ASSI { 3129}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 78   and name HD1 ))
      3.700     1.700     1.700 peak  3129 spectrum    1 weight  0.11000E+01 volume  0.30127E-02 ppm1      4.377 ppm2      1.753 CV     1
 ASSI { 3131}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.600     0.800     0.800 peak  3131 spectrum    1 weight  0.11000E+01 volume  0.36670E-02 ppm1      4.375 ppm2      2.193 CV     1
 ASSI { 3132}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HG1 ))
      3.700     1.700     1.700 peak  3132 spectrum    1 weight  0.11000E+01 volume  0.13610E-02 ppm1      4.379 ppm2      2.377 CV     1
 ASSI { 3133}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 76   and name HG1 ))
      4.000     2.000     2.000 peak  3133 spectrum    1 weight  0.11000E+01 volume  0.19629E-02 ppm1      4.372 ppm2      2.920 CV     1
 ASSI { 3135}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HG1 ))
      3.700     1.700     1.700 peak  3135 spectrum    1 weight  0.11000E+01 volume  0.83767E-03 ppm1      4.540 ppm2      1.289 CV     1
 ASSI { 3136}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HD1 ))
      3.500     1.500     1.500 peak  3136 spectrum    1 weight  0.11000E+01 volume  0.42774E-02 ppm1      4.538 ppm2      1.708 CV     1
 ASSI { 3137}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
      2.300     0.700     0.700 peak  3137 spectrum    1 weight  0.11000E+01 volume  0.47969E-02 ppm1      4.537 ppm2      2.019 CV     1
 ASSI { 3139}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
      2.200     0.600     0.600 peak  3139 spectrum    1 weight  0.11000E+01 volume  0.44747E-02 ppm1      4.509 ppm2      2.943 CV     1
 ASSI { 3140}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
      3.200     1.300     1.300 peak  3140 spectrum    1 weight  0.11000E+01 volume  0.11535E-02 ppm1      4.507 ppm2      3.253 CV     1
 ASSI { 3141}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name HB1 ))
      2.200     0.600     0.600 peak  3141 spectrum    1 weight  0.11000E+01 volume  0.23169E-02 ppm1      4.495 ppm2      3.070 CV     1
 ASSI { 3144}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 58   and name HE% )
      5.700     4.100     0.300 peak  3144 spectrum    1 weight  0.11000E+01 volume  0.86426E-04 ppm1      4.500 ppm2      6.891 CV     1
 ASSI { 3145}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      4.400     2.400     1.600 peak  3145 spectrum    1 weight  0.11000E+01 volume  0.43272E-03 ppm1      4.490 ppm2      7.196 CV     1
 ASSI { 3146}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      4.300     2.300     1.700 peak  3146 spectrum    1 weight  0.11000E+01 volume  0.21995E-03 ppm1      4.503 ppm2      7.385 CV     1
 ASSI { 3148}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 119  and name HN  ))
      3.600     1.600     1.600 peak  3148 spectrum    1 weight  0.11000E+01 volume  0.12113E-02 ppm1      4.539 ppm2      7.906 CV     1
 ASSI { 3150}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      3.100     1.200     1.200 peak  3150 spectrum    1 weight  0.11000E+01 volume  0.11182E-02 ppm1      4.372 ppm2      7.226 CV     1
 ASSI { 3153}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 91   and name HN  ))
      4.000     2.000     2.000 peak  3153 spectrum    1 weight  0.11000E+01 volume  0.11732E-02 ppm1      3.972 ppm2      7.488 CV     1
 ASSI { 3155}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      4.400     2.500     1.600 peak  3155 spectrum    1 weight  0.11000E+01 volume  0.97368E-03 ppm1      3.964 ppm2      8.189 CV     1
 ASSI { 3157}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
      2.800     1.000     1.000 peak  3157 spectrum    1 weight  0.11000E+01 volume  0.14594E-02 ppm1      3.816 ppm2      8.224 CV     1
 ASSI { 3158}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
      3.700     1.700     1.700 peak  3158 spectrum    1 weight  0.11000E+01 volume  0.18339E-02 ppm1      3.816 ppm2      8.376 CV     1
 ASSI { 3160}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 106  and name HZ  ))
      6.000     5.200     0.000 peak  3160 spectrum    1 weight  0.11000E+01 volume  0.71915E-04 ppm1      3.767 ppm2      7.290 CV     1
 ASSI { 3161}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
      3.200     1.300     1.300 peak  3161 spectrum    1 weight  0.11000E+01 volume  0.15184E-02 ppm1      3.768 ppm2      7.700 CV     1
 ASSI { 3163}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 114  and name HN  ))
      3.600     1.600     1.600 peak  3163 spectrum    1 weight  0.11000E+01 volume  0.11374E-02 ppm1      3.840 ppm2      7.483 CV     1
 ASSI { 3168}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      3.800     1.800     1.800 peak  3168 spectrum    1 weight  0.11000E+01 volume  0.46790E-03 ppm1      4.257 ppm2      8.439 CV     1
 ASSI { 3173}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 138  and name HN  ))
      4.300     2.300     1.700 peak  3173 spectrum    1 weight  0.11000E+01 volume  0.14332E-02 ppm1      4.076 ppm2      8.326 CV     1
 ASSI { 3174}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 120  and name HD2 ))
      3.600     3.600     2.400 peak  3174 spectrum    1 weight  0.11000E+01 volume  0.78463E-03 ppm1      4.576 ppm2      7.190 CV     1
 ASSI { 3182}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB1 ))
      2.700     0.900     0.900 peak  3182 spectrum    1 weight  0.11000E+01 volume  0.33301E-02 ppm1      2.819 ppm2      1.698 CV     1
 ASSI { 3183}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
      2.800     1.000     1.000 peak  3183 spectrum    1 weight  0.11000E+01 volume  0.22644E-02 ppm1      2.820 ppm2      2.054 CV     1
 ASSI { 3184}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
      2.800     1.000     1.000 peak  3184 spectrum    1 weight  0.11000E+01 volume  0.38049E-02 ppm1      2.812 ppm2      3.164 CV     1
 ASSI { 3186}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 57   and name HZ  ))
      3.500     1.500     1.500 peak  3186 spectrum    1 weight  0.11000E+01 volume  0.10002E-02 ppm1      2.822 ppm2      6.846 CV     1
 ASSI { 3194}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB  ))
      2.800     0.900     0.900 peak  3194 spectrum    1 weight  0.11000E+01 volume  0.16376E-02 ppm1      4.979 ppm2      1.770 CV     1
 ASSI { 3195}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 68   and name HG2%)
      4.500     2.500     1.500 peak  3195 spectrum    1 weight  0.11000E+01 volume  0.82866E-03 ppm1      4.976 ppm2      1.333 CV     1
 ASSI { 3196}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
      5.200     3.300     0.800 peak  3196 spectrum    1 weight  0.11000E+01 volume  0.35957E-03 ppm1      4.977 ppm2      0.441 CV     1
 ASSI { 3197}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      2.500     0.800     0.800 peak  3197 spectrum    1 weight  0.11000E+01 volume  0.25688E-02 ppm1      4.987 ppm2     -0.056 CV     1
 ASSI { 3199}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 128  and name HB1 ))
      2.900     2.900     3.100 peak  3199 spectrum    1 weight  0.11000E+01 volume  0.72884E-03 ppm1      4.624 ppm2      2.052 CV     1
 ASSI { 3200}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 129  and name HB1 ))
      2.800     1.000     1.000 peak  3200 spectrum    1 weight  0.11000E+01 volume  0.23706E-02 ppm1      4.621 ppm2      3.056 CV     1
 ASSI { 3201}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 129  and name HB2 ))
      2.900     1.100     1.100 peak  3201 spectrum    1 weight  0.11000E+01 volume  0.29666E-02 ppm1      4.622 ppm2      3.414 CV     1
 ASSI { 3202}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 129  and name HD2 ))
      6.000     6.000     0.000 peak  3202 spectrum    1 weight  0.11000E+01 volume  0.36443E-04 ppm1      4.617 ppm2      6.909 CV     1
 ASSI { 3204}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HE1 ))
      3.800     3.800     2.200 peak  3204 spectrum    1 weight  0.11000E+01 volume  0.21573E-02 ppm1      4.493 ppm2      2.967 CV     1
 ASSI { 3208}
   (( segid "    " and resid 31   and name HA  ))
   (  segid "    " and resid 31   and name HD% )
      3.800     1.800     1.800 peak  3208 spectrum    1 weight  0.11000E+01 volume  0.10585E-02 ppm1      4.495 ppm2      7.059 CV     1
 ASSI { 3213}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB1 ))
      2.900     1.100     1.100 peak  3213 spectrum    1 weight  0.11000E+01 volume  0.17528E-02 ppm1      4.369 ppm2      1.939 CV     1
 ASSI { 3215}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HG1 ))
      3.300     1.400     1.400 peak  3215 spectrum    1 weight  0.11000E+01 volume  0.26565E-02 ppm1      4.372 ppm2      2.274 CV     1
 ASSI { 3216}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 76   and name HG2 ))
      5.000     3.100     1.000 peak  3216 spectrum    1 weight  0.11000E+01 volume  0.46201E-03 ppm1      4.380 ppm2      2.958 CV     1
 ASSI { 3224}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 119  and name HN  ))
      3.300     1.300     1.300 peak  3224 spectrum    1 weight  0.11000E+01 volume  0.92434E-03 ppm1      4.075 ppm2      7.898 CV     1
 ASSI { 3226}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 111  and name HB1 ))
      3.100     1.200     1.200 peak  3226 spectrum    1 weight  0.11000E+01 volume  0.55679E-03 ppm1      4.050 ppm2      3.027 CV     1
 ASSI { 3227}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 111  and name HB2 ))
      4.300     2.300     1.700 peak  3227 spectrum    1 weight  0.11000E+01 volume  0.33788E-03 ppm1      4.044 ppm2      3.278 CV     1
 ASSI { 3229}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HG11))
      3.800     1.800     1.800 peak  3229 spectrum    1 weight  0.11000E+01 volume  0.70470E-03 ppm1      4.974 ppm2      1.452 CV     1
 ASSI { 3232}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 62   and name HA  ))
      3.300     1.300     1.300 peak  3232 spectrum    1 weight  0.11000E+01 volume  0.41074E-03 ppm1      4.977 ppm2      4.213 CV     1
 ASSI { 3236}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      4.500     2.500     1.500 peak  3236 spectrum    1 weight  0.11000E+01 volume  0.24492E-03 ppm1      4.142 ppm2      8.217 CV     1
 ASSI { 3237}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HE1 ))
      3.200     1.200     1.200 peak  3237 spectrum    1 weight  0.11000E+01 volume  0.24764E-02 ppm1      3.992 ppm2      2.951 CV     1
 ASSI { 3240}
   (( segid "    " and resid 132  and name HA  ))
   (  segid "    " and resid 131  and name HG1%)
      5.400     3.600     0.600 peak  3240 spectrum    1 weight  0.11000E+01 volume  0.85222E-04 ppm1      2.651 ppm2      0.805 CV     1
 ASSI { 3243}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HB1 ))
      2.500     0.800     0.800 peak  3243 spectrum    1 weight  0.11000E+01 volume  0.19532E-02 ppm1      2.652 ppm2      1.407 CV     1
 ASSI { 3244}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 133  and name HD1 ))
      2.300     0.600     0.600 peak  3244 spectrum    1 weight  0.11000E+01 volume  0.57616E-02 ppm1      2.652 ppm2      1.931 CV     1
 ASSI { 3245}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 133  and name HD2 ))
      2.700     0.900     0.900 peak  3245 spectrum    1 weight  0.11000E+01 volume  0.24912E-02 ppm1      2.653 ppm2      2.167 CV     1
 ASSI { 3247}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HB2 ))
      3.100     1.200     1.200 peak  3247 spectrum    1 weight  0.11000E+01 volume  0.21145E-02 ppm1      2.648 ppm2      1.784 CV     1
 ASSI { 3249}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 44   and name HZ2 ))
      3.200     3.200     2.800 peak  3249 spectrum    1 weight  0.11000E+01 volume  0.43205E-03 ppm1      2.652 ppm2      7.257 CV     1
 ASSI { 3253}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HG1 ))
      3.000     1.100     1.100 peak  3253 spectrum    1 weight  0.11000E+01 volume  0.20995E-02 ppm1      3.818 ppm2      1.174 CV     1
 ASSI { 3255}
   (( segid "    " and resid 73   and name HA  ))
   (  segid "    " and resid 77   and name HG2%)
      3.500     3.500     2.500 peak  3255 spectrum    1 weight  0.11000E+01 volume  0.87597E-03 ppm1      3.924 ppm2      1.081 CV     1
 ASSI { 3256}
   (( segid "    " and resid 73   and name HA  ))
   (  segid "    " and resid 86   and name HD1%)
      3.800     3.800     2.200 peak  3256 spectrum    1 weight  0.11000E+01 volume  0.87992E-03 ppm1      3.926 ppm2      0.806 CV     1
 ASSI { 3261}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB1 ))
      3.000     1.200     1.200 peak  3261 spectrum    1 weight  0.11000E+01 volume  0.25658E-02 ppm1      4.080 ppm2      3.013 CV     1
 ASSI { 3262}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB2 ))
      2.700     0.900     0.900 peak  3262 spectrum    1 weight  0.11000E+01 volume  0.19505E-02 ppm1      4.078 ppm2      3.283 CV     1
 ASSI { 3264}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 136  and name HN  ))
      6.000     4.600     0.000 peak  3264 spectrum    1 weight  0.11000E+01 volume  0.40859E-04 ppm1      4.138 ppm2      7.034 CV     1
 ASSI { 3267}
   (( segid "    " and resid 104  and name HA  ))
   (  segid "    " and resid 46   and name HG1%)
      5.000     5.000     1.000 peak  3267 spectrum    1 weight  0.11000E+01 volume  0.30753E-03 ppm1      4.086 ppm2     -0.212 CV     1
 ASSI { 3274}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 68   and name HG2%)
      2.600     0.900     0.900 peak  3274 spectrum    1 weight  0.11000E+01 volume  0.33571E-02 ppm1      4.497 ppm2      1.332 CV     1
 ASSI { 3276}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 100  and name HG  ))
      5.600     3.900     0.400 peak  3276 spectrum    1 weight  0.11000E+01 volume  0.29048E-03 ppm1      4.497 ppm2      1.555 CV     1
 ASSI { 3277}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
      4.500     2.600     1.500 peak  3277 spectrum    1 weight  0.11000E+01 volume  0.31754E-03 ppm1      4.502 ppm2      1.698 CV     1
 ASSI { 3278}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 69   and name HA1 ))
      4.100     2.100     1.900 peak  3278 spectrum    1 weight  0.11000E+01 volume  0.14964E-02 ppm1      4.491 ppm2      3.576 CV     1
 ASSI { 3280}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 100  and name HA  ))
      4.400     2.400     1.600 peak  3280 spectrum    1 weight  0.11000E+01 volume  0.60911E-03 ppm1      4.510 ppm2      5.179 CV     1
 ASSI { 3283}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      4.500     2.500     1.500 peak  3283 spectrum    1 weight  0.11000E+01 volume  0.72705E-03 ppm1      3.929 ppm2      8.897 CV     1
 ASSI { 3284}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HN  ))
      3.100     1.200     1.200 peak  3284 spectrum    1 weight  0.11000E+01 volume  0.82827E-03 ppm1      3.945 ppm2      8.475 CV     1
 ASSI { 3287}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
      4.800     2.900     1.200 peak  3287 spectrum    1 weight  0.11000E+01 volume  0.46349E-03 ppm1      3.808 ppm2      7.660 CV     1
 ASSI { 3289}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 90   and name HE3 ))
      3.200     1.300     1.300 peak  3289 spectrum    1 weight  0.11000E+01 volume  0.18017E-02 ppm1      3.924 ppm2      7.300 CV     1
 ASSI { 3290}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      2.800     1.000     1.000 peak  3290 spectrum    1 weight  0.11000E+01 volume  0.25961E-02 ppm1      3.993 ppm2      7.296 CV     1
 ASSI { 3295}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      2.500     0.800     0.800 peak  3295 spectrum    1 weight  0.11000E+01 volume  0.45091E-02 ppm1      4.136 ppm2      7.369 CV     1
 ASSI { 3301}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      3.800     3.800     2.200 peak  3301 spectrum    1 weight  0.11000E+01 volume  0.11070E-02 ppm1      4.493 ppm2      8.850 CV     1
 ASSI { 3315}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 101  and name HD2%)
      4.600     2.600     1.400 peak  3315 spectrum    1 weight  0.11000E+01 volume  0.26623E-03 ppm1      4.235 ppm2      0.081 CV     1
 ASSI { 3316}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB1 ))
      3.200     1.300     1.300 peak  3316 spectrum    1 weight  0.11000E+01 volume  0.14377E-02 ppm1      4.222 ppm2      2.998 CV     1
 ASSI { 3317}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
      2.500     0.800     0.800 peak  3317 spectrum    1 weight  0.11000E+01 volume  0.23388E-02 ppm1      4.223 ppm2      3.206 CV     1
 ASSI { 3322}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      3.700     1.700     1.700 peak  3322 spectrum    1 weight  0.11000E+01 volume  0.72561E-03 ppm1      4.124 ppm2      8.034 CV     1
 ASSI { 3323}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 53   and name HD% )
      2.400     0.700     0.700 peak  3323 spectrum    1 weight  0.11000E+01 volume  0.21615E-02 ppm1      4.039 ppm2      6.753 CV     1
 ASSI { 3324}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      4.700     2.800     1.300 peak  3324 spectrum    1 weight  0.11000E+01 volume  0.90960E-04 ppm1      4.026 ppm2      7.165 CV     1
 ASSI { 3326}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
      3.500     1.500     1.500 peak  3326 spectrum    1 weight  0.11000E+01 volume  0.11546E-02 ppm1      4.060 ppm2      7.639 CV     1
 ASSI { 3330}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 91   and name HN  ))
      3.200     1.300     1.300 peak  3330 spectrum    1 weight  0.11000E+01 volume  0.18016E-02 ppm1      3.819 ppm2      7.472 CV     1
 ASSI { 3331}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 118  and name HN  ))
      4.400     2.400     1.600 peak  3331 spectrum    1 weight  0.11000E+01 volume  0.51203E-03 ppm1      3.805 ppm2      7.751 CV     1
 ASSI { 3333}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 89   and name HN  ))
      5.400     3.700     0.600 peak  3333 spectrum    1 weight  0.11000E+01 volume  0.26040E-03 ppm1      3.812 ppm2      8.195 CV     1
 ASSI { 3339}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
      2.300     0.700     0.700 peak  3339 spectrum    1 weight  0.11000E+01 volume  0.72084E-02 ppm1      4.550 ppm2      2.287 CV     1
 ASSI { 3340}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HG1 ))
      4.500     2.500     1.500 peak  3340 spectrum    1 weight  0.11000E+01 volume  0.10219E-02 ppm1      4.549 ppm2      1.847 CV     1
 ASSI { 3342}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HG2 ))
      4.100     4.100     1.900 peak  3342 spectrum    1 weight  0.11000E+01 volume  0.11457E-02 ppm1      4.501 ppm2      1.914 CV     1
 ASSI { 3343}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 88   and name HD2 ))
      2.900     2.900     3.100 peak  3343 spectrum    1 weight  0.11000E+01 volume  0.27972E-02 ppm1      4.507 ppm2      2.112 CV     1
 ASSI { 3344}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 125  and name HB2 ))
      3.900     3.900     2.100 peak  3344 spectrum    1 weight  0.11000E+01 volume  0.25297E-02 ppm1      4.509 ppm2      2.530 CV     1
 ASSI { 3349}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 122  and name HN  ))
      3.100     3.100     2.900 peak  3349 spectrum    1 weight  0.11000E+01 volume  0.22648E-02 ppm1      4.545 ppm2      8.561 CV     1
 ASSI { 3350}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
      5.500     3.700     0.500 peak  3350 spectrum    1 weight  0.11000E+01 volume  0.11740E-03 ppm1      4.212 ppm2      7.602 CV     1
 ASSI { 3351}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      3.600     1.700     1.700 peak  3351 spectrum    1 weight  0.11000E+01 volume  0.11832E-02 ppm1      4.169 ppm2      8.827 CV     1
 ASSI { 3352}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 108  and name HN  ))
      3.600     1.700     1.700 peak  3352 spectrum    1 weight  0.11000E+01 volume  0.81575E-03 ppm1      4.168 ppm2      8.458 CV     1
 ASSI { 3354}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 61   and name HN  ))
      4.100     2.100     1.900 peak  3354 spectrum    1 weight  0.11000E+01 volume  0.69935E-03 ppm1      3.904 ppm2      7.934 CV     1
 ASSI { 3357}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HN  ))
      3.400     1.500     1.500 peak  3357 spectrum    1 weight  0.11000E+01 volume  0.60415E-03 ppm1      3.713 ppm2      7.122 CV     1
 ASSI { 3358}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 44   and name HH2 ))
      4.200     2.200     1.800 peak  3358 spectrum    1 weight  0.11000E+01 volume  0.60608E-03 ppm1      3.709 ppm2      7.282 CV     1
 ASSI { 3359}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 130  and name HN  ))
      5.600     4.000     0.400 peak  3359 spectrum    1 weight  0.11000E+01 volume  0.14592E-03 ppm1      3.726 ppm2      7.787 CV     1
 ASSI { 3361}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      3.800     1.800     1.800 peak  3361 spectrum    1 weight  0.11000E+01 volume  0.89515E-03 ppm1      3.981 ppm2      7.973 CV     1
 ASSI { 3362}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      3.500     1.500     1.500 peak  3362 spectrum    1 weight  0.11000E+01 volume  0.55795E-03 ppm1      3.976 ppm2      8.160 CV     1
 ASSI { 3365}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 120  and name HE1 ))
      6.000     4.800     0.000 peak  3365 spectrum    1 weight  0.11000E+01 volume  0.88633E-04 ppm1      4.545 ppm2      8.791 CV     1
 ASSI { 3367}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HB  ))
      3.200     1.300     1.300 peak  3367 spectrum    1 weight  0.11000E+01 volume  0.94756E-03 ppm1      3.020 ppm2     -1.227 CV     1
 ASSI { 3371}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 46   and name HG2%)
      2.400     0.700     0.700 peak  3371 spectrum    1 weight  0.11000E+01 volume  0.53068E-02 ppm1      3.021 ppm2      0.501 CV     1
 ASSI { 3372}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 45   and name HG1%)
      4.700     2.700     1.300 peak  3372 spectrum    1 weight  0.11000E+01 volume  0.19672E-03 ppm1      3.020 ppm2      0.803 CV     1
 ASSI { 3373}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 48   and name HG2 ))
      4.300     2.300     1.700 peak  3373 spectrum    1 weight  0.11000E+01 volume  0.12943E-03 ppm1      3.013 ppm2      1.363 CV     1
 ASSI { 3374}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 48   and name HB2 ))
      5.400     3.700     0.600 peak  3374 spectrum    1 weight  0.11000E+01 volume  0.38598E-03 ppm1      3.019 ppm2      1.785 CV     1
 ASSI { 3375}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 45   and name HB  ))
      6.000     4.700     0.000 peak  3375 spectrum    1 weight  0.11000E+01 volume  0.46452E-04 ppm1      3.018 ppm2      2.074 CV     1
 ASSI { 3376}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 49   and name HB1 ))
      6.000     5.400     0.000 peak  3376 spectrum    1 weight  0.11000E+01 volume  0.52312E-04 ppm1      3.019 ppm2      2.289 CV     1
 ASSI { 3378}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      3.800     1.800     1.800 peak  3378 spectrum    1 weight  0.11000E+01 volume  0.87607E-03 ppm1      3.022 ppm2      7.439 CV     1
 ASSI { 3379}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 53   and name HD% )
      6.000     6.000     0.000 peak  3379 spectrum    1 weight  0.11000E+01 volume  0.94491E-05 ppm1      3.019 ppm2      6.754 CV     1
 ASSI { 3380}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 130  and name HB1 ))
      3.200     1.300     1.300 peak  3380 spectrum    1 weight  0.11000E+01 volume  0.64028E-03 ppm1      3.714 ppm2      1.485 CV     1
 ASSI { 3381}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 132  and name HG1 ))
      4.700     2.800     1.300 peak  3381 spectrum    1 weight  0.11000E+01 volume  0.91644E-03 ppm1      3.714 ppm2      1.746 CV     1
 ASSI { 3383}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 132  and name HD1 ))
      2.800     1.000     1.000 peak  3383 spectrum    1 weight  0.11000E+01 volume  0.13126E-02 ppm1      3.713 ppm2      3.242 CV     1
 ASSI { 3384}
   (( segid "    " and resid 90   and name HA  ))
   (  segid "    " and resid 93   and name HB% )
      2.900     1.100     1.100 peak  3384 spectrum    1 weight  0.11000E+01 volume  0.16774E-02 ppm1      3.828 ppm2      1.147 CV     1
 ASSI { 3386}
   (( segid "    " and resid 90   and name HA  ))
   (  segid "    " and resid 101  and name HD2%)
      4.400     2.400     1.600 peak  3386 spectrum    1 weight  0.11000E+01 volume  0.27550E-03 ppm1      3.825 ppm2      0.067 CV     1
 ASSI { 3391}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 50   and name HE1 ))
      4.900     3.000     1.100 peak  3391 spectrum    1 weight  0.11000E+01 volume  0.23476E-03 ppm1      4.047 ppm2      2.801 CV     1
 ASSI { 3392}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 108  and name HD1%)
      3.900     3.900     2.100 peak  3392 spectrum    1 weight  0.11000E+01 volume  0.73288E-03 ppm1      4.007 ppm2      1.239 CV     1
 ASSI { 3394}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HB1 ))
      2.200     0.600     0.600 peak  3394 spectrum    1 weight  0.11000E+01 volume  0.45680E-02 ppm1      3.980 ppm2      2.169 CV     1
 ASSI { 3395}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 110  and name HB1 ))
      4.100     2.200     1.900 peak  3395 spectrum    1 weight  0.11000E+01 volume  0.27709E-03 ppm1      4.083 ppm2      1.184 CV     1
 ASSI { 3398}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 60   and name HB2 ))
      6.000     4.600     0.000 peak  3398 spectrum    1 weight  0.11000E+01 volume  0.10583E-03 ppm1      3.970 ppm2      1.492 CV     1
 ASSI { 3401}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 62   and name HD1 ))
      4.400     2.500     1.600 peak  3401 spectrum    1 weight  0.11000E+01 volume  0.10386E-02 ppm1      3.977 ppm2      3.097 CV     1
 ASSI { 3403}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
      2.800     1.000     1.000 peak  3403 spectrum    1 weight  0.11000E+01 volume  0.29794E-02 ppm1      3.980 ppm2      3.394 CV     1
 ASSI { 3411}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      3.500     1.500     1.500 peak  3411 spectrum    1 weight  0.11000E+01 volume  0.70523E-03 ppm1      4.623 ppm2      8.159 CV     1
 ASSI { 3412}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      4.300     2.300     1.700 peak  3412 spectrum    1 weight  0.11000E+01 volume  0.26590E-03 ppm1      4.628 ppm2      7.964 CV     1
 ASSI { 3413}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 59   and name HG2%)
      2.700     0.900     0.900 peak  3413 spectrum    1 weight  0.11000E+01 volume  0.52586E-02 ppm1      4.622 ppm2      1.443 CV     1
 ASSI { 3414}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
      5.000     3.100     1.000 peak  3414 spectrum    1 weight  0.11000E+01 volume  0.27579E-03 ppm1      4.628 ppm2      3.965 CV     1
 ASSI { 3417}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HG1 ))
      4.500     2.600     1.500 peak  3417 spectrum    1 weight  0.11000E+01 volume  0.81339E-03 ppm1      4.502 ppm2      2.125 CV     1
 ASSI { 3418}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.100     1.200     1.200 peak  3418 spectrum    1 weight  0.11000E+01 volume  0.20781E-02 ppm1      4.495 ppm2      2.546 CV     1
 ASSI { 3421}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
      3.100     3.100     2.900 peak  3421 spectrum    1 weight  0.11000E+01 volume  0.30440E-02 ppm1      4.192 ppm2      0.967 CV     1
 ASSI { 3423}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 23   and name HB1 ))
      4.600     2.600     1.400 peak  3423 spectrum    1 weight  0.11000E+01 volume  0.11868E-02 ppm1      4.297 ppm2      2.016 CV     1
 ASSI { 3428}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
      2.200     2.200     3.800 peak  3428 spectrum    1 weight  0.11000E+01 volume  0.16175E-01 ppm1      4.188 ppm2      3.942 CV     1
 ASSI { 3439}
   (( segid "    " and resid 134  and name HB1 ))
   (( segid "    " and resid 134  and name HN  ))
      3.400     1.400     1.400 peak  3439 spectrum    1 weight  0.11000E+01 volume  0.12485E-02 ppm1      3.884 ppm2      9.258 CV     1
 ASSI { 3442}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 56   and name HD1%)
      5.500     5.500     0.500 peak  3442 spectrum    1 weight  0.11000E+01 volume  0.43169E-03 ppm1      3.072 ppm2      1.101 CV     1
 ASSI { 3443}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 60   and name HB1 ))
      5.600     3.900     0.400 peak  3443 spectrum    1 weight  0.11000E+01 volume  0.18890E-03 ppm1      3.077 ppm2      1.293 CV     1
 ASSI { 3444}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 60   and name HG  ))
      3.500     1.500     1.500 peak  3444 spectrum    1 weight  0.11000E+01 volume  0.85183E-03 ppm1      3.069 ppm2      1.587 CV     1
 ASSI { 3446}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 59   and name HB  ))
      5.400     3.700     0.600 peak  3446 spectrum    1 weight  0.11000E+01 volume  0.93403E-04 ppm1      3.071 ppm2      4.484 CV     1
 ASSI { 3447}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 106  and name HE% )
      2.800     1.000     1.000 peak  3447 spectrum    1 weight  0.11000E+01 volume  0.88194E-03 ppm1      3.069 ppm2      5.920 CV     1
 ASSI { 3448}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 57   and name HE% )
      4.500     2.600     1.500 peak  3448 spectrum    1 weight  0.11000E+01 volume  0.40650E-03 ppm1      3.066 ppm2      7.283 CV     1
 ASSI { 3451}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      4.100     2.100     1.900 peak  3451 spectrum    1 weight  0.11000E+01 volume  0.61441E-03 ppm1      3.073 ppm2      7.963 CV     1
 ASSI { 3455}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HD1 ))
      5.200     3.400     0.800 peak  3455 spectrum    1 weight  0.11000E+01 volume  0.80775E-04 ppm1      4.171 ppm2      3.104 CV     1
 ASSI { 3460}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 106  and name HE% )
      3.900     1.900     1.900 peak  3460 spectrum    1 weight  0.11000E+01 volume  0.11915E-02 ppm1      3.919 ppm2      6.000 CV     1
 ASSI { 3462}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      3.900     1.900     1.900 peak  3462 spectrum    1 weight  0.11000E+01 volume  0.14672E-02 ppm1      3.919 ppm2      7.331 CV     1
 ASSI { 3477}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      4.000     2.000     2.000 peak  3477 spectrum    1 weight  0.11000E+01 volume  0.26140E-03 ppm1      3.872 ppm2      9.145 CV     1
 ASSI { 3478}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      4.000     2.000     2.000 peak  3478 spectrum    1 weight  0.11000E+01 volume  0.39996E-03 ppm1      3.865 ppm2      9.308 CV     1
 ASSI { 3479}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 46   and name HG1%)
      4.400     4.400     1.600 peak  3479 spectrum    1 weight  0.11000E+01 volume  0.75268E-03 ppm1      3.862 ppm2     -0.206 CV     1
 ASSI { 3481}
   (( segid "    " and resid 77   and name HA  ))
   (  segid "    " and resid 86   and name HD1%)
      2.500     2.500     3.500 peak  3481 spectrum    1 weight  0.11000E+01 volume  0.54388E-02 ppm1      3.974 ppm2      0.801 CV     1
 ASSI { 3483}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 76   and name HB1 ))
      4.300     2.300     1.700 peak  3483 spectrum    1 weight  0.11000E+01 volume  0.10559E-02 ppm1      3.972 ppm2      2.121 CV     1
 ASSI { 3484}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 85   and name HB  ))
      6.000     4.700     0.000 peak  3484 spectrum    1 weight  0.11000E+01 volume  0.99878E-04 ppm1      4.030 ppm2      2.125 CV     1
 ASSI { 3485}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      3.800     1.800     1.800 peak  3485 spectrum    1 weight  0.11000E+01 volume  0.53988E-03 ppm1      3.985 ppm2      7.528 CV     1
 ASSI { 3486}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 83   and name HD21))
      5.500     3.800     0.500 peak  3486 spectrum    1 weight  0.11000E+01 volume  0.10553E-03 ppm1      3.981 ppm2      7.724 CV     1
 ASSI { 3487}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 76   and name HN  ))
      4.200     2.200     1.800 peak  3487 spectrum    1 weight  0.11000E+01 volume  0.10468E-02 ppm1      3.981 ppm2      8.447 CV     1
 ASSI { 3488}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HN  ))
      3.000     1.100     1.100 peak  3488 spectrum    1 weight  0.11000E+01 volume  0.15296E-02 ppm1      3.982 ppm2      8.619 CV     1
 ASSI { 3491}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      4.300     2.300     1.700 peak  3491 spectrum    1 weight  0.11000E+01 volume  0.24306E-03 ppm1      4.031 ppm2      7.008 CV     1
 ASSI { 3492}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 85   and name HN  ))
      5.100     3.200     0.900 peak  3492 spectrum    1 weight  0.11000E+01 volume  0.84042E-04 ppm1      4.028 ppm2      6.870 CV     1
 ASSI { 3493}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 87   and name HN  ))
      4.200     2.200     1.800 peak  3493 spectrum    1 weight  0.11000E+01 volume  0.27721E-03 ppm1      4.021 ppm2      8.585 CV     1
 ASSI { 3501}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      3.100     1.200     1.200 peak  3501 spectrum    1 weight  0.11000E+01 volume  0.14876E-02 ppm1      3.718 ppm2      8.021 CV     1
 ASSI { 3502}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 89   and name HN  ))
      3.100     1.200     1.200 peak  3502 spectrum    1 weight  0.11000E+01 volume  0.15999E-02 ppm1      3.712 ppm2      8.188 CV     1
 ASSI { 3504}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      4.900     3.000     1.100 peak  3504 spectrum    1 weight  0.11000E+01 volume  0.39146E-03 ppm1      3.677 ppm2      7.012 CV     1
 ASSI { 3505}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 114  and name HN  ))
      4.900     4.900     1.100 peak  3505 spectrum    1 weight  0.11000E+01 volume  0.37847E-03 ppm1      3.672 ppm2      7.461 CV     1
 ASSI { 3512}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      2.300     0.700     0.700 peak  3512 spectrum    1 weight  0.11000E+01 volume  0.12880E-01 ppm1      3.485 ppm2      0.906 CV     1
 ASSI { 3513}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 135  and name HG2 ))
      4.900     3.000     1.100 peak  3513 spectrum    1 weight  0.11000E+01 volume  0.37084E-03 ppm1      3.480 ppm2      1.381 CV     1
 ASSI { 3514}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      2.600     0.800     0.800 peak  3514 spectrum    1 weight  0.11000E+01 volume  0.47982E-02 ppm1      3.483 ppm2      1.794 CV     1
 ASSI { 3515}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 135  and name HB2 ))
      3.300     3.300     2.700 peak  3515 spectrum    1 weight  0.11000E+01 volume  0.39254E-02 ppm1      3.483 ppm2      1.987 CV     1
 ASSI { 3516}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 96   and name HB1 ))
      6.000     4.700     0.000 peak  3516 spectrum    1 weight  0.11000E+01 volume  0.14327E-03 ppm1      3.484 ppm2      2.277 CV     1
 ASSI { 3519}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 136  and name HG1 ))
      3.200     1.300     1.300 peak  3519 spectrum    1 weight  0.11000E+01 volume  0.24332E-02 ppm1      3.601 ppm2      1.473 CV     1
 ASSI { 3523}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 136  and name HD1 ))
      3.400     1.400     1.400 peak  3523 spectrum    1 weight  0.11000E+01 volume  0.12125E-02 ppm1      3.599 ppm2      2.965 CV     1
 ASSI { 3524}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 81   and name HG  ))
      3.000     1.100     1.100 peak  3524 spectrum    1 weight  0.11000E+01 volume  0.10126E-02 ppm1      3.830 ppm2      1.551 CV     1
 ASSI { 3525}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 80   and name HB1 ))
      4.000     2.000     2.000 peak  3525 spectrum    1 weight  0.11000E+01 volume  0.13323E-02 ppm1      3.827 ppm2      2.169 CV     1
 ASSI { 3526}
   (( segid "    " and resid 79   and name HB1 ))
   (  segid "    " and resid 86   and name HD2%)
      3.400     3.400     2.600 peak  3526 spectrum    1 weight  0.11000E+01 volume  0.17600E-02 ppm1      3.829 ppm2      0.700 CV     1
 ASSI { 3528}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HN  ))
      3.100     1.200     1.200 peak  3528 spectrum    1 weight  0.11000E+01 volume  0.96708E-03 ppm1      4.184 ppm2      7.497 CV     1
 ASSI { 3529}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
      3.700     1.700     1.700 peak  3529 spectrum    1 weight  0.11000E+01 volume  0.19431E-02 ppm1      3.955 ppm2      2.200 CV     1
 ASSI { 3530}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
      3.100     1.200     1.200 peak  3530 spectrum    1 weight  0.11000E+01 volume  0.11299E-02 ppm1      3.960 ppm2      2.386 CV     1
 ASSI { 3531}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 55   and name HG2 ))
      2.600     0.900     0.900 peak  3531 spectrum    1 weight  0.11000E+01 volume  0.83035E-03 ppm1      3.947 ppm2      2.576 CV     1
 ASSI { 3538}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HB  ))
      2.700     0.900     0.900 peak  3538 spectrum    1 weight  0.11000E+01 volume  0.36063E-02 ppm1      3.293 ppm2      1.899 CV     1
 ASSI { 3540}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 116  and name HN  ))
      3.400     1.500     1.500 peak  3540 spectrum    1 weight  0.11000E+01 volume  0.71038E-03 ppm1      3.296 ppm2      7.859 CV     1
 ASSI { 3541}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
      3.600     1.600     1.600 peak  3541 spectrum    1 weight  0.11000E+01 volume  0.18250E-02 ppm1      3.295 ppm2      2.074 CV     1
 ASSI { 3545}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
      3.100     1.200     1.200 peak  3545 spectrum    1 weight  0.11000E+01 volume  0.26000E-02 ppm1      4.417 ppm2      2.391 CV     1
 ASSI { 3546}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 54   and name HB1 ))
      2.900     1.000     1.000 peak  3546 spectrum    1 weight  0.11000E+01 volume  0.12471E-02 ppm1      4.416 ppm2      2.795 CV     1
 ASSI { 3549}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB1 ))
      2.500     0.800     0.800 peak  3549 spectrum    1 weight  0.11000E+01 volume  0.33469E-02 ppm1      4.416 ppm2      1.824 CV     1
 ASSI { 3550}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HG1 ))
      3.300     1.400     1.400 peak  3550 spectrum    1 weight  0.11000E+01 volume  0.25454E-02 ppm1      4.416 ppm2      2.007 CV     1
 ASSI { 3552}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
      3.600     1.700     1.700 peak  3552 spectrum    1 weight  0.11000E+01 volume  0.24868E-02 ppm1      4.414 ppm2      2.892 CV     1
 ASSI { 3553}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HD1 ))
      3.900     1.900     1.900 peak  3553 spectrum    1 weight  0.11000E+01 volume  0.44326E-03 ppm1      4.417 ppm2      3.401 CV     1
 ASSI { 3554}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      4.500     2.500     1.500 peak  3554 spectrum    1 weight  0.11000E+01 volume  0.44421E-03 ppm1      4.412 ppm2      7.206 CV     1
 ASSI { 3555}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      3.800     1.800     1.800 peak  3555 spectrum    1 weight  0.11000E+01 volume  0.52196E-03 ppm1      4.411 ppm2      7.376 CV     1
 ASSI { 3557}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      4.000     2.000     2.000 peak  3557 spectrum    1 weight  0.11000E+01 volume  0.54104E-03 ppm1      4.414 ppm2      9.669 CV     1
 ASSI { 3559}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 91   and name HN  ))
      4.600     2.700     1.400 peak  3559 spectrum    1 weight  0.11000E+01 volume  0.28945E-03 ppm1      3.470 ppm2      7.490 CV     1
 ASSI { 3561}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 93   and name HN  ))
      4.000     2.000     2.000 peak  3561 spectrum    1 weight  0.11000E+01 volume  0.54489E-03 ppm1      3.468 ppm2      8.062 CV     1
 ASSI { 3563}
   (( segid "    " and resid 113  and name HA  ))
   (  segid "    " and resid 113  and name HG2%)
      2.500     0.800     0.800 peak  3563 spectrum    1 weight  0.11000E+01 volume  0.49570E-02 ppm1      3.295 ppm2      0.864 CV     1
 ASSI { 3564}
   (( segid "    " and resid 113  and name HA  ))
   (  segid "    " and resid 113  and name HD1%)
      3.400     1.500     1.500 peak  3564 spectrum    1 weight  0.11000E+01 volume  0.47674E-02 ppm1      3.293 ppm2      0.728 CV     1
 ASSI { 3567}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 112  and name HB1 ))
      3.500     1.500     1.500 peak  3567 spectrum    1 weight  0.11000E+01 volume  0.87544E-03 ppm1      3.471 ppm2      1.146 CV     1
 ASSI { 3568}
   (( segid "    " and resid 84   and name HB  ))
   (  segid "    " and resid 85   and name HG2%)
      3.600     1.600     1.600 peak  3568 spectrum    1 weight  0.11000E+01 volume  0.14757E-02 ppm1      4.150 ppm2      1.084 CV     1
 ASSI { 3569}
   (( segid "    " and resid 84   and name HB  ))
   (( segid "    " and resid 83   and name HB2 ))
      3.900     3.900     2.100 peak  3569 spectrum    1 weight  0.11000E+01 volume  0.14421E-03 ppm1      4.157 ppm2      2.902 CV     1
 ASSI { 3570}
   (( segid "    " and resid 84   and name HB  ))
   (( segid "    " and resid 85   and name HN  ))
      3.500     1.500     1.500 peak  3570 spectrum    1 weight  0.11000E+01 volume  0.45604E-03 ppm1      4.151 ppm2      6.839 CV     1
 ASSI { 3572}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 49   and name HB2 ))
      5.700     4.000     0.300 peak  3572 spectrum    1 weight  0.11000E+01 volume  0.16011E-03 ppm1      3.899 ppm2      2.338 CV     1
 ASSI { 3573}
   (( segid "    " and resid 52   and name HB  ))
   (  segid "    " and resid 53   and name HD% )
      6.000     4.600     0.000 peak  3573 spectrum    1 weight  0.11000E+01 volume  0.31615E-04 ppm1      3.912 ppm2      6.750 CV     1
 ASSI { 3574}
   (( segid "    " and resid 52   and name HB  ))
   (  segid "    " and resid 53   and name HE% )
      3.900     1.900     1.900 peak  3574 spectrum    1 weight  0.11000E+01 volume  0.46125E-03 ppm1      3.909 ppm2      6.961 CV     1
 ASSI { 3575}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 53   and name HN  ))
      2.900     1.000     1.000 peak  3575 spectrum    1 weight  0.11000E+01 volume  0.16698E-02 ppm1      3.898 ppm2      7.187 CV     1
 ASSI { 3576}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 52   and name HN  ))
      3.000     1.100     1.100 peak  3576 spectrum    1 weight  0.11000E+01 volume  0.13273E-02 ppm1      3.910 ppm2      7.361 CV     1
 ASSI { 3577}
   (( segid "    " and resid 59   and name HB  ))
   (  segid "    " and resid 106  and name HE% )
      5.000     3.100     1.000 peak  3577 spectrum    1 weight  0.11000E+01 volume  0.33861E-03 ppm1      4.491 ppm2      5.994 CV     1
 ASSI { 3578}
   (( segid "    " and resid 59   and name HB  ))
   (( segid "    " and resid 106  and name HZ  ))
      6.000     6.000     0.000 peak  3578 spectrum    1 weight  0.11000E+01 volume  0.75302E-04 ppm1      4.485 ppm2      7.284 CV     1
 ASSI { 3580}
   (( segid "    " and resid 59   and name HB  ))
   (  segid "    " and resid 59   and name HG2%)
      2.200     0.600     0.600 peak  3580 spectrum    1 weight  0.11000E+01 volume  0.84735E-02 ppm1      4.492 ppm2      1.443 CV     1
 ASSI { 3581}
   (( segid "    " and resid 59   and name HB  ))
   (  segid "    " and resid 56   and name HG2%)
      4.000     2.000     2.000 peak  3581 spectrum    1 weight  0.11000E+01 volume  0.61663E-03 ppm1      4.486 ppm2      1.090 CV     1
 ASSI { 3582}
   (( segid "    " and resid 59   and name HB  ))
   (  segid "    " and resid 60   and name HD2%)
      4.900     3.000     1.100 peak  3582 spectrum    1 weight  0.11000E+01 volume  0.24112E-03 ppm1      4.486 ppm2      0.699 CV     1
 ASSI { 3583}
   (( segid "    " and resid 59   and name HB  ))
   (( segid "    " and resid 58   and name HB1 ))
      6.000     4.700     0.000 peak  3583 spectrum    1 weight  0.11000E+01 volume  0.15949E-03 ppm1      4.481 ppm2      2.912 CV     1
 ASSI { 3585}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 106  and name HZ  ))
      4.200     2.200     1.800 peak  3585 spectrum    1 weight  0.11000E+01 volume  0.70667E-03 ppm1      1.377 ppm2      7.333 CV     1
 ASSI { 3587}
   (( segid "    " and resid 110  and name HB1 ))
   (( segid "    " and resid 110  and name HN  ))
      3.500     1.600     1.600 peak  3587 spectrum    1 weight  0.11000E+01 volume  0.70108E-03 ppm1      1.242 ppm2      7.161 CV     1
 ASSI { 3588}
   (( segid "    " and resid 110  and name HB1 ))
   (( segid "    " and resid 106  and name HZ  ))
      5.500     3.800     0.500 peak  3588 spectrum    1 weight  0.11000E+01 volume  0.50577E-03 ppm1      1.256 ppm2      7.329 CV     1
 ASSI { 3589}
   (( segid "    " and resid 110  and name HB1 ))
   (  segid "    " and resid 53   and name HD% )
      5.500     3.800     0.500 peak  3589 spectrum    1 weight  0.11000E+01 volume  0.21813E-04 ppm1      1.253 ppm2      6.746 CV     1
 ASSI { 3590}
   (( segid "    " and resid 110  and name HB2 ))
   (  segid "    " and resid 53   and name HD% )
      6.000     5.100     0.000 peak  3590 spectrum    1 weight  0.11000E+01 volume  0.27347E-04 ppm1      1.378 ppm2      6.751 CV     1
 ASSI { 3593}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 110  and name HD21))
      3.900     1.900     1.900 peak  3593 spectrum    1 weight  0.11000E+01 volume  0.25840E-03 ppm1      1.386 ppm2      5.708 CV     1
 ASSI { 3595}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 101  and name HN  ))
      6.000     6.000     0.000 peak  3595 spectrum    1 weight  0.11000E+01 volume  0.17103E-04 ppm1      1.699 ppm2      8.638 CV     1
 ASSI { 3596}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 57   and name HZ  ))
      4.400     2.400     1.600 peak  3596 spectrum    1 weight  0.11000E+01 volume  0.16393E-03 ppm1      1.681 ppm2      6.849 CV     1
 ASSI { 3597}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 57   and name HZ  ))
      3.900     1.900     1.900 peak  3597 spectrum    1 weight  0.11000E+01 volume  0.13326E-03 ppm1      2.034 ppm2      6.864 CV     1
 ASSI { 3600}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 97   and name HN  ))
      2.900     1.100     1.100 peak  3600 spectrum    1 weight  0.11000E+01 volume  0.16115E-02 ppm1      1.198 ppm2      7.499 CV     1
 ASSI { 3601}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 90   and name HE3 ))
      3.600     3.600     2.400 peak  3601 spectrum    1 weight  0.11000E+01 volume  0.15083E-02 ppm1      1.188 ppm2      7.338 CV     1
 ASSI { 3602}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 67   and name HN  ))
      6.000     6.000     0.000 peak  3602 spectrum    1 weight  0.11000E+01 volume  0.93374E-04 ppm1      2.576 ppm2      9.301 CV     1
 ASSI { 3603}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 44   and name HD1 ))
      4.300     2.400     1.700 peak  3603 spectrum    1 weight  0.11000E+01 volume  0.52991E-03 ppm1     -1.232 ppm2      7.435 CV     1
 ASSI { 3604}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 108  and name HA  ))
      5.500     3.800     0.500 peak  3604 spectrum    1 weight  0.11000E+01 volume  0.92728E-04 ppm1     -1.216 ppm2      4.077 CV     1
 ASSI { 3606}
   (( segid "    " and resid 113  and name HG11))
   (( segid "    " and resid 113  and name HA  ))
      3.200     1.300     1.300 peak  3606 spectrum    1 weight  0.11000E+01 volume  0.11456E-02 ppm1      0.756 ppm2      3.300 CV     1
 ASSI { 3607}
   (( segid "    " and resid 113  and name HG11))
   (( segid "    " and resid 110  and name HA  ))
      4.100     2.100     1.900 peak  3607 spectrum    1 weight  0.11000E+01 volume  0.35539E-03 ppm1      0.749 ppm2      3.788 CV     1
 ASSI { 3608}
   (( segid "    " and resid 46   and name HB  ))
   (  segid "    " and resid 107  and name HB% )
      4.400     2.400     1.600 peak  3608 spectrum    1 weight  0.11000E+01 volume  0.42663E-03 ppm1     -1.217 ppm2      1.825 CV     1
 ASSI { 3609}
   (( segid "    " and resid 46   and name HB  ))
   (  segid "    " and resid 45   and name HG1%)
      6.000     6.000     0.000 peak  3609 spectrum    1 weight  0.11000E+01 volume  0.26258E-04 ppm1     -1.224 ppm2      0.812 CV     1
 ASSI { 3612}
   (( segid "    " and resid 46   and name HB  ))
   (  segid "    " and resid 46   and name HG1%)
      2.500     0.800     0.800 peak  3612 spectrum    1 weight  0.11000E+01 volume  0.39122E-02 ppm1     -1.219 ppm2     -0.208 CV     1
 ASSI { 3614}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 57   and name HZ  ))
      4.400     2.400     1.600 peak  3614 spectrum    1 weight  0.11000E+01 volume  0.83449E-03 ppm1     -0.039 ppm2      6.840 CV     1
 ASSI { 3617}
   (( segid "    " and resid 133  and name HD1 ))
   (( segid "    " and resid 135  and name HN  ))
      5.800     4.200     0.200 peak  3617 spectrum    1 weight  0.11000E+01 volume  0.16585E-03 ppm1      1.962 ppm2      7.726 CV     1
 ASSI { 3619}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 81   and name HA  ))
      3.600     1.700     1.700 peak  3619 spectrum    1 weight  0.11000E+01 volume  0.65209E-03 ppm1      3.965 ppm2      4.515 CV     1
 ASSI { 3621}
   (( segid "    " and resid 110  and name HB1 ))
   (( segid "    " and resid 110  and name HA  ))
      3.100     1.200     1.200 peak  3621 spectrum    1 weight  0.11000E+01 volume  0.14524E-02 ppm1      1.251 ppm2      3.779 CV     1
 ASSI { 3622}
   (( segid "    " and resid 110  and name HB1 ))
   (( segid "    " and resid 108  and name HA  ))
      5.000     3.200     1.000 peak  3622 spectrum    1 weight  0.11000E+01 volume  0.24739E-03 ppm1      1.233 ppm2      4.027 CV     1
 ASSI { 3623}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 111  and name HA  ))
      4.200     2.200     1.800 peak  3623 spectrum    1 weight  0.11000E+01 volume  0.11348E-02 ppm1      1.375 ppm2      4.046 CV     1
 ASSI { 3628}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 84   and name HN  ))
      4.000     2.000     2.000 peak  3628 spectrum    1 weight  0.11000E+01 volume  0.11675E-02 ppm1      2.151 ppm2      7.002 CV     1
 ASSI { 3629}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 85   and name HN  ))
      3.000     1.100     1.100 peak  3629 spectrum    1 weight  0.11000E+01 volume  0.87530E-03 ppm1      2.147 ppm2      6.858 CV     1
 ASSI { 3630}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 67   and name HN  ))
      4.900     3.000     1.100 peak  3630 spectrum    1 weight  0.11000E+01 volume  0.39799E-03 ppm1      2.196 ppm2      9.296 CV     1
 ASSI { 3633}
   (  segid "    " and resid 126  and name HD2%)
   (( segid "    " and resid 126  and name HN  ))
      4.400     2.400     1.600 peak  3633 spectrum    1 weight  0.11000E+01 volume  0.44256E-03 ppm1      0.959 ppm2      8.958 CV     1
 ASSI { 3634}
   (  segid "    " and resid 117  and name HD1%)
   (( segid "    " and resid 117  and name HN  ))
      4.500     2.600     1.500 peak  3634 spectrum    1 weight  0.11000E+01 volume  0.85444E-03 ppm1      0.853 ppm2      9.046 CV     1
 ASSI { 3636}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 101  and name HN  ))
      4.500     2.500     1.500 peak  3636 spectrum    1 weight  0.11000E+01 volume  0.35878E-03 ppm1      0.790 ppm2      8.633 CV     1
 ASSI { 3637}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 53   and name HN  ))
      3.100     3.100     2.900 peak  3637 spectrum    1 weight  0.11000E+01 volume  0.59268E-03 ppm1      1.818 ppm2      7.132 CV     1
 ASSI { 3638}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 111  and name HN  ))
      4.200     2.200     1.800 peak  3638 spectrum    1 weight  0.11000E+01 volume  0.60709E-03 ppm1      1.817 ppm2      8.382 CV     1
 ASSI { 3640}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 112  and name HN  ))
      5.500     3.700     0.500 peak  3640 spectrum    1 weight  0.11000E+01 volume  0.25466E-03 ppm1      1.374 ppm2      8.259 CV     1
 ASSI { 3641}
   (( segid "    " and resid 110  and name HB1 ))
   (( segid "    " and resid 112  and name HN  ))
      5.500     5.500     0.500 peak  3641 spectrum    1 weight  0.11000E+01 volume  0.16335E-03 ppm1      1.267 ppm2      8.280 CV     1
 ASSI { 3642}
   (( segid "    " and resid 110  and name HB1 ))
   (( segid "    " and resid 111  and name HN  ))
      3.600     1.600     1.600 peak  3642 spectrum    1 weight  0.11000E+01 volume  0.35734E-03 ppm1      1.260 ppm2      8.379 CV     1
 ASSI { 3643}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      6.000     4.800     0.000 peak  3643 spectrum    1 weight  0.11000E+01 volume  0.41182E-04 ppm1      4.182 ppm2      9.305 CV     1
 ASSI { 3648}
   (  segid "    " and resid 56   and name HD1%)
   (  segid "    " and resid 106  and name HE% )
      6.000     6.000     0.000 peak  3648 spectrum    1 weight  0.11000E+01 volume  0.28377E-04 ppm1      1.047 ppm2      6.022 CV     1
 ASSI { 3649}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 37   and name HA  ))
      3.200     3.200     2.800 peak  3649 spectrum    1 weight  0.11000E+01 volume  0.46410E-03 ppm1      0.782 ppm2      4.298 CV     1
 ASSI { 3651}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 113  and name HB  ))
      2.200     2.200     3.800 peak  3651 spectrum    1 weight  0.11000E+01 volume  0.11085E-01 ppm1      0.759 ppm2      1.917 CV     1
 ASSI { 3652}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 76   and name HB1 ))
      2.500     2.500     3.500 peak  3652 spectrum    1 weight  0.11000E+01 volume  0.27426E-02 ppm1      0.758 ppm2      2.122 CV     1
 ASSI { 3653}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 75   and name HG1 ))
      4.300     2.300     1.700 peak  3653 spectrum    1 weight  0.11000E+01 volume  0.76507E-04 ppm1      0.757 ppm2      2.326 CV     1
 ASSI { 3657}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 76   and name HA  ))
      2.200     0.600     0.600 peak  3657 spectrum    1 weight  0.11000E+01 volume  0.65296E-02 ppm1      0.759 ppm2      3.996 CV     1
 ASSI { 3661}
   (( segid "    " and resid 59   and name HB  ))
   (( segid "    " and resid 61   and name HN  ))
      5.700     4.100     0.300 peak  3661 spectrum    1 weight  0.11000E+01 volume  0.12378E-03 ppm1      4.482 ppm2      7.983 CV     1
 ASSI { 3664}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 90   and name HN  ))
      4.300     2.300     1.700 peak  3664 spectrum    1 weight  0.11000E+01 volume  0.22243E-03 ppm1      3.475 ppm2      8.680 CV     1
 ASSI { 3673}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 86   and name HA  ))
      4.200     2.200     1.800 peak  3673 spectrum    1 weight  0.11000E+01 volume  0.96809E-03 ppm1      3.469 ppm2      3.859 CV     1
 ASSI { 3677}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 79   and name HB1 ))
      4.000     2.000     2.000 peak  3677 spectrum    1 weight  0.11000E+01 volume  0.11843E-02 ppm1      3.299 ppm2      3.810 CV     1
 ASSI { 3678}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 81   and name HG  ))
      3.900     1.900     1.900 peak  3678 spectrum    1 weight  0.11000E+01 volume  0.74796E-03 ppm1      4.195 ppm2      1.567 CV     1
 ASSI { 3679}
   (( segid "    " and resid 79   and name HB2 ))
   (  segid "    " and resid 81   and name HD1%)
      2.500     2.500     3.500 peak  3679 spectrum    1 weight  0.11000E+01 volume  0.98885E-02 ppm1      4.195 ppm2      0.823 CV     1
 ASSI { 3682}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 130  and name HN  ))
      3.800     1.800     1.800 peak  3682 spectrum    1 weight  0.11000E+01 volume  0.50640E-03 ppm1      4.195 ppm2      7.793 CV     1
 ASSI { 3689}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 136  and name HD2 ))
      3.700     1.700     1.700 peak  3689 spectrum    1 weight  0.11000E+01 volume  0.93745E-03 ppm1      3.596 ppm2      3.162 CV     1
 ASSI { 3690}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 134  and name HA  ))
      4.300     2.300     1.700 peak  3690 spectrum    1 weight  0.11000E+01 volume  0.41886E-03 ppm1      3.602 ppm2      4.104 CV     1
 ASSI { 3691}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 87   and name HN  ))
      5.600     4.000     0.400 peak  3691 spectrum    1 weight  0.11000E+01 volume  0.71857E-04 ppm1      3.672 ppm2      8.535 CV     1
 ASSI { 3693}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 118  and name HA  ))
      4.600     2.700     1.400 peak  3693 spectrum    1 weight  0.11000E+01 volume  0.21668E-02 ppm1      3.722 ppm2      4.131 CV     1
 ASSI { 3694}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 84   and name HB  ))
      3.400     1.400     1.400 peak  3694 spectrum    1 weight  0.11000E+01 volume  0.14759E-02 ppm1      3.683 ppm2      4.142 CV     1
 ASSI { 3700}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HB1 ))
      3.400     3.400     2.600 peak  3700 spectrum    1 weight  0.11000E+01 volume  0.13847E-03 ppm1      4.192 ppm2      3.867 CV     1
 ASSI { 3702}
   (( segid "    " and resid 79   and name HB1 ))
   (  segid "    " and resid 81   and name HD1%)
      2.200     0.600     0.600 peak  3702 spectrum    1 weight  0.11000E+01 volume  0.71337E-02 ppm1      3.831 ppm2      0.880 CV     1
 ASSI { 3704}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 88   and name HN  ))
      6.000     4.700     0.000 peak  3704 spectrum    1 weight  0.11000E+01 volume  0.33323E-04 ppm1      4.028 ppm2      7.282 CV     1
 ASSI { 3707}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 83   and name HB2 ))
      4.700     2.700     1.300 peak  3707 spectrum    1 weight  0.11000E+01 volume  0.34786E-03 ppm1      4.023 ppm2      2.845 CV     1
 ASSI { 3711}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      3.900     1.900     1.900 peak  3711 spectrum    1 weight  0.11000E+01 volume  0.29755E-03 ppm1      3.921 ppm2      9.199 CV     1
 ASSI { 3713}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 106  and name HD% )
      3.100     1.200     1.200 peak  3713 spectrum    1 weight  0.11000E+01 volume  0.55299E-03 ppm1      3.072 ppm2      7.435 CV     1
 ASSI { 3714}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
      1.900     0.500     0.500 peak  3714 spectrum    1 weight  0.11000E+01 volume  0.75562E-02 ppm1      3.072 ppm2      3.261 CV     1
 ASSI { 3718}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 57   and name HZ  ))
      5.200     3.300     0.800 peak  3718 spectrum    1 weight  0.11000E+01 volume  0.35784E-03 ppm1      4.174 ppm2      6.862 CV     1
 ASSI { 3719}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      5.000     3.100     1.000 peak  3719 spectrum    1 weight  0.11000E+01 volume  0.28828E-03 ppm1      4.507 ppm2      6.971 CV     1
 ASSI { 3720}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      6.000     4.500     0.000 peak  3720 spectrum    1 weight  0.11000E+01 volume  0.78920E-04 ppm1      4.488 ppm2      8.097 CV     1
 ASSI { 3728}
   (( segid "    " and resid 134  and name HB1 ))
   (( segid "    " and resid 134  and name HA  ))
      2.900     1.000     1.000 peak  3728 spectrum    1 weight  0.11000E+01 volume  0.28397E-02 ppm1      3.876 ppm2      4.143 CV     1
 ASSI { 3731}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      3.600     1.600     1.600 peak  3731 spectrum    1 weight  0.11000E+01 volume  0.43755E-03 ppm1      3.023 ppm2      7.596 CV     1
 ASSI { 3736}
   (( segid "    " and resid 123  and name HA  ))
   (  segid "    " and resid 92   and name HD1%)
      5.700     5.700     0.300 peak  3736 spectrum    1 weight  0.11000E+01 volume  0.26081E-03 ppm1      4.549 ppm2      0.817 CV     1
 ASSI { 3737}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HD2 ))
      5.000     3.100     1.000 peak  3737 spectrum    1 weight  0.11000E+01 volume  0.24200E-03 ppm1      4.555 ppm2      3.737 CV     1
 ASSI { 3739}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
      6.000     5.100     0.000 peak  3739 spectrum    1 weight  0.11000E+01 volume  0.26699E-04 ppm1      4.224 ppm2      0.456 CV     1
 ASSI { 3745}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 41   and name HB2 ))
      4.700     2.700     1.300 peak  3745 spectrum    1 weight  0.11000E+01 volume  0.46216E-04 ppm1      4.126 ppm2      2.646 CV     1
 ASSI { 3747}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 58   and name HE% )
      3.900     1.900     1.900 peak  3747 spectrum    1 weight  0.11000E+01 volume  0.12814E-02 ppm1      3.981 ppm2      6.871 CV     1
 ASSI { 3748}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 66   and name HD1 ))
      4.500     2.500     1.500 peak  3748 spectrum    1 weight  0.11000E+01 volume  0.40629E-03 ppm1      4.174 ppm2      1.553 CV     1
 ASSI { 3749}
   (( segid "    " and resid 61   and name HB1 ))
   (  segid "    " and resid 67   and name HG2%)
      5.500     3.700     0.500 peak  3749 spectrum    1 weight  0.11000E+01 volume  0.59668E-04 ppm1      3.908 ppm2     -0.051 CV     1
 ASSI { 3750}
   (( segid "    " and resid 61   and name HB1 ))
   (  segid "    " and resid 63   and name HG2%)
      5.900     5.900     0.100 peak  3750 spectrum    1 weight  0.11000E+01 volume  0.48100E-04 ppm1      3.912 ppm2      0.935 CV     1
 ASSI { 3751}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 62   and name HD1 ))
      6.000     6.000     0.000 peak  3751 spectrum    1 weight  0.11000E+01 volume  0.41212E-05 ppm1      3.908 ppm2      3.077 CV     1
 ASSI { 3752}
   (( segid "    " and resid 61   and name HB1 ))
   (( segid "    " and resid 60   and name HA  ))
      3.500     1.500     1.500 peak  3752 spectrum    1 weight  0.11000E+01 volume  0.82664E-03 ppm1      3.907 ppm2      4.456 CV     1
 ASSI { 3755}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      6.000     4.600     0.000 peak  3755 spectrum    1 weight  0.11000E+01 volume  0.33588E-04 ppm1      4.033 ppm2      9.673 CV     1
 ASSI { 3756}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      2.700     0.900     0.900 peak  3756 spectrum    1 weight  0.11000E+01 volume  0.17569E-02 ppm1      4.027 ppm2      7.418 CV     1
 ASSI { 3757}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      5.400     3.700     0.600 peak  3757 spectrum    1 weight  0.11000E+01 volume  0.21259E-03 ppm1      4.026 ppm2      7.586 CV     1
 ASSI { 3758}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 51   and name HD1 ))
      3.400     1.500     1.500 peak  3758 spectrum    1 weight  0.11000E+01 volume  0.23216E-02 ppm1      4.036 ppm2      3.382 CV     1
 ASSI { 3764}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 73   and name HE1 ))
      4.000     2.000     2.000 peak  3764 spectrum    1 weight  0.11000E+01 volume  0.11925E-02 ppm1      3.825 ppm2      2.083 CV     1
 ASSI { 3767}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.400     0.700     0.700 peak  3767 spectrum    1 weight  0.11000E+01 volume  0.34123E-02 ppm1      3.826 ppm2      3.393 CV     1
 ASSI { 3768}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HB1 ))
      2.800     0.900     0.900 peak  3768 spectrum    1 weight  0.11000E+01 volume  0.44471E-02 ppm1      3.825 ppm2      3.296 CV     1
 ASSI { 3769}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HE2 ))
      6.000     4.900     0.000 peak  3769 spectrum    1 weight  0.11000E+01 volume  0.65763E-04 ppm1      3.824 ppm2      2.919 CV     1
 ASSI { 3772}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 118  and name HG2 ))
      6.000     4.900     0.000 peak  3772 spectrum    1 weight  0.11000E+01 volume  0.60521E-04 ppm1      3.820 ppm2      2.535 CV     1
 ASSI { 3773}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 109  and name HN  ))
      3.100     1.200     1.200 peak  3773 spectrum    1 weight  0.11000E+01 volume  0.13908E-02 ppm1      4.193 ppm2      8.715 CV     1
 ASSI { 3774}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      5.800     4.300     0.200 peak  3774 spectrum    1 weight  0.11000E+01 volume  0.46717E-04 ppm1      4.221 ppm2      8.011 CV     1
 ASSI { 3776}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 77   and name HN  ))
      4.000     2.000     2.000 peak  3776 spectrum    1 weight  0.11000E+01 volume  0.62304E-03 ppm1      3.931 ppm2      8.570 CV     1
 ASSI { 3779}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 77   and name HB  ))
      3.100     3.100     2.900 peak  3779 spectrum    1 weight  0.11000E+01 volume  0.34563E-02 ppm1      3.919 ppm2      2.338 CV     1
 ASSI { 3780}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 108  and name HN  ))
      2.900     1.000     1.000 peak  3780 spectrum    1 weight  0.11000E+01 volume  0.18497E-02 ppm1      3.992 ppm2      8.442 CV     1
 ASSI { 3781}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
      2.800     1.000     1.000 peak  3781 spectrum    1 weight  0.11000E+01 volume  0.18293E-02 ppm1      3.997 ppm2      8.801 CV     1
 ASSI { 3784}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HG1 ))
      2.600     0.800     0.800 peak  3784 spectrum    1 weight  0.11000E+01 volume  0.25195E-02 ppm1      3.991 ppm2      1.509 CV     1
 ASSI { 3787}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
      2.300     0.700     0.700 peak  3787 spectrum    1 weight  0.11000E+01 volume  0.43679E-02 ppm1      3.998 ppm2      4.232 CV     1
 ASSI { 3789}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      3.200     1.300     1.300 peak  3789 spectrum    1 weight  0.11000E+01 volume  0.37771E-03 ppm1      4.976 ppm2      9.310 CV     1
 ASSI { 3792}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
      3.700     1.700     1.700 peak  3792 spectrum    1 weight  0.11000E+01 volume  0.64920E-03 ppm1      4.084 ppm2      8.246 CV     1
 ASSI { 3793}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB1 ))
      2.500     0.800     0.800 peak  3793 spectrum    1 weight  0.11000E+01 volume  0.65936E-02 ppm1      4.078 ppm2      3.828 CV     1
 ASSI { 3794}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HB1 ))
      3.000     1.100     1.100 peak  3794 spectrum    1 weight  0.11000E+01 volume  0.29899E-02 ppm1      4.043 ppm2      2.069 CV     1
 ASSI { 3796}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 46   and name HG2%)
      4.700     2.800     1.300 peak  3796 spectrum    1 weight  0.11000E+01 volume  0.63084E-03 ppm1      4.086 ppm2      0.514 CV     1
 ASSI { 3797}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      3.300     1.400     1.400 peak  3797 spectrum    1 weight  0.11000E+01 volume  0.89278E-03 ppm1      4.032 ppm2      8.053 CV     1
 ASSI { 3798}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 78   and name HN  ))
      3.800     1.800     1.800 peak  3798 spectrum    1 weight  0.11000E+01 volume  0.21389E-02 ppm1      4.038 ppm2      7.336 CV     1
 ASSI { 3802}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
      3.500     1.500     1.500 peak  3802 spectrum    1 weight  0.11000E+01 volume  0.68967E-03 ppm1      4.047 ppm2      2.245 CV     1
 ASSI { 3804}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
      4.100     2.100     1.900 peak  3804 spectrum    1 weight  0.11000E+01 volume  0.17509E-02 ppm1      4.043 ppm2      3.121 CV     1
 ASSI { 3814}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 117  and name HB1 ))
      2.900     1.100     1.100 peak  3814 spectrum    1 weight  0.11000E+01 volume  0.18699E-02 ppm1      3.807 ppm2      1.458 CV     1
 ASSI { 3815}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 113  and name HG11))
      4.600     2.700     1.400 peak  3815 spectrum    1 weight  0.11000E+01 volume  0.16032E-02 ppm1      4.079 ppm2      0.682 CV     1
 ASSI { 3816}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 81   and name HG  ))
      6.000     5.000     0.000 peak  3816 spectrum    1 weight  0.11000E+01 volume  0.50365E-04 ppm1      4.081 ppm2      1.583 CV     1
 ASSI { 3819}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      3.300     1.400     1.400 peak  3819 spectrum    1 weight  0.11000E+01 volume  0.79436E-03 ppm1      4.121 ppm2      7.892 CV     1
 ASSI { 3826}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HG12))
      4.900     2.900     1.100 peak  3826 spectrum    1 weight  0.11000E+01 volume  0.24821E-03 ppm1      4.116 ppm2      1.342 CV     1
 ASSI { 3828}
   (( segid "    " and resid 39   and name HA  ))
   (  segid "    " and resid 39   and name HG2%)
      2.200     0.600     0.600 peak  3828 spectrum    1 weight  0.11000E+01 volume  0.13628E-01 ppm1      4.123 ppm2      0.858 CV     1
 ASSI { 3829}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 137  and name HD2 ))
      4.300     2.300     1.700 peak  3829 spectrum    1 weight  0.11000E+01 volume  0.28203E-03 ppm1      4.125 ppm2      3.101 CV     1
 ASSI { 3830}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
      6.000     5.100     0.000 peak  3830 spectrum    1 weight  0.11000E+01 volume  0.13953E-03 ppm1      4.127 ppm2      2.695 CV     1
 ASSI { 3833}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 94   and name HB2 ))
      3.900     1.900     1.900 peak  3833 spectrum    1 weight  0.11000E+01 volume  0.13300E-02 ppm1      3.882 ppm2      2.207 CV     1
 ASSI { 3834}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 94   and name HB1 ))
      3.000     1.200     1.200 peak  3834 spectrum    1 weight  0.11000E+01 volume  0.11790E-02 ppm1      3.880 ppm2      1.170 CV     1
 ASSI { 3836}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HE2 ))
      5.800     4.300     0.200 peak  3836 spectrum    1 weight  0.11000E+01 volume  0.29134E-03 ppm1      3.887 ppm2      3.046 CV     1
 ASSI { 3837}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HG1 ))
      2.800     1.000     1.000 peak  3837 spectrum    1 weight  0.11000E+01 volume  0.71824E-02 ppm1      3.880 ppm2      1.579 CV     1
 ASSI { 3838}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 87   and name HN  ))
      4.100     2.100     1.900 peak  3838 spectrum    1 weight  0.11000E+01 volume  0.10775E-02 ppm1      4.128 ppm2      8.585 CV     1
 ASSI { 3840}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      6.000     5.700     0.000 peak  3840 spectrum    1 weight  0.11000E+01 volume  0.19399E-04 ppm1      4.129 ppm2      9.169 CV     1
 ASSI { 3841}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      2.900     1.000     1.000 peak  3841 spectrum    1 weight  0.11000E+01 volume  0.30407E-02 ppm1      4.132 ppm2      7.203 CV     1
 ASSI { 3842}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 92   and name HN  ))
      3.500     1.500     1.500 peak  3842 spectrum    1 weight  0.11000E+01 volume  0.15151E-02 ppm1      4.125 ppm2      7.678 CV     1
 ASSI { 3843}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 58   and name HD% )
      2.500     0.800     0.800 peak  3843 spectrum    1 weight  0.11000E+01 volume  0.61706E-02 ppm1      4.135 ppm2      7.386 CV     1
 ASSI { 3845}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 58   and name HB1 ))
      4.300     2.300     1.700 peak  3845 spectrum    1 weight  0.11000E+01 volume  0.15274E-02 ppm1      4.136 ppm2      2.905 CV     1
 ASSI { 3847}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HG1 ))
      3.500     1.500     1.500 peak  3847 spectrum    1 weight  0.11000E+01 volume  0.22115E-02 ppm1      4.134 ppm2      2.331 CV     1
 ASSI { 3855}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      4.100     2.100     1.900 peak  3855 spectrum    1 weight  0.11000E+01 volume  0.60425E-03 ppm1      4.374 ppm2      7.502 CV     1
 ASSI { 3857}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 78   and name HN  ))
      3.900     1.900     1.900 peak  3857 spectrum    1 weight  0.11000E+01 volume  0.49797E-03 ppm1      4.377 ppm2      7.334 CV     1
 ASSI { 3859}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 58   and name HE% )
      4.200     2.200     1.800 peak  3859 spectrum    1 weight  0.11000E+01 volume  0.90199E-03 ppm1      2.816 ppm2      6.863 CV     1
 ASSI { 3860}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 57   and name HE% )
      6.000     6.000     0.000 peak  3860 spectrum    1 weight  0.11000E+01 volume  0.54460E-05 ppm1      2.825 ppm2      7.279 CV     1
 ASSI { 3861}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      6.000     5.800     0.000 peak  3861 spectrum    1 weight  0.11000E+01 volume  0.19841E-04 ppm1      2.822 ppm2      8.055 CV     1
 ASSI { 3862}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
      6.000     6.000     0.000 peak  3862 spectrum    1 weight  0.11000E+01 volume  0.43832E-04 ppm1      2.814 ppm2      0.443 CV     1
 ASSI { 3863}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      6.000     6.000     0.000 peak  3863 spectrum    1 weight  0.11000E+01 volume  0.30114E-04 ppm1      2.815 ppm2      9.309 CV     1
 ASSI { 3864}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 106  and name HN  ))
      4.600     2.700     1.400 peak  3864 spectrum    1 weight  0.11000E+01 volume  0.14792E-03 ppm1      2.809 ppm2      9.511 CV     1
 ASSI { 3866}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 57   and name HA  ))
      4.100     2.100     1.900 peak  3866 spectrum    1 weight  0.11000E+01 volume  0.10213E-02 ppm1      2.818 ppm2      3.059 CV     1
 ASSI { 3868}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 77   and name HN  ))
      6.000     5.300     0.000 peak  3868 spectrum    1 weight  0.11000E+01 volume  0.22343E-04 ppm1      4.374 ppm2      8.594 CV     1
 ASSI { 3869}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 115  and name HG1%)
      3.500     1.500     1.500 peak  3869 spectrum    1 weight  0.11000E+01 volume  0.81806E-03 ppm1      4.535 ppm2      0.663 CV     1
 ASSI { 3870}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 122  and name HD2%)
      4.500     2.600     1.500 peak  3870 spectrum    1 weight  0.11000E+01 volume  0.31627E-03 ppm1      4.533 ppm2      0.823 CV     1
 ASSI { 3871}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 81   and name HD2%)
      4.900     4.900     1.100 peak  3871 spectrum    1 weight  0.11000E+01 volume  0.65165E-03 ppm1      4.536 ppm2      0.930 CV     1
 ASSI { 3872}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HG2 ))
      4.300     2.300     1.700 peak  3872 spectrum    1 weight  0.11000E+01 volume  0.60338E-03 ppm1      4.534 ppm2      1.486 CV     1
 ASSI { 3876}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 57   and name HD% )
      5.100     3.300     0.900 peak  3876 spectrum    1 weight  0.11000E+01 volume  0.16211E-03 ppm1      4.487 ppm2      7.603 CV     1
 ASSI { 3877}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 106  and name HE% )
      6.000     4.700     0.000 peak  3877 spectrum    1 weight  0.11000E+01 volume  0.19655E-03 ppm1      4.491 ppm2      5.946 CV     1
 ASSI { 3878}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 103  and name HA  ))
      2.800     1.000     1.000 peak  3878 spectrum    1 weight  0.11000E+01 volume  0.31588E-02 ppm1      4.503 ppm2      2.797 CV     1
 ASSI { 3879}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
      6.000     6.000     0.000 peak  3879 spectrum    1 weight  0.11000E+01 volume  0.82336E-04 ppm1      4.500 ppm2      0.467 CV     1
 ASSI { 3880}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 56   and name HB  ))
      5.700     4.100     0.300 peak  3880 spectrum    1 weight  0.11000E+01 volume  0.13453E-03 ppm1      4.502 ppm2      2.395 CV     1
 ASSI { 3884}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 115  and name HN  ))
      4.300     2.300     1.700 peak  3884 spectrum    1 weight  0.11000E+01 volume  0.28027E-03 ppm1      3.834 ppm2      8.010 CV     1
 ASSI { 3886}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 116  and name HN  ))
      4.300     2.300     1.700 peak  3886 spectrum    1 weight  0.11000E+01 volume  0.35710E-03 ppm1      3.820 ppm2      7.848 CV     1
 ASSI { 3887}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HD1 ))
      4.100     2.100     1.900 peak  3887 spectrum    1 weight  0.11000E+01 volume  0.12708E-02 ppm1      3.812 ppm2      1.648 CV     1
 ASSI { 3888}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name HN  ))
      4.500     2.500     1.500 peak  3888 spectrum    1 weight  0.11000E+01 volume  0.23647E-03 ppm1      3.874 ppm2      8.524 CV     1
 ASSI { 3893}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 90   and name HN  ))
      6.000     4.700     0.000 peak  3893 spectrum    1 weight  0.11000E+01 volume  0.11825E-03 ppm1      3.868 ppm2      8.658 CV     1
 ASSI { 3894}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      4.000     2.000     2.000 peak  3894 spectrum    1 weight  0.11000E+01 volume  0.51825E-03 ppm1      4.030 ppm2      7.248 CV     1
 ASSI { 3895}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
      4.200     2.200     1.800 peak  3895 spectrum    1 weight  0.11000E+01 volume  0.29543E-03 ppm1      4.029 ppm2      8.328 CV     1
 ASSI { 3898}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      5.000     3.200     1.000 peak  3898 spectrum    1 weight  0.11000E+01 volume  0.36728E-03 ppm1      3.821 ppm2      8.016 CV     1
 ASSI { 3900}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      4.300     2.300     1.700 peak  3900 spectrum    1 weight  0.11000E+01 volume  0.33458E-03 ppm1      3.859 ppm2     10.758 CV     1
 ASSI { 3904}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HE1 ))
      6.000     6.000     0.000 peak  3904 spectrum    1 weight  0.11000E+01 volume  0.60227E-04 ppm1      3.827 ppm2      3.052 CV     1
 ASSI { 3906}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HA  ))
      6.000     6.000     0.000 peak  3906 spectrum    1 weight  0.11000E+01 volume  0.32675E-05 ppm1      3.808 ppm2      3.271 CV     1
 ASSI { 3907}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 96   and name HB1 ))
      5.700     4.100     0.300 peak  3907 spectrum    1 weight  0.11000E+01 volume  0.17335E-03 ppm1      3.826 ppm2      2.244 CV     1
 ASSI { 3908}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 89   and name HG12))
      3.000     3.000     3.000 peak  3908 spectrum    1 weight  0.11000E+01 volume  0.74136E-02 ppm1      3.872 ppm2      1.851 CV     1
 ASSI { 3914}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 126  and name HB1 ))
      4.100     2.100     1.900 peak  3914 spectrum    1 weight  0.11000E+01 volume  0.61094E-03 ppm1      3.971 ppm2      1.537 CV     1
 ASSI { 3921}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 60   and name HA  ))
      5.600     3.900     0.400 peak  3921 spectrum    1 weight  0.11000E+01 volume  0.17215E-03 ppm1      3.968 ppm2      4.422 CV     1
 ASSI { 3923}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HG  ))
      2.600     0.900     0.900 peak  3923 spectrum    1 weight  0.11000E+01 volume  0.29760E-02 ppm1      3.964 ppm2      1.810 CV     1
 ASSI { 3924}
   (( segid "    " and resid 110  and name HD22))
   (( segid "    " and resid 110  and name HA  ))
      3.300     3.300     2.700 peak  3924 spectrum    1 weight  0.11000E+01 volume  0.25347E-02 ppm1      3.969 ppm2      3.762 CV     1
 ASSI { 3925}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 44   and name HE3 ))
      6.000     6.000     0.000 peak  3925 spectrum    1 weight  0.11000E+01 volume  0.67998E-05 ppm1      4.610 ppm2      7.650 CV     1
 ASSI { 3927}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 100  and name HA  ))
      4.000     2.000     2.000 peak  3927 spectrum    1 weight  0.11000E+01 volume  0.11012E-02 ppm1      4.969 ppm2      5.116 CV     1
 ASSI { 3929}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 118  and name HN  ))
      3.200     3.200     2.800 peak  3929 spectrum    1 weight  0.11000E+01 volume  0.14757E-02 ppm1      4.046 ppm2      7.710 CV     1
 ASSI { 3931}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HB1 ))
      2.700     0.900     0.900 peak  3931 spectrum    1 weight  0.11000E+01 volume  0.44996E-02 ppm1      4.077 ppm2      1.450 CV     1
 ASSI { 3932}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HB1 ))
      2.300     0.700     0.700 peak  3932 spectrum    1 weight  0.11000E+01 volume  0.91109E-02 ppm1      4.069 ppm2      1.803 CV     1
 ASSI { 3933}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HB2 ))
      2.400     0.700     0.700 peak  3933 spectrum    1 weight  0.11000E+01 volume  0.49247E-02 ppm1      4.082 ppm2      2.057 CV     1
 ASSI { 3934}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HB1 ))
      2.700     0.900     0.900 peak  3934 spectrum    1 weight  0.11000E+01 volume  0.23572E-02 ppm1      4.069 ppm2      1.626 CV     1
 ASSI { 3941}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HB1 ))
      2.300     0.700     0.700 peak  3941 spectrum    1 weight  0.11000E+01 volume  0.95508E-02 ppm1      4.050 ppm2      1.745 CV     1
 ASSI { 3946}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HG1 ))
      3.400     1.500     1.500 peak  3946 spectrum    1 weight  0.11000E+01 volume  0.20131E-02 ppm1      4.049 ppm2      1.349 CV     1
 ASSI { 3947}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      3.100     1.200     1.200 peak  3947 spectrum    1 weight  0.11000E+01 volume  0.18874E-02 ppm1      4.095 ppm2      7.525 CV     1
 ASSI { 3949}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HE1 ))
      5.000     3.200     1.000 peak  3949 spectrum    1 weight  0.11000E+01 volume  0.56860E-03 ppm1      4.100 ppm2      2.950 CV     1
 ASSI { 3952}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      4.000     2.000     2.000 peak  3952 spectrum    1 weight  0.11000E+01 volume  0.22207E-02 ppm1      3.913 ppm2      7.546 CV     1
 ASSI { 3953}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HE1 ))
      6.000     6.000     0.000 peak  3953 spectrum    1 weight  0.11000E+01 volume  0.17515E-04 ppm1      3.937 ppm2      3.070 CV     1
 ASSI { 3954}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
      2.700     0.900     0.900 peak  3954 spectrum    1 weight  0.11000E+01 volume  0.56142E-02 ppm1      3.932 ppm2      2.010 CV     1
 ASSI { 3957}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 110  and name HN  ))
      6.000     4.500     0.000 peak  3957 spectrum    1 weight  0.11000E+01 volume  0.41329E-04 ppm1      3.624 ppm2      7.164 CV     1
 ASSI { 3958}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 90   and name HE3 ))
      4.100     2.100     1.900 peak  3958 spectrum    1 weight  0.11000E+01 volume  0.10182E-03 ppm1      3.634 ppm2      7.286 CV     1
 ASSI { 3959}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
      4.700     2.700     1.300 peak  3959 spectrum    1 weight  0.11000E+01 volume  0.12661E-03 ppm1      3.636 ppm2      8.225 CV     1
 ASSI { 3960}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
      5.900     4.400     0.100 peak  3960 spectrum    1 weight  0.11000E+01 volume  0.50336E-04 ppm1      3.631 ppm2      8.326 CV     1
 ASSI { 3961}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 108  and name HB2 ))
      6.000     6.000     0.000 peak  3961 spectrum    1 weight  0.11000E+01 volume  0.26287E-04 ppm1      3.630 ppm2      2.565 CV     1
 ASSI { 3962}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 112  and name HG  ))
      3.700     1.700     1.700 peak  3962 spectrum    1 weight  0.11000E+01 volume  0.79070E-03 ppm1      3.629 ppm2      1.920 CV     1
 ASSI { 3963}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 112  and name HB2 ))
      2.700     0.900     0.900 peak  3963 spectrum    1 weight  0.11000E+01 volume  0.17057E-02 ppm1      3.632 ppm2      2.028 CV     1
 ASSI { 3964}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 108  and name HG  ))
      6.000     5.000     0.000 peak  3964 spectrum    1 weight  0.11000E+01 volume  0.60112E-04 ppm1      3.624 ppm2      1.538 CV     1
 ASSI { 3965}
   (( segid "    " and resid 109  and name HA  ))
   (  segid "    " and resid 112  and name HD2%)
      4.200     4.200     1.800 peak  3965 spectrum    1 weight  0.11000E+01 volume  0.18157E-02 ppm1      3.635 ppm2      0.701 CV     1
 ASSI { 3968}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 90   and name HZ3 ))
      6.000     5.700     0.000 peak  3968 spectrum    1 weight  0.11000E+01 volume  0.11566E-03 ppm1      4.087 ppm2      6.818 CV     1
 ASSI { 3970}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      5.800     4.300     0.200 peak  3970 spectrum    1 weight  0.11000E+01 volume  0.10892E-03 ppm1      4.092 ppm2     -0.031 CV     1
 ASSI { 3973}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 67   and name HG12))
      3.800     1.800     1.800 peak  3973 spectrum    1 weight  0.11000E+01 volume  0.19453E-02 ppm1      4.081 ppm2      1.488 CV     1
 ASSI { 3974}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 75   and name HB1 ))
      3.700     1.700     1.700 peak  3974 spectrum    1 weight  0.11000E+01 volume  0.15365E-02 ppm1      4.081 ppm2      1.970 CV     1
 ASSI { 3975}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.800     1.000     1.000 peak  3975 spectrum    1 weight  0.11000E+01 volume  0.13845E-02 ppm1      4.093 ppm2      2.190 CV     1
 ASSI { 3977}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 76   and name HG2 ))
      4.000     2.000     2.000 peak  3977 spectrum    1 weight  0.11000E+01 volume  0.45498E-03 ppm1      4.088 ppm2      3.016 CV     1
 ASSI { 3980}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 101  and name HD1%)
      3.900     1.900     1.900 peak  3980 spectrum    1 weight  0.11000E+01 volume  0.18814E-02 ppm1      4.085 ppm2      0.817 CV     1
 ASSI { 3982}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.600     0.900     0.900 peak  3982 spectrum    1 weight  0.11000E+01 volume  0.13737E-02 ppm1      3.766 ppm2      3.207 CV     1
 ASSI { 3983}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 110  and name HB1 ))
      3.300     1.300     1.300 peak  3983 spectrum    1 weight  0.11000E+01 volume  0.12074E-02 ppm1      3.759 ppm2      1.180 CV     1
 ASSI { 3985}
   (( segid "    " and resid 107  and name HA  ))
   (  segid "    " and resid 46   and name HG2%)
      4.200     2.200     1.800 peak  3985 spectrum    1 weight  0.11000E+01 volume  0.39216E-03 ppm1      3.764 ppm2      0.500 CV     1
 ASSI { 3987}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 74   and name HE1 ))
      6.000     5.500     0.000 peak  3987 spectrum    1 weight  0.11000E+01 volume  0.17839E-04 ppm1      3.935 ppm2      2.948 CV     1
 ASSI { 3988}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 120  and name HD2 ))
      6.000     4.800     0.000 peak  3988 spectrum    1 weight  0.11000E+01 volume  0.17748E-03 ppm1      4.139 ppm2      7.192 CV     1
 ASSI { 3990}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 117  and name HB1 ))
      2.900     2.900     3.100 peak  3990 spectrum    1 weight  0.11000E+01 volume  0.22414E-02 ppm1      4.138 ppm2      1.442 CV     1
 ASSI { 3991}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 117  and name HD1%)
      2.400     2.400     3.600 peak  3991 spectrum    1 weight  0.11000E+01 volume  0.28179E-02 ppm1      4.139 ppm2      0.914 CV     1
 ASSI { 3992}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
      2.500     0.800     0.800 peak  3992 spectrum    1 weight  0.11000E+01 volume  0.31924E-02 ppm1      5.111 ppm2      1.690 CV     1
 ASSI { 3996}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 69   and name HA1 ))
      4.700     2.700     1.300 peak  3996 spectrum    1 weight  0.11000E+01 volume  0.30064E-03 ppm1      5.110 ppm2      3.577 CV     1
 ASSI { 3998}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 106  and name HN  ))
      4.800     2.800     1.200 peak  3998 spectrum    1 weight  0.11000E+01 volume  0.46016E-03 ppm1      5.817 ppm2      9.494 CV     1
 ASSI { 4000}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 105  and name HG2 ))
      6.000     5.300     0.000 peak  4000 spectrum    1 weight  0.11000E+01 volume  0.25581E-04 ppm1      5.818 ppm2      2.917 CV     1
 ASSI { 4002}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      3.500     1.600     1.600 peak  4002 spectrum    1 weight  0.11000E+01 volume  0.96255E-03 ppm1      4.625 ppm2     10.742 CV     1
 ASSI { 4003}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 90   and name HE1 ))
      4.300     2.300     1.700 peak  4003 spectrum    1 weight  0.11000E+01 volume  0.60015E-03 ppm1      4.623 ppm2     10.601 CV     1
 ASSI { 4007}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 127  and name HB1 ))
      5.400     3.700     0.600 peak  4007 spectrum    1 weight  0.11000E+01 volume  0.51820E-03 ppm1      4.173 ppm2      1.892 CV     1
 ASSI { 4008}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 127  and name HG2 ))
      5.300     3.500     0.700 peak  4008 spectrum    1 weight  0.11000E+01 volume  0.63614E-03 ppm1      4.167 ppm2      2.138 CV     1
 ASSI { 4010}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 125  and name HB2 ))
      5.200     3.400     0.800 peak  4010 spectrum    1 weight  0.11000E+01 volume  0.23167E-04 ppm1      4.175 ppm2      2.493 CV     1
 ASSI { 4011}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 92   and name HD2%)
      3.400     1.400     1.400 peak  4011 spectrum    1 weight  0.11000E+01 volume  0.80308E-03 ppm1      4.053 ppm2      0.677 CV     1
 ASSI { 4015}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 105  and name HG1 ))
      4.100     2.100     1.900 peak  4015 spectrum    1 weight  0.11000E+01 volume  0.56662E-03 ppm1      4.094 ppm2      2.291 CV     1
 ASSI { 4016}
   (( segid "    " and resid 93   and name HA  ))
   (  segid "    " and resid 101  and name HD2%)
      5.100     3.200     0.900 peak  4016 spectrum    1 weight  0.11000E+01 volume  0.17539E-03 ppm1      4.095 ppm2      0.068 CV     1
 ASSI { 4018}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 123  and name HB2 ))
      6.000     6.000     0.000 peak  4018 spectrum    1 weight  0.11000E+01 volume  0.47835E-04 ppm1      4.410 ppm2      2.318 CV     1
 ASSI { 4022}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      3.100     3.100     2.900 peak  4022 spectrum    1 weight  0.11000E+01 volume  0.24812E-02 ppm1      4.523 ppm2      0.901 CV     1
 ASSI { 4029}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 82   and name HG2 ))
      4.800     2.800     1.200 peak  4029 spectrum    1 weight  0.11000E+01 volume  0.10617E-02 ppm1      4.486 ppm2      2.143 CV     1
 ASSI { 4030}
   (( segid "    " and resid 81   and name HA  ))
   (  segid "    " and resid 81   and name HD1%)
      3.300     3.300     2.700 peak  4030 spectrum    1 weight  0.11000E+01 volume  0.68605E-02 ppm1      4.483 ppm2      0.910 CV     1
 ASSI { 4032}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HA1 ))
      3.800     1.800     1.800 peak  4032 spectrum    1 weight  0.11000E+01 volume  0.10757E-02 ppm1      4.417 ppm2      3.692 CV     1
 ASSI { 4033}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 44   and name HD1 ))
      3.300     1.400     1.400 peak  4033 spectrum    1 weight  0.11000E+01 volume  0.11000E-02 ppm1      4.631 ppm2      7.495 CV     1
 ASSI { 4034}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      3.600     1.600     1.600 peak  4034 spectrum    1 weight  0.11000E+01 volume  0.69998E-03 ppm1      4.636 ppm2      7.483 CV     1
 ASSI { 4036}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HD21))
      4.100     2.100     1.900 peak  4036 spectrum    1 weight  0.11000E+01 volume  0.72407E-03 ppm1      4.663 ppm2      8.104 CV     1
 ASSI { 4037}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HE1 ))
      3.900     1.900     1.900 peak  4037 spectrum    1 weight  0.11000E+01 volume  0.16167E-02 ppm1      4.668 ppm2      8.582 CV     1
 ASSI { 4040}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 101  and name HN  ))
      5.200     3.400     0.800 peak  4040 spectrum    1 weight  0.11000E+01 volume  0.12855E-03 ppm1      5.397 ppm2      8.644 CV     1
 ASSI { 4041}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
      6.000     5.900     0.000 peak  4041 spectrum    1 weight  0.11000E+01 volume  0.10636E-03 ppm1      5.398 ppm2      0.452 CV     1
 ASSI { 4043}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 43   and name HB2 ))
      3.300     3.300     2.700 peak  4043 spectrum    1 weight  0.11000E+01 volume  0.34203E-03 ppm1      5.213 ppm2      1.965 CV     1
 ASSI { 4044}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      3.200     1.300     1.300 peak  4044 spectrum    1 weight  0.11000E+01 volume  0.10647E-02 ppm1      4.546 ppm2      8.424 CV     1
 ASSI { 4046}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HG1 ))
      3.500     1.600     1.600 peak  4046 spectrum    1 weight  0.11000E+01 volume  0.21934E-02 ppm1      4.277 ppm2      1.513 CV     1
 ASSI { 4050}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HB1 ))
      2.400     0.700     0.700 peak  4050 spectrum    1 weight  0.11000E+01 volume  0.51724E-02 ppm1      4.278 ppm2      2.846 CV     1
 ASSI { 4051}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 86   and name HG  ))
      4.000     2.000     2.000 peak  4051 spectrum    1 weight  0.11000E+01 volume  0.57168E-03 ppm1      4.275 ppm2      1.545 CV     1
 ASSI { 4052}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HB1 ))
      2.700     2.700     3.300 peak  4052 spectrum    1 weight  0.11000E+01 volume  0.26918E-02 ppm1      4.274 ppm2      1.813 CV     1
 ASSI { 4054}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 85   and name HN  ))
      6.000     4.900     0.000 peak  4054 spectrum    1 weight  0.11000E+01 volume  0.34206E-04 ppm1      4.300 ppm2      6.859 CV     1
 ASSI { 4057}
   (( segid "    " and resid 62   and name HD1 ))
   (  segid "    " and resid 57   and name HE% )
      5.200     3.400     0.800 peak  4057 spectrum    1 weight  0.11000E+01 volume  0.23447E-03 ppm1      3.097 ppm2      7.274 CV     1
 ASSI { 4059}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HB2 ))
      3.400     1.500     1.500 peak  4059 spectrum    1 weight  0.11000E+01 volume  0.20972E-02 ppm1      3.436 ppm2      1.535 CV     1
 ASSI { 4060}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 61   and name HA  ))
      2.300     0.700     0.700 peak  4060 spectrum    1 weight  0.11000E+01 volume  0.48212E-02 ppm1      3.429 ppm2      3.979 CV     1
 ASSI { 4063}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 85   and name HA  ))
      3.900     1.900     1.900 peak  4063 spectrum    1 weight  0.11000E+01 volume  0.19102E-02 ppm1      3.962 ppm2      3.633 CV     1
 ASSI { 4064}
   (( segid "    " and resid 82   and name HD1 ))
   (( segid "    " and resid 84   and name HN  ))
      6.000     6.000     0.000 peak  4064 spectrum    1 weight  0.11000E+01 volume  0.28289E-04 ppm1      3.343 ppm2      6.965 CV     1
 ASSI { 4065}
   (( segid "    " and resid 82   and name HD1 ))
   (( segid "    " and resid 81   and name HN  ))
      4.900     3.000     1.100 peak  4065 spectrum    1 weight  0.11000E+01 volume  0.51160E-03 ppm1      3.339 ppm2      7.431 CV     1
 ASSI { 4067}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 81   and name HN  ))
      5.600     4.000     0.400 peak  4067 spectrum    1 weight  0.11000E+01 volume  0.25660E-03 ppm1      3.989 ppm2      7.430 CV     1
 ASSI { 4069}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 86   and name HN  ))
      6.000     4.800     0.000 peak  4069 spectrum    1 weight  0.11000E+01 volume  0.38739E-04 ppm1      3.987 ppm2      8.054 CV     1
 ASSI { 4070}
   (( segid "    " and resid 82   and name HD2 ))
   (( segid "    " and resid 82   and name HB2 ))
      5.000     3.200     1.000 peak  4070 spectrum    1 weight  0.11000E+01 volume  0.28639E-03 ppm1      3.965 ppm2      2.530 CV     1
 ASSI { 4072}
   (( segid "    " and resid 127  and name HD1 ))
   (  segid "    " and resid 130  and name HD2%)
      4.200     2.200     1.800 peak  4072 spectrum    1 weight  0.11000E+01 volume  0.11836E-02 ppm1      3.475 ppm2      0.584 CV     1
 ASSI { 4073}
   (( segid "    " and resid 127  and name HD2 ))
   (  segid "    " and resid 92   and name HD2%)
      2.800     2.800     3.200 peak  4073 spectrum    1 weight  0.11000E+01 volume  0.94111E-03 ppm1      4.089 ppm2      0.645 CV     1
 ASSI { 4074}
   (( segid "    " and resid 127  and name HD1 ))
   (( segid "    " and resid 130  and name HB2 ))
      4.800     2.800     1.200 peak  4074 spectrum    1 weight  0.11000E+01 volume  0.50722E-03 ppm1      3.477 ppm2      1.718 CV     1
 ASSI { 4076}
   (( segid "    " and resid 132  and name HD1 ))
   (( segid "    " and resid 135  and name HB2 ))
      4.800     2.900     1.200 peak  4076 spectrum    1 weight  0.11000E+01 volume  0.73996E-03 ppm1      3.240 ppm2      1.941 CV     1
 ASSI { 4078}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 131  and name HB  ))
      3.700     1.700     1.700 peak  4078 spectrum    1 weight  0.11000E+01 volume  0.16221E-02 ppm1      4.282 ppm2      1.947 CV     1
 ASSI { 4079}
   (( segid "    " and resid 132  and name HD1 ))
   (( segid "    " and resid 44   and name HH2 ))
      4.500     2.500     1.500 peak  4079 spectrum    1 weight  0.11000E+01 volume  0.11454E-03 ppm1      3.238 ppm2      7.276 CV     1
 ASSI { 4080}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 44   and name HH2 ))
      5.600     3.900     0.400 peak  4080 spectrum    1 weight  0.11000E+01 volume  0.19776E-03 ppm1      4.289 ppm2      7.275 CV     1
 ASSI { 4082}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 130  and name HN  ))
      4.400     2.400     1.600 peak  4082 spectrum    1 weight  0.11000E+01 volume  0.55270E-03 ppm1      3.882 ppm2      7.841 CV     1
 ASSI { 4083}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 127  and name HA  ))
      4.500     2.500     1.500 peak  4083 spectrum    1 weight  0.11000E+01 volume  0.23152E-03 ppm1      3.880 ppm2      4.846 CV     1
 ASSI { 4084}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name HA  ))
      4.300     2.300     1.700 peak  4084 spectrum    1 weight  0.11000E+01 volume  0.59630E-03 ppm1      3.885 ppm2      4.196 CV     1
 ASSI { 4085}
   (( segid "    " and resid 127  and name HD1 ))
   (( segid "    " and resid 126  and name HA  ))
      1.900     0.500     0.500 peak  4085 spectrum    1 weight  0.11000E+01 volume  0.80394E-02 ppm1      3.481 ppm2      4.141 CV     1
 ASSI { 4087}
   (( segid "    " and resid 51   and name HD1 ))
   (( segid "    " and resid 53   and name HN  ))
      5.100     3.300     0.900 peak  4087 spectrum    1 weight  0.11000E+01 volume  0.31925E-03 ppm1      3.386 ppm2      7.190 CV     1
 ASSI { 4090}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 127  and name HG1 ))
      5.500     3.800     0.500 peak  4090 spectrum    1 weight  0.11000E+01 volume  0.35542E-03 ppm1      3.891 ppm2      1.543 CV     1
 ASSI { 4093}
   (( segid "    " and resid 123  and name HD1 ))
   (( segid "    " and resid 122  and name HB2 ))
      3.900     1.900     1.900 peak  4093 spectrum    1 weight  0.11000E+01 volume  0.18531E-02 ppm1      3.308 ppm2      1.669 CV     1
 ASSI { 4095}
   (( segid "    " and resid 82   and name HD1 ))
   (( segid "    " and resid 81   and name HB2 ))
      4.200     2.200     1.800 peak  4095 spectrum    1 weight  0.11000E+01 volume  0.20340E-02 ppm1      3.339 ppm2      1.547 CV     1
 ASSI { 4098}
   (( segid "    " and resid 69   and name HA1 ))
   (( segid "    " and resid 69   and name HA2 ))
      2.100     0.500     0.500 peak  4098 spectrum    1 weight  0.11000E+01 volume  0.29114E-02 ppm1      3.578 ppm2      3.798 CV     1
 ASSI { 4102}
   (( segid "    " and resid 69   and name HA2 ))
   (( segid "    " and resid 73   and name HD1 ))
      3.600     1.700     1.700 peak  4102 spectrum    1 weight  0.11000E+01 volume  0.80105E-03 ppm1      3.792 ppm2      1.299 CV     1
 ASSI { 4103}
   (( segid "    " and resid 69   and name HA2 ))
   (  segid "    " and resid 100  and name HD1%)
      4.400     4.400     1.600 peak  4103 spectrum    1 weight  0.11000E+01 volume  0.15336E-02 ppm1      3.781 ppm2      0.818 CV     1
 ASSI { 4105}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HD1 ))
      1.800     0.400     0.400 peak  4105 spectrum    1 weight  0.11000E+01 volume  0.81681E-02 ppm1      2.168 ppm2      1.945 CV     1
 ASSI { 4109}
   (( segid "    " and resid 133  and name HD1 ))
   (( segid "    " and resid 44   and name HH2 ))
      3.000     3.000     3.000 peak  4109 spectrum    1 weight  0.11000E+01 volume  0.71236E-03 ppm1      1.959 ppm2      7.306 CV     1
 ASSI { 4110}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 134  and name HN  ))
      4.100     2.100     1.900 peak  4110 spectrum    1 weight  0.11000E+01 volume  0.19231E-03 ppm1      2.135 ppm2      9.233 CV     1
 ASSI { 4112}
   (( segid "    " and resid 133  and name HD1 ))
   (( segid "    " and resid 133  and name HG1 ))
      2.600     0.900     0.900 peak  4112 spectrum    1 weight  0.11000E+01 volume  0.20615E-02 ppm1      1.966 ppm2      1.517 CV     1
 ASSI { 4115}
   (( segid "    " and resid 47   and name HA1 ))
   (  segid "    " and resid 46   and name HG2%)
      5.600     5.600     0.400 peak  4115 spectrum    1 weight  0.11000E+01 volume  0.27671E-03 ppm1      3.580 ppm2      0.511 CV     1
 ASSI { 4116}
   (( segid "    " and resid 47   and name HA2 ))
   (( segid "    " and resid 50   and name HD1 ))
      3.700     1.700     1.700 peak  4116 spectrum    1 weight  0.11000E+01 volume  0.10262E-02 ppm1      4.145 ppm2      1.661 CV     1
 ASSI { 4117}
   (( segid "    " and resid 47   and name HA2 ))
   (( segid "    " and resid 50   and name HG2 ))
      4.400     2.400     1.600 peak  4117 spectrum    1 weight  0.11000E+01 volume  0.12013E-02 ppm1      4.142 ppm2      1.824 CV     1
 ASSI { 4119}
   (( segid "    " and resid 99   and name HA2 ))
   (( segid "    " and resid 90   and name HZ2 ))
      2.800     1.000     1.000 peak  4119 spectrum    1 weight  0.11000E+01 volume  0.13672E-02 ppm1      4.314 ppm2      7.179 CV     1
 ASSI { 4120}
   (( segid "    " and resid 99   and name HA2 ))
   (( segid "    " and resid 90   and name HH2 ))
      6.000     6.000     0.000 peak  4120 spectrum    1 weight  0.11000E+01 volume  0.10127E-04 ppm1      4.316 ppm2      6.799 CV     1
 ASSI { 4126}
   (( segid "    " and resid 99   and name HA1 ))
   (( segid "    " and resid 90   and name HZ2 ))
      4.400     2.400     1.600 peak  4126 spectrum    1 weight  0.11000E+01 volume  0.17333E-02 ppm1      3.836 ppm2      7.179 CV     1
 ASSI { 4128}
   (( segid "    " and resid 99   and name HA2 ))
   (( segid "    " and resid 90   and name HE1 ))
      3.800     1.800     1.800 peak  4128 spectrum    1 weight  0.11000E+01 volume  0.89389E-03 ppm1      4.322 ppm2     10.579 CV     1
 ASSI { 4130}
   (( segid "    " and resid 99   and name HA1 ))
   (( segid "    " and resid 90   and name HE1 ))
      4.800     2.900     1.200 peak  4130 spectrum    1 weight  0.11000E+01 volume  0.10811E-02 ppm1      3.835 ppm2     10.579 CV     1
 ASSI { 4131}
   (( segid "    " and resid 99   and name HA1 ))
   (( segid "    " and resid 90   and name HH2 ))
      6.000     4.700     0.000 peak  4131 spectrum    1 weight  0.11000E+01 volume  0.22184E-03 ppm1      3.824 ppm2      6.807 CV     1
 ASSI { 4132}
   (( segid "    " and resid 99   and name HA2 ))
   (  segid "    " and resid 100  and name HD1%)
      5.100     5.100     0.900 peak  4132 spectrum    1 weight  0.11000E+01 volume  0.61971E-03 ppm1      4.314 ppm2      0.812 CV     1
 ASSI { 4133}
   (( segid "    " and resid 99   and name HA2 ))
   (( segid "    " and resid 100  and name HG  ))
      5.000     3.200     1.000 peak  4133 spectrum    1 weight  0.11000E+01 volume  0.35389E-03 ppm1      4.313 ppm2      1.531 CV     1
 ASSI { 4136}
   (( segid "    " and resid 99   and name HA1 ))
   (( segid "    " and resid 100  and name HB1 ))
      4.100     2.100     1.900 peak  4136 spectrum    1 weight  0.11000E+01 volume  0.45916E-03 ppm1      3.836 ppm2      1.548 CV     1
 ASSI { 4138}
   (( segid "    " and resid 99   and name HA1 ))
   (  segid "    " and resid 100  and name HD1%)
      4.700     2.800     1.300 peak  4138 spectrum    1 weight  0.11000E+01 volume  0.75259E-03 ppm1      3.831 ppm2      0.802 CV     1
 ASSI { 4139}
   (( segid "    " and resid 65   and name HA1 ))
   (( segid "    " and resid 57   and name HZ  ))
      4.400     2.400     1.600 peak  4139 spectrum    1 weight  0.11000E+01 volume  0.51343E-03 ppm1      3.761 ppm2      6.807 CV     1
 ASSI { 4140}
   (( segid "    " and resid 65   and name HA2 ))
   (( segid "    " and resid 57   and name HZ  ))
      4.000     2.000     2.000 peak  4140 spectrum    1 weight  0.11000E+01 volume  0.22378E-03 ppm1      4.257 ppm2      6.850 CV     1
 ASSI { 4142}
   (( segid "    " and resid 100  and name HB2 ))
   (  segid "    " and resid 100  and name HD2%)
      3.400     1.500     1.500 peak  4142 spectrum    1 weight  0.11000E+01 volume  0.13517E-02 ppm1      1.641 ppm2      0.845 CV     1
 ASSI { 4144}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 66   and name HG1 ))
      3.600     1.600     1.600 peak  4144 spectrum    1 weight  0.11000E+01 volume  0.28057E-02 ppm1      1.537 ppm2      1.292 CV     1
 ASSI { 4145}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 66   and name HG1 ))
      2.700     0.900     0.900 peak  4145 spectrum    1 weight  0.11000E+01 volume  0.37520E-02 ppm1      1.640 ppm2      1.345 CV     1
 ASSI { 4147}
   (( segid "    " and resid 87   and name HA1 ))
   (( segid "    " and resid 90   and name HB1 ))
      3.100     1.200     1.200 peak  4147 spectrum    1 weight  0.11000E+01 volume  0.66832E-02 ppm1      3.900 ppm2      3.277 CV     1
 ASSI { 4150}
   (( segid "    " and resid 119  and name HA1 ))
   (( segid "    " and resid 121  and name HN  ))
      6.000     6.000     0.000 peak  4150 spectrum    1 weight  0.11000E+01 volume  0.17427E-04 ppm1      3.643 ppm2      8.379 CV     1
 ASSI { 4151}
   (( segid "    " and resid 119  and name HA2 ))
   (( segid "    " and resid 118  and name HB2 ))
      4.500     2.600     1.500 peak  4151 spectrum    1 weight  0.11000E+01 volume  0.84239E-03 ppm1      4.127 ppm2      2.170 CV     1
 ASSI { 4160}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 125  and name HN  ))
      3.100     1.200     1.200 peak  4160 spectrum    1 weight  0.11000E+01 volume  0.14183E-02 ppm1      2.329 ppm2      7.547 CV     1
 ASSI { 4161}
   (( segid "    " and resid 125  and name HB2 ))
   (  segid "    " and resid 92   and name HD2%)
      5.200     5.200     0.800 peak  4161 spectrum    1 weight  0.11000E+01 volume  0.39810E-03 ppm1      2.487 ppm2      0.660 CV     1
 ASSI { 4163}
   (( segid "    " and resid 125  and name HB2 ))
   (  segid "    " and resid 124  and name HB% )
      3.300     3.300     2.700 peak  4163 spectrum    1 weight  0.11000E+01 volume  0.40085E-03 ppm1      2.496 ppm2      1.378 CV     1
 ASSI { 4164}
   (( segid "    " and resid 125  and name HB1 ))
   (  segid "    " and resid 124  and name HB% )
      3.100     3.100     2.900 peak  4164 spectrum    1 weight  0.11000E+01 volume  0.51637E-03 ppm1      2.327 ppm2      1.380 CV     1
 ASSI { 4166}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 124  and name HA  ))
      3.900     1.900     1.900 peak  4166 spectrum    1 weight  0.11000E+01 volume  0.14601E-03 ppm1      2.491 ppm2      4.097 CV     1
 ASSI { 4170}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 127  and name HG1 ))
      3.200     3.200     2.800 peak  4170 spectrum    1 weight  0.11000E+01 volume  0.89057E-03 ppm1      2.329 ppm2      1.597 CV     1
 ASSI { 4172}
   (( segid "    " and resid 125  and name HB1 ))
   (  segid "    " and resid 126  and name HD1%)
      6.000     6.000     0.000 peak  4172 spectrum    1 weight  0.11000E+01 volume  0.10695E-03 ppm1      2.334 ppm2      0.824 CV     1
 ASSI { 4175}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HH21))
      4.300     2.300     1.700 peak  4175 spectrum    1 weight  0.11000E+01 volume  0.12508E-02 ppm1      2.957 ppm2      6.386 CV     1
 ASSI { 4177}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HA  ))
      6.000     4.600     0.000 peak  4177 spectrum    1 weight  0.11000E+01 volume  0.17512E-03 ppm1      2.960 ppm2      4.117 CV     1
 ASSI { 4179}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HN  ))
      3.800     1.800     1.800 peak  4179 spectrum    1 weight  0.11000E+01 volume  0.86407E-03 ppm1      2.308 ppm2      7.222 CV     1
 ASSI { 4180}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 111  and name HE1 ))
      3.300     3.300     2.700 peak  4180 spectrum    1 weight  0.11000E+01 volume  0.25591E-02 ppm1      2.298 ppm2      7.561 CV     1
 ASSI { 4181}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 111  and name HA  ))
      4.800     2.800     1.200 peak  4181 spectrum    1 weight  0.11000E+01 volume  0.39590E-03 ppm1      2.326 ppm2      4.093 CV     1
 ASSI { 4182}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 48   and name HD2 ))
      6.000     6.000     0.000 peak  4182 spectrum    1 weight  0.11000E+01 volume  0.14880E-03 ppm1      2.335 ppm2      1.699 CV     1
 ASSI { 4183}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 48   and name HG1 ))
      3.300     1.400     1.400 peak  4183 spectrum    1 weight  0.11000E+01 volume  0.41827E-03 ppm1      2.334 ppm2      1.384 CV     1
 ASSI { 4185}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 93   and name HN  ))
      3.900     1.900     1.900 peak  4185 spectrum    1 weight  0.11000E+01 volume  0.36311E-03 ppm1      1.076 ppm2      8.064 CV     1
 ASSI { 4186}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 89   and name HN  ))
      4.700     2.800     1.300 peak  4186 spectrum    1 weight  0.11000E+01 volume  0.49826E-03 ppm1      1.058 ppm2      8.197 CV     1
 ASSI { 4189}
   (( segid "    " and resid 92   and name HB1 ))
   (( segid "    " and resid 92   and name HG  ))
      2.800     1.000     1.000 peak  4189 spectrum    1 weight  0.11000E+01 volume  0.11581E-02 ppm1      1.072 ppm2      1.796 CV     1
 ASSI { 4190}
   (( segid "    " and resid 92   and name HB2 ))
   (  segid "    " and resid 112  and name HD2%)
      3.600     3.600     2.400 peak  4190 spectrum    1 weight  0.11000E+01 volume  0.45339E-02 ppm1      1.933 ppm2      0.675 CV     1
 ASSI { 4191}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 126  and name HB2 ))
      3.700     3.700     2.300 peak  4191 spectrum    1 weight  0.11000E+01 volume  0.16832E-02 ppm1      1.942 ppm2      1.595 CV     1
 ASSI { 4193}
   (( segid "    " and resid 101  and name HB1 ))
   (  segid "    " and resid 67   and name HD1%)
      4.100     2.100     1.900 peak  4193 spectrum    1 weight  0.11000E+01 volume  0.40635E-03 ppm1      1.581 ppm2      0.450 CV     1
 ASSI { 4194}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 105  and name HG1 ))
      5.900     4.400     0.100 peak  4194 spectrum    1 weight  0.11000E+01 volume  0.70330E-03 ppm1      1.871 ppm2      2.280 CV     1
 ASSI { 4195}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HB1 ))
      1.700     0.400     0.500 peak  4195 spectrum    1 weight  0.11000E+01 volume  0.47923E-02 ppm1      1.879 ppm2      1.561 CV     1
 ASSI { 4196}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 105  and name HG1 ))
      6.000     6.000     0.000 peak  4196 spectrum    1 weight  0.11000E+01 volume  0.18516E-04 ppm1      1.603 ppm2      2.254 CV     1
 ASSI { 4197}
   (( segid "    " and resid 101  and name HB1 ))
   (  segid "    " and resid 109  and name HB% )
      6.000     4.700     0.000 peak  4197 spectrum    1 weight  0.11000E+01 volume  0.42949E-04 ppm1      1.594 ppm2      1.197 CV     1
 ASSI { 4198}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 105  and name HB2 ))
      5.200     3.400     0.800 peak  4198 spectrum    1 weight  0.11000E+01 volume  0.51690E-03 ppm1      1.857 ppm2      2.503 CV     1
 ASSI { 4199}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 106  and name HB2 ))
      4.400     2.400     1.600 peak  4199 spectrum    1 weight  0.11000E+01 volume  0.16361E-03 ppm1      1.863 ppm2      3.199 CV     1
 ASSI { 4200}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 106  and name HA  ))
      5.100     3.200     0.900 peak  4200 spectrum    1 weight  0.11000E+01 volume  0.10750E-03 ppm1      1.861 ppm2      4.241 CV     1
 ASSI { 4201}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 44   and name HZ2 ))
      6.000     4.700     0.000 peak  4201 spectrum    1 weight  0.11000E+01 volume  0.35501E-04 ppm1      1.450 ppm2      7.236 CV     1
 ASSI { 4204}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 129  and name HB2 ))
      4.700     2.700     1.300 peak  4204 spectrum    1 weight  0.11000E+01 volume  0.14704E-03 ppm1      1.683 ppm2      3.478 CV     1
 ASSI { 4205}
   (( segid "    " and resid 108  and name HB2 ))
   (  segid "    " and resid 112  and name HD1%)
      6.000     6.000     0.000 peak  4205 spectrum    1 weight  0.11000E+01 volume  0.34382E-04 ppm1      2.587 ppm2      0.815 CV     1
 ASSI { 4206}
   (( segid "    " and resid 108  and name HB2 ))
   (  segid "    " and resid 46   and name HG2%)
      5.200     3.300     0.800 peak  4206 spectrum    1 weight  0.11000E+01 volume  0.14165E-03 ppm1      2.588 ppm2      0.498 CV     1
 ASSI { 4207}
   (( segid "    " and resid 108  and name HB2 ))
   (  segid "    " and resid 46   and name HG1%)
      4.900     3.000     1.100 peak  4207 spectrum    1 weight  0.11000E+01 volume  0.15967E-03 ppm1      2.584 ppm2     -0.209 CV     1
 ASSI { 4209}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 116  and name HN  ))
      5.400     3.600     0.600 peak  4209 spectrum    1 weight  0.11000E+01 volume  0.72267E-04 ppm1      1.072 ppm2      7.844 CV     1
 ASSI { 4210}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 116  and name HN  ))
      4.500     2.500     1.500 peak  4210 spectrum    1 weight  0.11000E+01 volume  0.51425E-03 ppm1      2.037 ppm2      7.845 CV     1
 ASSI { 4211}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 109  and name HA  ))
      4.700     2.700     1.300 peak  4211 spectrum    1 weight  0.11000E+01 volume  0.51926E-03 ppm1      1.094 ppm2      3.633 CV     1
 ASSI { 4215}
   (( segid "    " and resid 117  and name HB2 ))
   (  segid "    " and resid 117  and name HD1%)
      2.300     2.300     3.700 peak  4215 spectrum    1 weight  0.11000E+01 volume  0.92685E-02 ppm1      2.045 ppm2      0.849 CV     1
 ASSI { 4217}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 113  and name HA  ))
      5.400     3.600     0.600 peak  4217 spectrum    1 weight  0.11000E+01 volume  0.10960E-03 ppm1      2.023 ppm2      3.298 CV     1
 ASSI { 4218}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 89   and name HB  ))
      2.100     2.100     3.900 peak  4218 spectrum    1 weight  0.11000E+01 volume  0.48949E-02 ppm1      2.037 ppm2      1.836 CV     1
 ASSI { 4219}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 119  and name HN  ))
      4.700     2.700     1.300 peak  4219 spectrum    1 weight  0.11000E+01 volume  0.46319E-03 ppm1      2.051 ppm2      7.898 CV     1
 ASSI { 4220}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 118  and name HN  ))
      5.000     3.100     1.000 peak  4220 spectrum    1 weight  0.11000E+01 volume  0.21630E-03 ppm1      2.054 ppm2      7.746 CV     1
 ASSI { 4224}
   (( segid "    " and resid 117  and name HB1 ))
   (  segid "    " and resid 117  and name HD1%)
      2.400     0.700     0.700 peak  4224 spectrum    1 weight  0.11000E+01 volume  0.17221E-01 ppm1      1.438 ppm2      0.881 CV     1
 ASSI { 4226}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 86   and name HN  ))
      5.800     4.200     0.200 peak  4226 spectrum    1 weight  0.11000E+01 volume  0.50601E-04 ppm1      1.051 ppm2      8.029 CV     1
 ASSI { 4228}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 82   and name HD2 ))
      3.800     1.800     1.800 peak  4228 spectrum    1 weight  0.11000E+01 volume  0.10945E-02 ppm1      1.551 ppm2      3.983 CV     1
 ASSI { 4229}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HA  ))
      4.900     3.000     1.100 peak  4229 spectrum    1 weight  0.11000E+01 volume  0.13986E-03 ppm1      1.553 ppm2      4.488 CV     1
 ASSI { 4230}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 82   and name HD2 ))
      2.400     0.700     0.700 peak  4230 spectrum    1 weight  0.11000E+01 volume  0.10963E-02 ppm1      1.047 ppm2      3.958 CV     1
 ASSI { 4233}
   (( segid "    " and resid 81   and name HB2 ))
   (  segid "    " and resid 81   and name HD2%)
      2.400     2.400     3.600 peak  4233 spectrum    1 weight  0.11000E+01 volume  0.21944E-01 ppm1      1.546 ppm2      0.900 CV     1
 ASSI { 4235}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 81   and name HB2 ))
      1.700     0.300     0.500 peak  4235 spectrum    1 weight  0.11000E+01 volume  0.70292E-02 ppm1      1.058 ppm2      1.559 CV     1
 ASSI { 4238}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 73   and name HE1 ))
      3.400     1.500     1.500 peak  4238 spectrum    1 weight  0.11000E+01 volume  0.10655E-02 ppm1      1.158 ppm2      2.087 CV     1
 ASSI { 4239}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HG1 ))
      3.500     1.600     1.600 peak  4239 spectrum    1 weight  0.11000E+01 volume  0.65455E-03 ppm1      3.920 ppm2      1.114 CV     1
 ASSI { 4242}
   (( segid "    " and resid 73   and name HE2 ))
   (( segid "    " and resid 73   and name HA  ))
      4.200     2.200     1.800 peak  4242 spectrum    1 weight  0.11000E+01 volume  0.39545E-03 ppm1      2.288 ppm2      3.904 CV     1
 ASSI { 4244}
   (( segid "    " and resid 73   and name HE2 ))
   (( segid "    " and resid 73   and name HG1 ))
      2.900     1.100     1.100 peak  4244 spectrum    1 weight  0.11000E+01 volume  0.19814E-02 ppm1      2.278 ppm2      1.115 CV     1
 ASSI { 4245}
   (( segid "    " and resid 73   and name HE2 ))
   (( segid "    " and resid 73   and name HD2 ))
      2.400     0.700     0.700 peak  4245 spectrum    1 weight  0.11000E+01 volume  0.55087E-02 ppm1      2.284 ppm2      1.285 CV     1
 ASSI { 4246}
   (( segid "    " and resid 73   and name HE2 ))
   (  segid "    " and resid 86   and name HD2%)
      5.300     3.600     0.700 peak  4246 spectrum    1 weight  0.11000E+01 volume  0.11275E-03 ppm1      2.288 ppm2      0.721 CV     1
 ASSI { 4250}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 102  and name HN  ))
      4.200     2.200     1.800 peak  4250 spectrum    1 weight  0.11000E+01 volume  0.93610E-04 ppm1      2.573 ppm2      9.116 CV     1
 ASSI { 4252}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 101  and name HA  ))
      6.000     6.000     0.000 peak  4252 spectrum    1 weight  0.11000E+01 volume  0.14130E-05 ppm1      3.272 ppm2      5.806 CV     1
 ASSI { 4255}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 103  and name HB2 ))
      6.000     6.000     0.000 peak  4255 spectrum    1 weight  0.11000E+01 volume  0.18280E-04 ppm1      3.288 ppm2      2.095 CV     1
 ASSI { 4256}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 67   and name HN  ))
      5.300     3.500     0.700 peak  4256 spectrum    1 weight  0.11000E+01 volume  0.92844E-04 ppm1      1.790 ppm2      9.298 CV     1
 ASSI { 4258}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 88   and name HN  ))
      4.400     2.500     1.600 peak  4258 spectrum    1 weight  0.11000E+01 volume  0.73519E-03 ppm1      1.766 ppm2      7.272 CV     1
 ASSI { 4260}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 71   and name HN  ))
      5.500     3.800     0.500 peak  4260 spectrum    1 weight  0.11000E+01 volume  0.88927E-04 ppm1      1.792 ppm2      7.615 CV     1
 ASSI { 4261}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 73   and name HN  ))
      5.000     3.200     1.000 peak  4261 spectrum    1 weight  0.11000E+01 volume  0.29361E-03 ppm1      1.780 ppm2      8.744 CV     1
 ASSI { 4263}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 71   and name HB1 ))
      5.600     4.000     0.400 peak  4263 spectrum    1 weight  0.11000E+01 volume  0.90989E-04 ppm1      1.769 ppm2      2.529 CV     1
 ASSI { 4265}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 90   and name HN  ))
      5.300     3.500     0.700 peak  4265 spectrum    1 weight  0.11000E+01 volume  0.10180E-03 ppm1      1.162 ppm2      8.735 CV     1
 ASSI { 4266}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 90   and name HN  ))
      6.000     5.000     0.000 peak  4266 spectrum    1 weight  0.11000E+01 volume  0.72209E-04 ppm1      1.777 ppm2      8.736 CV     1
 ASSI { 4267}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      3.500     1.600     1.600 peak  4267 spectrum    1 weight  0.11000E+01 volume  0.55414E-03 ppm1      1.161 ppm2      8.545 CV     1
 ASSI { 4268}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 87   and name HN  ))
      6.000     5.000     0.000 peak  4268 spectrum    1 weight  0.11000E+01 volume  0.14218E-04 ppm1      1.767 ppm2      8.539 CV     1
 ASSI { 4270}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HG  ))
      2.700     2.700     3.300 peak  4270 spectrum    1 weight  0.11000E+01 volume  0.24838E-02 ppm1      1.757 ppm2      1.606 CV     1
 ASSI { 4271}
   (  segid "    " and resid 46   and name HG1%)
   (  segid "    " and resid 53   and name HD% )
      6.000     6.000     0.000 peak  4271 spectrum    1 weight  0.11000E+01 volume  0.88604E-05 ppm1     -0.196 ppm2      6.749 CV     1
 ASSI { 4272}
   (  segid "    " and resid 46   and name HG1%)
   (( segid "    " and resid 46   and name HN  ))
      4.300     2.300     1.700 peak  4272 spectrum    1 weight  0.11000E+01 volume  0.36926E-03 ppm1     -0.197 ppm2      9.283 CV     1
 ASSI { 4279}
   (( segid "    " and resid 98   and name HB1 ))
   (  segid "    " and resid 100  and name HD1%)
      4.600     2.700     1.400 peak  4279 spectrum    1 weight  0.11000E+01 volume  0.38745E-03 ppm1      2.435 ppm2      0.814 CV     1
 ASSI { 4280}
   (( segid "    " and resid 98   and name HB1 ))
   (( segid "    " and resid 100  and name HG  ))
      5.500     3.800     0.500 peak  4280 spectrum    1 weight  0.11000E+01 volume  0.97083E-04 ppm1      2.429 ppm2      1.507 CV     1
 ASSI { 4283}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HA  ))
      3.700     1.700     1.700 peak  4283 spectrum    1 weight  0.11000E+01 volume  0.76140E-03 ppm1      2.662 ppm2      4.589 CV     1
 ASSI { 4286}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 21   and name HA2 ))
      4.700     2.800     1.300 peak  4286 spectrum    1 weight  0.11000E+01 volume  0.38277E-03 ppm1      2.655 ppm2      3.895 CV     1
 ASSI { 4288}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 102  and name HB2 ))
      2.000     0.500     0.500 peak  4288 spectrum    1 weight  0.11000E+01 volume  0.39791E-02 ppm1      2.569 ppm2      3.275 CV     1
 ASSI { 4289}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 66   and name HD2 ))
      6.000     6.000     0.000 peak  4289 spectrum    1 weight  0.11000E+01 volume  0.11275E-04 ppm1      2.574 ppm2      1.759 CV     1
 ASSI { 4291}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 42   and name HG2%)
      4.100     4.100     1.900 peak  4291 spectrum    1 weight  0.11000E+01 volume  0.83444E-03 ppm1      2.557 ppm2      0.872 CV     1
 ASSI { 4292}
   (( segid "    " and resid 41   and name HB2 ))
   (  segid "    " and resid 42   and name HG2%)
      4.500     2.500     1.500 peak  4292 spectrum    1 weight  0.11000E+01 volume  0.90035E-03 ppm1      2.662 ppm2      0.877 CV     1
 ASSI { 4295}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 53   and name HB1 ))
      2.600     2.600     3.400 peak  4295 spectrum    1 weight  0.11000E+01 volume  0.18098E-01 ppm1      2.894 ppm2      3.160 CV     1
 ASSI { 4296}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 53   and name HB2 ))
      4.700     2.800     1.300 peak  4296 spectrum    1 weight  0.11000E+01 volume  0.37373E-03 ppm1      2.801 ppm2      3.233 CV     1
 ASSI { 4297}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 53   and name HB2 ))
      2.500     2.500     3.500 peak  4297 spectrum    1 weight  0.11000E+01 volume  0.63985E-02 ppm1      2.895 ppm2      3.259 CV     1
 ASSI { 4298}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 67   and name HN  ))
      6.000     5.800     0.000 peak  4298 spectrum    1 weight  0.11000E+01 volume  0.10362E-03 ppm1      2.996 ppm2      9.318 CV     1
 ASSI { 4300}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 107  and name HN  ))
      6.000     5.000     0.000 peak  4300 spectrum    1 weight  0.11000E+01 volume  0.55400E-04 ppm1      3.264 ppm2      7.991 CV     1
 ASSI { 4301}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 58   and name HN  ))
      6.000     6.000     0.000 peak  4301 spectrum    1 weight  0.11000E+01 volume  0.36413E-04 ppm1      3.259 ppm2      7.811 CV     1
 ASSI { 4302}
   (( segid "    " and resid 57   and name HB2 ))
   (  segid "    " and resid 106  and name HD% )
      3.400     1.400     1.400 peak  4302 spectrum    1 weight  0.11000E+01 volume  0.38630E-03 ppm1      3.264 ppm2      7.443 CV     1
 ASSI { 4303}
   (( segid "    " and resid 57   and name HB2 ))
   (  segid "    " and resid 106  and name HE% )
      3.900     1.900     1.900 peak  4303 spectrum    1 weight  0.11000E+01 volume  0.71058E-03 ppm1      3.263 ppm2      5.927 CV     1
 ASSI { 4304}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 106  and name HE% )
      6.000     6.000     0.000 peak  4304 spectrum    1 weight  0.11000E+01 volume  0.14336E-04 ppm1      3.072 ppm2      5.923 CV     1
 ASSI { 4306}
   (( segid "    " and resid 57   and name HB2 ))
   (  segid "    " and resid 67   and name HD1%)
      5.000     3.100     1.000 peak  4306 spectrum    1 weight  0.11000E+01 volume  0.29093E-03 ppm1      3.241 ppm2      0.453 CV     1
 ASSI { 4308}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 67   and name HD1%)
      5.400     5.400     0.600 peak  4308 spectrum    1 weight  0.11000E+01 volume  0.71684E-03 ppm1      3.068 ppm2      0.459 CV     1
 ASSI { 4329}
   (( segid "    " and resid 56   and name HB  ))
   (( segid "    " and resid 57   and name HA  ))
      4.000     2.000     2.000 peak  4329 spectrum    1 weight  0.11000E+01 volume  0.52745E-03 ppm1      2.395 ppm2      3.116 CV     1
 ASSI { 4334}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 62   and name HD1 ))
      6.000     6.000     0.000 peak  4334 spectrum    1 weight  0.11000E+01 volume  0.30379E-04 ppm1      1.301 ppm2      3.072 CV     1
 ASSI { 4336}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 62   and name HD1 ))
      4.800     2.900     1.200 peak  4336 spectrum    1 weight  0.11000E+01 volume  0.11890E-03 ppm1      1.497 ppm2      3.081 CV     1
 ASSI { 4337}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 60   and name HD2%)
      3.800     1.800     1.800 peak  4337 spectrum    1 weight  0.11000E+01 volume  0.17931E-02 ppm1      1.495 ppm2      0.675 CV     1
 ASSI { 4338}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 60   and name HD1%)
      2.700     0.900     0.900 peak  4338 spectrum    1 weight  0.11000E+01 volume  0.24783E-02 ppm1      1.486 ppm2      0.457 CV     1
 ASSI { 4339}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 67   and name HG2%)
      3.600     1.600     1.600 peak  4339 spectrum    1 weight  0.11000E+01 volume  0.64688E-03 ppm1      1.299 ppm2     -0.047 CV     1
 ASSI { 4340}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 60   and name HD1%)
      2.700     0.900     0.900 peak  4340 spectrum    1 weight  0.11000E+01 volume  0.22957E-02 ppm1      1.299 ppm2      0.457 CV     1
 ASSI { 4342}
   (( segid "    " and resid 56   and name HG11))
   (( segid "    " and resid 55   and name HG2 ))
      4.600     2.600     1.400 peak  4342 spectrum    1 weight  0.11000E+01 volume  0.20447E-03 ppm1      1.297 ppm2      2.528 CV     1
 ASSI { 4343}
   (( segid "    " and resid 110  and name HB1 ))
   (( segid "    " and resid 110  and name HD21))
      3.300     1.400     1.400 peak  4343 spectrum    1 weight  0.11000E+01 volume  0.65031E-03 ppm1      1.222 ppm2      5.710 CV     1
 ASSI { 4344}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      6.000     5.200     0.000 peak  4344 spectrum    1 weight  0.11000E+01 volume  0.12249E-03 ppm1      1.708 ppm2      8.789 CV     1
 ASSI { 4353}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 55   and name HA  ))
      3.000     1.100     1.100 peak  4353 spectrum    1 weight  0.11000E+01 volume  0.12687E-02 ppm1      3.378 ppm2      4.104 CV     1
 ASSI { 4356}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 72   and name HN  ))
      3.300     1.300     1.300 peak  4356 spectrum    1 weight  0.11000E+01 volume  0.82317E-03 ppm1      2.854 ppm2      8.874 CV     1
 ASSI { 4357}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
      5.300     3.500     0.700 peak  4357 spectrum    1 weight  0.11000E+01 volume  0.17441E-03 ppm1      2.817 ppm2      8.800 CV     1
 ASSI { 4360}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 60   and name HB1 ))
      3.100     1.200     1.200 peak  4360 spectrum    1 weight  0.11000E+01 volume  0.13626E-02 ppm1      2.846 ppm2      1.300 CV     1
 ASSI { 4361}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 60   and name HB2 ))
      4.800     2.800     1.200 peak  4361 spectrum    1 weight  0.11000E+01 volume  0.35801E-03 ppm1      2.847 ppm2      1.503 CV     1
 ASSI { 4366}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      5.900     4.300     0.100 peak  4366 spectrum    1 weight  0.11000E+01 volume  0.60112E-04 ppm1      3.110 ppm2      8.756 CV     1
 ASSI { 4367}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 66   and name HN  ))
      5.100     3.300     0.900 peak  4367 spectrum    1 weight  0.11000E+01 volume  0.24986E-03 ppm1      2.796 ppm2      7.592 CV     1
 ASSI { 4369}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 85   and name HN  ))
      6.000     6.000     0.000 peak  4369 spectrum    1 weight  0.11000E+01 volume  0.31203E-05 ppm1      2.793 ppm2      6.861 CV     1
 ASSI { 4371}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 66   and name HG1 ))
      6.000     6.000     0.000 peak  4371 spectrum    1 weight  0.11000E+01 volume  0.52369E-04 ppm1      3.098 ppm2      1.291 CV     1
 ASSI { 4372}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 109  and name HN  ))
      5.700     4.000     0.300 peak  4372 spectrum    1 weight  0.11000E+01 volume  0.17179E-03 ppm1      2.301 ppm2      8.700 CV     1
 ASSI { 4373}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 106  and name HN  ))
      6.000     4.800     0.000 peak  4373 spectrum    1 weight  0.11000E+01 volume  0.11021E-03 ppm1      2.319 ppm2      9.524 CV     1
 ASSI { 4375}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 101  and name HA  ))
      6.000     5.100     0.000 peak  4375 spectrum    1 weight  0.11000E+01 volume  0.97083E-04 ppm1      2.297 ppm2      5.852 CV     1
 ASSI { 4376}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HA  ))
      3.000     1.100     1.100 peak  4376 spectrum    1 weight  0.11000E+01 volume  0.28003E-02 ppm1      2.897 ppm2      4.002 CV     1
 ASSI { 4377}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 94   and name HA  ))
      3.300     1.400     1.400 peak  4377 spectrum    1 weight  0.11000E+01 volume  0.36228E-03 ppm1      2.900 ppm2      4.482 CV     1
 ASSI { 4378}
   (( segid "    " and resid 105  and name HG2 ))
   (  segid "    " and resid 95   and name HG2%)
      4.000     2.000     2.000 peak  4378 spectrum    1 weight  0.11000E+01 volume  0.99627E-03 ppm1      2.912 ppm2      1.075 CV     1
 ASSI { 4379}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 132  and name HB1 ))
      3.300     1.400     1.400 peak  4379 spectrum    1 weight  0.11000E+01 volume  0.29207E-02 ppm1      2.902 ppm2      1.401 CV     1
 ASSI { 4380}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 101  and name HB2 ))
      4.400     2.400     1.600 peak  4380 spectrum    1 weight  0.11000E+01 volume  0.16889E-02 ppm1      2.912 ppm2      1.805 CV     1
 ASSI { 4383}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 52   and name HN  ))
      5.500     3.800     0.500 peak  4383 spectrum    1 weight  0.11000E+01 volume  0.16979E-03 ppm1      3.242 ppm2      7.389 CV     1
 ASSI { 4386}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 54   and name HN  ))
      4.800     2.900     1.200 peak  4386 spectrum    1 weight  0.11000E+01 volume  0.51839E-04 ppm1      3.241 ppm2      9.670 CV     1
 ASSI { 4389}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 98   and name HN  ))
      4.400     2.400     1.600 peak  4389 spectrum    1 weight  0.11000E+01 volume  0.35583E-03 ppm1      1.200 ppm2      8.424 CV     1
 ASSI { 4390}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 95   and name HN  ))
      4.900     3.000     1.100 peak  4390 spectrum    1 weight  0.11000E+01 volume  0.41006E-03 ppm1      1.171 ppm2      8.221 CV     1
 ASSI { 4393}
   (( segid "    " and resid 55   and name HG2 ))
   (  segid "    " and resid 56   and name HD1%)
      5.700     4.100     0.300 peak  4393 spectrum    1 weight  0.11000E+01 volume  0.23950E-03 ppm1      2.579 ppm2      1.116 CV     1
 ASSI { 4394}
   (( segid "    " and resid 118  and name HG1 ))
   (( segid "    " and resid 119  and name HN  ))
      4.200     2.200     1.800 peak  4394 spectrum    1 weight  0.11000E+01 volume  0.99290E-03 ppm1      2.235 ppm2      7.894 CV     1
 ASSI { 4395}
   (( segid "    " and resid 118  and name HG1 ))
   (( segid "    " and resid 118  and name HN  ))
      2.900     1.100     1.100 peak  4395 spectrum    1 weight  0.11000E+01 volume  0.92535E-03 ppm1      2.236 ppm2      7.759 CV     1
 ASSI { 4396}
   (( segid "    " and resid 118  and name HG1 ))
   (( segid "    " and resid 120  and name HD2 ))
      5.200     3.300     0.800 peak  4396 spectrum    1 weight  0.11000E+01 volume  0.13588E-03 ppm1      2.232 ppm2      7.166 CV     1
 ASSI { 4399}
   (( segid "    " and resid 118  and name HG2 ))
   (  segid "    " and resid 117  and name HD1%)
      5.200     5.200     0.800 peak  4399 spectrum    1 weight  0.11000E+01 volume  0.24403E-04 ppm1      2.524 ppm2      0.909 CV     1
 ASSI { 4400}
   (( segid "    " and resid 118  and name HG2 ))
   (  segid "    " and resid 115  and name HG2%)
      3.600     3.600     2.400 peak  4400 spectrum    1 weight  0.11000E+01 volume  0.23361E-03 ppm1      2.524 ppm2      0.667 CV     1
 ASSI { 4402}
   (( segid "    " and resid 118  and name HG2 ))
   (( segid "    " and resid 117  and name HB1 ))
      3.500     1.500     1.500 peak  4402 spectrum    1 weight  0.11000E+01 volume  0.82808E-03 ppm1      2.537 ppm2      1.455 CV     1
 ASSI { 4403}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     5.000     0.000 peak  4403 spectrum    1 weight  0.11000E+01 volume  0.41064E-04 ppm1      2.424 ppm2      4.048 CV     1
 ASSI { 4404}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 72   and name HA  ))
      4.100     2.100     1.900 peak  4404 spectrum    1 weight  0.11000E+01 volume  0.58141E-03 ppm1      2.355 ppm2      4.074 CV     1
 ASSI { 4405}
   (( segid "    " and resid 121  and name HG1 ))
   (( segid "    " and resid 121  and name HA  ))
      3.500     1.500     1.500 peak  4405 spectrum    1 weight  0.11000E+01 volume  0.24245E-02 ppm1      2.279 ppm2      4.291 CV     1
 ASSI { 4406}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 77   and name HN  ))
      4.500     2.500     1.500 peak  4406 spectrum    1 weight  0.11000E+01 volume  0.46145E-03 ppm1      2.145 ppm2      8.579 CV     1
 ASSI { 4407}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 90   and name HE3 ))
      6.000     5.300     0.000 peak  4407 spectrum    1 weight  0.11000E+01 volume  0.13547E-03 ppm1      2.215 ppm2      7.275 CV     1
 ASSI { 4408}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 90   and name HE3 ))
      6.000     5.000     0.000 peak  4408 spectrum    1 weight  0.11000E+01 volume  0.14371E-03 ppm1      2.168 ppm2      7.287 CV     1
 ASSI { 4410}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 44   and name HZ2 ))
      3.600     1.600     1.600 peak  4410 spectrum    1 weight  0.11000E+01 volume  0.81382E-03 ppm1     -1.214 ppm2      7.276 CV     1
 ASSI { 4411}
   (( segid "    " and resid 111  and name HB2 ))
   (  segid "    " and resid 53   and name HD% )
      6.000     6.000     0.000 peak  4411 spectrum    1 weight  0.11000E+01 volume  0.44450E-05 ppm1      3.262 ppm2      6.763 CV     1
 ASSI { 4412}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 111  and name HD2 ))
      4.300     2.300     1.700 peak  4412 spectrum    1 weight  0.11000E+01 volume  0.60030E-03 ppm1      3.277 ppm2      6.254 CV     1
 ASSI { 4415}
   (( segid "    " and resid 111  and name HB2 ))
   (  segid "    " and resid 130  and name HD1%)
      6.000     6.000     0.000 peak  4415 spectrum    1 weight  0.11000E+01 volume  0.69000E-04 ppm1      3.278 ppm2      0.776 CV     1
 ASSI { 4416}
   (( segid "    " and resid 111  and name HB2 ))
   (  segid "    " and resid 46   and name HG2%)
      3.200     1.300     1.300 peak  4416 spectrum    1 weight  0.11000E+01 volume  0.53102E-03 ppm1      3.270 ppm2      0.507 CV     1
 ASSI { 4418}
   (( segid "    " and resid 111  and name HB1 ))
   (  segid "    " and resid 46   and name HG1%)
      4.500     2.600     1.500 peak  4418 spectrum    1 weight  0.11000E+01 volume  0.60810E-03 ppm1      3.009 ppm2     -0.211 CV     1
 ASSI { 4419}
   (( segid "    " and resid 111  and name HB1 ))
   (  segid "    " and resid 46   and name HG2%)
      4.200     2.200     1.800 peak  4419 spectrum    1 weight  0.11000E+01 volume  0.52471E-03 ppm1      3.003 ppm2      0.500 CV     1
 ASSI { 4420}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 111  and name HB1 ))
      2.000     0.500     0.500 peak  4420 spectrum    1 weight  0.11000E+01 volume  0.33164E-02 ppm1      3.296 ppm2      3.052 CV     1
 ASSI { 4421}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 74   and name HN  ))
      2.700     0.900     0.900 peak  4421 spectrum    1 weight  0.11000E+01 volume  0.13393E-02 ppm1      1.786 ppm2      7.484 CV     1
 ASSI { 4422}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 90   and name HE3 ))
      4.600     2.600     1.400 peak  4422 spectrum    1 weight  0.11000E+01 volume  0.62361E-03 ppm1      1.660 ppm2      7.305 CV     1
 ASSI { 4423}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      4.400     2.500     1.600 peak  4423 spectrum    1 weight  0.11000E+01 volume  0.62395E-03 ppm1      1.783 ppm2      7.641 CV     1
 ASSI { 4425}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HG2 ))
      2.900     1.000     1.000 peak  4425 spectrum    1 weight  0.11000E+01 volume  0.35512E-02 ppm1      1.671 ppm2      1.275 CV     1
 ASSI { 4426}
   (( segid "    " and resid 77   and name HB  ))
   (( segid "    " and resid 76   and name HN  ))
      3.300     1.400     1.400 peak  4426 spectrum    1 weight  0.11000E+01 volume  0.33583E-02 ppm1      2.315 ppm2      8.432 CV     1
 ASSI { 4428}
   (( segid "    " and resid 77   and name HB  ))
   (( segid "    " and resid 78   and name HN  ))
      2.700     0.900     0.900 peak  4428 spectrum    1 weight  0.11000E+01 volume  0.19798E-02 ppm1      2.308 ppm2      7.383 CV     1
 ASSI { 4429}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 120  and name HE1 ))
      5.500     3.800     0.500 peak  4429 spectrum    1 weight  0.11000E+01 volume  0.37317E-03 ppm1      2.312 ppm2      8.776 CV     1
 ASSI { 4432}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HG2 ))
      2.100     0.500     0.500 peak  4432 spectrum    1 weight  0.11000E+01 volume  0.81999E-02 ppm1      2.317 ppm2      1.853 CV     1
 ASSI { 4433}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 123  and name HG1 ))
      1.900     0.500     0.500 peak  4433 spectrum    1 weight  0.11000E+01 volume  0.12897E-01 ppm1      2.261 ppm2      1.847 CV     1
 ASSI { 4434}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 101  and name HA  ))
      3.900     1.900     1.900 peak  4434 spectrum    1 weight  0.11000E+01 volume  0.44362E-03 ppm1      2.473 ppm2      5.823 CV     1
 ASSI { 4438}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
      4.900     3.000     1.100 peak  4438 spectrum    1 weight  0.11000E+01 volume  0.29296E-03 ppm1      2.474 ppm2      9.309 CV     1
 ASSI { 4439}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 106  and name HN  ))
      4.300     2.300     1.700 peak  4439 spectrum    1 weight  0.11000E+01 volume  0.15587E-03 ppm1      2.474 ppm2      9.464 CV     1
 ASSI { 4440}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 101  and name HN  ))
      4.200     2.200     1.800 peak  4440 spectrum    1 weight  0.11000E+01 volume  0.79291E-03 ppm1      2.221 ppm2      8.642 CV     1
 ASSI { 4444}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HA  ))
      2.900     1.000     1.000 peak  4444 spectrum    1 weight  0.11000E+01 volume  0.19854E-02 ppm1      2.475 ppm2      4.001 CV     1
 ASSI { 4445}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HA  ))
      2.900     1.100     1.100 peak  4445 spectrum    1 weight  0.11000E+01 volume  0.13112E-02 ppm1      2.217 ppm2      4.017 CV     1
 ASSI { 4447}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HG2 ))
      2.700     0.900     0.900 peak  4447 spectrum    1 weight  0.11000E+01 volume  0.84567E-03 ppm1      2.211 ppm2      2.922 CV     1
 ASSI { 4449}
   (( segid "    " and resid 105  and name HB1 ))
   (  segid "    " and resid 101  and name HD2%)
      2.900     1.000     1.000 peak  4449 spectrum    1 weight  0.11000E+01 volume  0.86354E-03 ppm1      2.207 ppm2      0.066 CV     1
 ASSI { 4452}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 101  and name HB1 ))
      3.400     1.500     1.500 peak  4452 spectrum    1 weight  0.11000E+01 volume  0.11478E-02 ppm1      2.469 ppm2      1.582 CV     1
 ASSI { 4455}
   (( segid "    " and resid 105  and name HB1 ))
   (  segid "    " and resid 101  and name HD1%)
      3.100     1.200     1.200 peak  4455 spectrum    1 weight  0.11000E+01 volume  0.25528E-02 ppm1      2.229 ppm2      0.819 CV     1
 ASSI { 4459}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HD1 ))
      4.500     2.500     1.500 peak  4459 spectrum    1 weight  0.11000E+01 volume  0.71501E-03 ppm1      2.546 ppm2      3.352 CV     1
 ASSI { 4463}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 41   and name HN  ))
      4.500     2.500     1.500 peak  4463 spectrum    1 weight  0.11000E+01 volume  0.59582E-04 ppm1      0.895 ppm2      8.059 CV     1
 ASSI { 4467}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 90   and name HN  ))
      5.700     4.000     0.300 peak  4467 spectrum    1 weight  0.11000E+01 volume  0.20497E-03 ppm1      1.954 ppm2      8.673 CV     1
 ASSI { 4469}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 126  and name HN  ))
      5.500     5.500     0.500 peak  4469 spectrum    1 weight  0.11000E+01 volume  0.11174E-03 ppm1      1.952 ppm2      8.892 CV     1
 ASSI { 4470}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      2.100     0.500     0.500 peak  4470 spectrum    1 weight  0.11000E+01 volume  0.11601E-01 ppm1      2.031 ppm2      4.144 CV     1
 ASSI { 4471}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HG2 ))
      1.700     1.700     4.300 peak  4471 spectrum    1 weight  0.11000E+01 volume  0.90849E-01 ppm1      2.027 ppm2      1.718 CV     1
 ASSI { 4472}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 115  and name HG2%)
      2.000     0.500     0.500 peak  4472 spectrum    1 weight  0.11000E+01 volume  0.14103E-01 ppm1      2.022 ppm2      0.665 CV     1
 ASSI { 4475}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 137  and name HN  ))
      4.900     3.000     1.100 peak  4475 spectrum    1 weight  0.11000E+01 volume  0.34853E-04 ppm1      3.174 ppm2      8.113 CV     1
 ASSI { 4477}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HD1 ))
      3.200     1.300     1.300 peak  4477 spectrum    1 weight  0.11000E+01 volume  0.78039E-03 ppm1      3.301 ppm2      7.157 CV     1
 ASSI { 4478}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 101  and name HD1%)
      4.900     4.900     1.100 peak  4478 spectrum    1 weight  0.11000E+01 volume  0.48448E-03 ppm1      3.305 ppm2      0.864 CV     1
 ASSI { 4480}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 93   and name HB% )
      4.700     4.700     1.300 peak  4480 spectrum    1 weight  0.11000E+01 volume  0.58734E-03 ppm1      3.319 ppm2      1.161 CV     1
 ASSI { 4481}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 93   and name HB% )
      5.100     3.200     0.900 peak  4481 spectrum    1 weight  0.11000E+01 volume  0.32366E-03 ppm1      3.432 ppm2      1.164 CV     1
 ASSI { 4483}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 101  and name HD1%)
      3.800     3.800     2.200 peak  4483 spectrum    1 weight  0.11000E+01 volume  0.14819E-02 ppm1      3.413 ppm2      0.861 CV     1
 ASSI { 4484}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 91   and name HG2 ))
      6.000     5.100     0.000 peak  4484 spectrum    1 weight  0.11000E+01 volume  0.24815E-03 ppm1      3.455 ppm2      1.583 CV     1
 ASSI { 4488}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 91   and name HG2 ))
      6.000     4.600     0.000 peak  4488 spectrum    1 weight  0.11000E+01 volume  0.76622E-04 ppm1      3.321 ppm2      1.501 CV     1
 ASSI { 4495}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
      6.000     4.600     0.000 peak  4495 spectrum    1 weight  0.11000E+01 volume  0.22269E-03 ppm1      3.533 ppm2      4.273 CV     1
 ASSI { 4496}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HB1 ))
      2.000     0.500     0.500 peak  4496 spectrum    1 weight  0.11000E+01 volume  0.51160E-02 ppm1      3.525 ppm2      2.851 CV     1
 ASSI { 4497}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 43   and name HG2 ))
      2.900     2.900     3.100 peak  4497 spectrum    1 weight  0.11000E+01 volume  0.73250E-03 ppm1      2.842 ppm2      2.207 CV     1
 ASSI { 4499}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 130  and name HB2 ))
      3.800     3.800     2.200 peak  4499 spectrum    1 weight  0.11000E+01 volume  0.17483E-02 ppm1      2.833 ppm2      1.646 CV     1
 ASSI { 4500}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 45   and name HB  ))
      4.700     2.800     1.300 peak  4500 spectrum    1 weight  0.11000E+01 volume  0.77653E-03 ppm1      3.547 ppm2      2.161 CV     1
 ASSI { 4512}
   (( segid "    " and resid 138  and name HB1 ))
   (( segid "    " and resid 138  and name HA  ))
      4.400     2.400     1.600 peak  4512 spectrum    1 weight  0.11000E+01 volume  0.27279E-03 ppm1      3.101 ppm2      4.627 CV     1
 ASSI { 4515}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 76   and name HB1 ))
      2.500     0.800     0.800 peak  4515 spectrum    1 weight  0.11000E+01 volume  0.75871E-02 ppm1      2.960 ppm2      2.181 CV     1
 ASSI { 4516}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HG2 ))
      3.000     1.100     1.100 peak  4516 spectrum    1 weight  0.11000E+01 volume  0.25483E-02 ppm1      1.199 ppm2      1.864 CV     1
 ASSI { 4517}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HG2 ))
      1.900     0.400     0.400 peak  4517 spectrum    1 weight  0.11000E+01 volume  0.10792E-01 ppm1      1.538 ppm2      1.847 CV     1
 ASSI { 4518}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HB1 ))
      1.700     0.400     0.500 peak  4518 spectrum    1 weight  0.11000E+01 volume  0.73187E-02 ppm1      1.535 ppm2      1.201 CV     1
 ASSI { 4519}
   (( segid "    " and resid 62   and name HB2 ))
   (  segid "    " and resid 67   and name HG2%)
      4.200     2.200     1.800 peak  4519 spectrum    1 weight  0.11000E+01 volume  0.13927E-02 ppm1      1.534 ppm2     -0.043 CV     1
 ASSI { 4520}
   (( segid "    " and resid 62   and name HB1 ))
   (  segid "    " and resid 67   and name HG2%)
      2.600     0.900     0.900 peak  4520 spectrum    1 weight  0.11000E+01 volume  0.18971E-02 ppm1      1.186 ppm2     -0.053 CV     1
 ASSI { 4521}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 57   and name HZ  ))
      3.900     1.900     1.900 peak  4521 spectrum    1 weight  0.11000E+01 volume  0.24268E-03 ppm1      1.519 ppm2      6.824 CV     1
 ASSI { 4522}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 57   and name HZ  ))
      3.400     1.500     1.500 peak  4522 spectrum    1 weight  0.11000E+01 volume  0.49965E-03 ppm1      1.203 ppm2      6.854 CV     1
 ASSI { 4523}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 66   and name HN  ))
      4.900     3.000     1.100 peak  4523 spectrum    1 weight  0.11000E+01 volume  0.20000E-03 ppm1      1.203 ppm2      7.542 CV     1
 ASSI { 4525}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 66   and name HN  ))
      3.900     1.900     1.900 peak  4525 spectrum    1 weight  0.11000E+01 volume  0.20094E-03 ppm1      1.523 ppm2      7.529 CV     1
 ASSI { 4526}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      3.200     1.200     1.200 peak  4526 spectrum    1 weight  0.11000E+01 volume  0.94742E-03 ppm1      1.523 ppm2      8.827 CV     1
 ASSI { 4529}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
      5.000     3.100     1.000 peak  4529 spectrum    1 weight  0.11000E+01 volume  0.42010E-03 ppm1      1.189 ppm2      8.818 CV     1
 ASSI { 4531}
   (( segid "    " and resid 136  and name HB1 ))
   (( segid "    " and resid 136  and name HN  ))
      4.000     2.000     2.000 peak  4531 spectrum    1 weight  0.11000E+01 volume  0.43684E-03 ppm1      1.609 ppm2      6.991 CV     1
 ASSI { 4532}
   (( segid "    " and resid 113  and name HG12))
   (( segid "    " and resid 114  and name HN  ))
      6.000     6.000     0.000 peak  4532 spectrum    1 weight  0.11000E+01 volume  0.34265E-04 ppm1      0.728 ppm2      7.476 CV     1
 ASSI { 4534}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name HB1 ))
      1.600     0.300     0.600 peak  4534 spectrum    1 weight  0.11000E+01 volume  0.15437E-01 ppm1      2.423 ppm2      2.066 CV     1
 ASSI { 4535}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 130  and name HN  ))
      5.200     3.400     0.800 peak  4535 spectrum    1 weight  0.11000E+01 volume  0.17088E-03 ppm1      2.416 ppm2      7.844 CV     1
 ASSI { 4537}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 114  and name HG1 ))
      3.000     3.000     3.000 peak  4537 spectrum    1 weight  0.11000E+01 volume  0.17940E-02 ppm1      1.932 ppm2      1.179 CV     1
 ASSI { 4539}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HN  ))
      2.700     0.900     0.900 peak  4539 spectrum    1 weight  0.11000E+01 volume  0.35383E-02 ppm1      1.966 ppm2      7.788 CV     1
 ASSI { 4540}
   (( segid "    " and resid 45   and name HB  ))
   (( segid "    " and resid 45   and name HN  ))
      3.600     1.600     1.600 peak  4540 spectrum    1 weight  0.11000E+01 volume  0.42581E-03 ppm1      2.129 ppm2      9.107 CV     1
 ASSI { 4541}
   (( segid "    " and resid 45   and name HB  ))
   (( segid "    " and resid 46   and name HN  ))
      3.600     1.700     1.700 peak  4541 spectrum    1 weight  0.11000E+01 volume  0.52981E-03 ppm1      2.118 ppm2      9.304 CV     1
 ASSI { 4542}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 89   and name HN  ))
      4.200     2.200     1.800 peak  4542 spectrum    1 weight  0.11000E+01 volume  0.50254E-03 ppm1      2.149 ppm2      8.218 CV     1
 ASSI { 4543}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 86   and name HN  ))
      3.200     1.300     1.300 peak  4543 spectrum    1 weight  0.11000E+01 volume  0.70542E-03 ppm1      2.147 ppm2      8.057 CV     1
 ASSI { 4544}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 81   and name HN  ))
      3.400     3.400     2.600 peak  4544 spectrum    1 weight  0.11000E+01 volume  0.33305E-03 ppm1      2.141 ppm2      7.482 CV     1
 ASSI { 4547}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 49   and name HN  ))
      4.700     2.800     1.300 peak  4547 spectrum    1 weight  0.11000E+01 volume  0.38674E-03 ppm1      1.739 ppm2      7.230 CV     1
 ASSI { 4549}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 116  and name HN  ))
      2.700     2.700     3.300 peak  4549 spectrum    1 weight  0.11000E+01 volume  0.14535E-02 ppm1      1.741 ppm2      7.898 CV     1
 ASSI { 4551}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 117  and name HN  ))
      4.300     2.300     1.700 peak  4551 spectrum    1 weight  0.11000E+01 volume  0.32543E-03 ppm1      1.745 ppm2      9.046 CV     1
 ASSI { 4556}
   (( segid "    " and resid 132  and name HB1 ))
   (( segid "    " and resid 132  and name HD1 ))
      5.700     4.100     0.300 peak  4556 spectrum    1 weight  0.11000E+01 volume  0.14245E-03 ppm1      1.396 ppm2      3.187 CV     1
 ASSI { 4557}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HD1 ))
      5.300     3.600     0.700 peak  4557 spectrum    1 weight  0.11000E+01 volume  0.21462E-03 ppm1      1.815 ppm2      3.265 CV     1
 ASSI { 4558}
   (( segid "    " and resid 114  and name HD2 ))
   (( segid "    " and resid 115  and name HN  ))
      3.800     3.800     2.200 peak  4558 spectrum    1 weight  0.11000E+01 volume  0.10636E-02 ppm1      1.985 ppm2      8.108 CV     1
 ASSI { 4559}
   (( segid "    " and resid 114  and name HD1 ))
   (( segid "    " and resid 114  and name HN  ))
      2.800     2.800     3.200 peak  4559 spectrum    1 weight  0.11000E+01 volume  0.13266E-01 ppm1      1.970 ppm2      7.488 CV     1
 ASSI { 4562}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HN  ))
      4.700     2.700     1.300 peak  4562 spectrum    1 weight  0.11000E+01 volume  0.29249E-03 ppm1      1.747 ppm2      8.161 CV     1
 ASSI { 4563}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HG2 ))
      3.000     1.100     1.100 peak  4563 spectrum    1 weight  0.11000E+01 volume  0.23952E-02 ppm1      2.093 ppm2      1.497 CV     1
 ASSI { 4565}
   (( segid "    " and resid 116  and name HD1 ))
   (( segid "    " and resid 113  and name HG11))
      2.500     2.500     3.500 peak  4565 spectrum    1 weight  0.11000E+01 volume  0.17831E-02 ppm1      1.744 ppm2      0.676 CV     1
 ASSI { 4566}
   (( segid "    " and resid 116  and name HB2 ))
   (  segid "    " and resid 85   and name HG1%)
      3.000     3.000     3.000 peak  4566 spectrum    1 weight  0.11000E+01 volume  0.29785E-02 ppm1      2.089 ppm2      1.027 CV     1
 ASSI { 4568}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 137  and name HN  ))
      3.300     3.300     2.700 peak  4568 spectrum    1 weight  0.11000E+01 volume  0.17183E-02 ppm1      2.029 ppm2      8.208 CV     1
 ASSI { 4569}
   (( segid "    " and resid 135  and name HB2 ))
   (  segid "    " and resid 135  and name HZ% )
      3.800     3.800     2.200 peak  4569 spectrum    1 weight  0.11000E+01 volume  0.17381E-02 ppm1      2.032 ppm2      8.017 CV     1
 ASSI { 4571}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 111  and name HB2 ))
      3.400     3.400     2.600 peak  4571 spectrum    1 weight  0.11000E+01 volume  0.29137E-03 ppm1      2.042 ppm2      3.308 CV     1
 ASSI { 4573}
   (( segid "    " and resid 122  and name HG  ))
   (  segid "    " and resid 122  and name HD2%)
      2.200     0.600     0.600 peak  4573 spectrum    1 weight  0.11000E+01 volume  0.89307E-02 ppm1      2.032 ppm2      0.842 CV     1
 ASSI { 4574}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 47   and name HA2 ))
      2.200     0.600     0.600 peak  4574 spectrum    1 weight  0.11000E+01 volume  0.33518E-02 ppm1      2.307 ppm2      4.147 CV     1
 ASSI { 4576}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HE1 ))
      4.900     3.000     1.100 peak  4576 spectrum    1 weight  0.11000E+01 volume  0.22708E-03 ppm1      1.511 ppm2      2.808 CV     1
 ASSI { 4581}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 114  and name HN  ))
      3.500     3.500     2.500 peak  4581 spectrum    1 weight  0.11000E+01 volume  0.24124E-03 ppm1      0.761 ppm2      7.480 CV     1
 ASSI { 4582}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 113  and name HN  ))
      4.100     2.100     1.900 peak  4582 spectrum    1 weight  0.11000E+01 volume  0.11058E-02 ppm1      0.760 ppm2      7.694 CV     1
 ASSI { 4584}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 112  and name HN  ))
      4.500     4.500     1.500 peak  4584 spectrum    1 weight  0.11000E+01 volume  0.57934E-04 ppm1      0.764 ppm2      8.215 CV     1
 ASSI { 4585}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 76   and name HN  ))
      4.300     2.300     1.700 peak  4585 spectrum    1 weight  0.11000E+01 volume  0.31400E-03 ppm1      0.758 ppm2      8.427 CV     1
 ASSI { 4586}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 77   and name HN  ))
      3.500     3.500     2.500 peak  4586 spectrum    1 weight  0.11000E+01 volume  0.24518E-03 ppm1      0.759 ppm2      8.579 CV     1
 ASSI { 4587}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 122  and name HB1 ))
      3.700     3.700     2.300 peak  4587 spectrum    1 weight  0.11000E+01 volume  0.10988E-02 ppm1      0.645 ppm2      1.121 CV     1
 ASSI { 4588}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 85   and name HA  ))
      3.100     3.100     2.900 peak  4588 spectrum    1 weight  0.11000E+01 volume  0.59326E-03 ppm1      0.641 ppm2      3.631 CV     1
 ASSI { 4590}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 89   and name HB  ))
      1.700     1.700     4.300 peak  4590 spectrum    1 weight  0.11000E+01 volume  0.26086E-01 ppm1      0.895 ppm2      1.901 CV     1
 ASSI { 4592}
   (  segid "    " and resid 89   and name HG2%)
   (  segid "    " and resid 109  and name HB% )
      2.800     2.800     3.200 peak  4592 spectrum    1 weight  0.11000E+01 volume  0.52736E-02 ppm1      0.903 ppm2      1.146 CV     1
 ASSI { 4594}
   (  segid "    " and resid 56   and name HG2%)
   (  segid "    " and resid 67   and name HG2%)
      6.000     6.000     0.000 peak  4594 spectrum    1 weight  0.11000E+01 volume  0.14041E-03 ppm1      1.103 ppm2     -0.016 CV     1
 ASSI { 4595}
   (  segid "    " and resid 52   and name HG2%)
   (  segid "    " and resid 53   and name HE% )
      3.600     3.600     2.400 peak  4595 spectrum    1 weight  0.11000E+01 volume  0.10104E-02 ppm1      1.107 ppm2      6.966 CV     1
 ASSI { 4600}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 49   and name HA  ))
      5.500     3.800     0.500 peak  4600 spectrum    1 weight  0.11000E+01 volume  0.21180E-03 ppm1      1.110 ppm2      4.764 CV     1
 ASSI { 4601}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 67   and name HN  ))
      4.700     4.700     1.300 peak  4601 spectrum    1 weight  0.11000E+01 volume  0.57982E-03 ppm1      0.069 ppm2      9.294 CV     1
 ASSI { 4603}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 106  and name HB2 ))
      6.000     6.000     0.000 peak  4603 spectrum    1 weight  0.11000E+01 volume  0.12216E-04 ppm1      0.063 ppm2      3.187 CV     1
 ASSI { 4604}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 88   and name HN  ))
      5.700     5.700     0.300 peak  4604 spectrum    1 weight  0.11000E+01 volume  0.19225E-03 ppm1      0.826 ppm2      7.329 CV     1
 ASSI { 4606}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 67   and name HN  ))
      5.800     5.800     0.200 peak  4606 spectrum    1 weight  0.11000E+01 volume  0.15546E-03 ppm1      0.832 ppm2      9.311 CV     1
 ASSI { 4607}
   (( segid "    " and resid 101  and name HG  ))
   (( segid "    " and resid 101  and name HA  ))
      5.100     3.300     0.900 peak  4607 spectrum    1 weight  0.11000E+01 volume  0.65585E-04 ppm1      1.576 ppm2      5.820 CV     1
 ASSI { 4609}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HH22))
      6.000     6.000     0.000 peak  4609 spectrum    1 weight  0.11000E+01 volume  0.14533E-03 ppm1      1.600 ppm2      7.175 CV     1
 ASSI { 4614}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 72   and name HB% )
      3.800     3.800     2.200 peak  4614 spectrum    1 weight  0.11000E+01 volume  0.12073E-02 ppm1      0.476 ppm2      1.792 CV     1
 ASSI { 4617}
   (( segid "    " and resid 60   and name HG  ))
   (( segid "    " and resid 61   and name HN  ))
      5.600     3.900     0.400 peak  4617 spectrum    1 weight  0.11000E+01 volume  0.18799E-03 ppm1      1.601 ppm2      7.995 CV     1
 ASSI { 4618}
   (( segid "    " and resid 60   and name HG  ))
   (( segid "    " and resid 60   and name HA  ))
      4.400     2.400     1.600 peak  4618 spectrum    1 weight  0.11000E+01 volume  0.28630E-03 ppm1      1.597 ppm2      4.467 CV     1
 ASSI { 4619}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 44   and name HH2 ))
      4.100     2.100     1.900 peak  4619 spectrum    1 weight  0.11000E+01 volume  0.10014E-03 ppm1      0.589 ppm2      7.270 CV     1
 ASSI { 4620}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 46   and name HN  ))
      3.800     1.800     1.800 peak  4620 spectrum    1 weight  0.11000E+01 volume  0.16323E-03 ppm1      0.599 ppm2      9.275 CV     1
 ASSI { 4622}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 131  and name HN  ))
      4.300     4.300     1.700 peak  4622 spectrum    1 weight  0.11000E+01 volume  0.73447E-04 ppm1      0.766 ppm2      7.123 CV     1
 ASSI { 4623}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 130  and name HA  ))
      6.000     6.000     0.000 peak  4623 spectrum    1 weight  0.11000E+01 volume  0.15631E-04 ppm1      0.769 ppm2      4.614 CV     1
 ASSI { 4624}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 130  and name HB1 ))
      2.700     0.900     0.900 peak  4624 spectrum    1 weight  0.11000E+01 volume  0.76632E-02 ppm1      0.770 ppm2      1.485 CV     1
 ASSI { 4627}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 127  and name HG2 ))
      3.100     1.200     1.200 peak  4627 spectrum    1 weight  0.11000E+01 volume  0.11561E-02 ppm1      0.771 ppm2      2.121 CV     1
 ASSI { 4628}
   (( segid "    " and resid 130  and name HG  ))
   (  segid "    " and resid 46   and name HG1%)
      3.900     3.900     2.100 peak  4628 spectrum    1 weight  0.11000E+01 volume  0.14468E-03 ppm1      0.954 ppm2     -0.208 CV     1
 ASSI { 4633}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 130  and name HA  ))
      6.000     5.600     0.000 peak  4633 spectrum    1 weight  0.11000E+01 volume  0.11098E-04 ppm1      0.962 ppm2      4.626 CV     1
 ASSI { 4635}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 44   and name HE3 ))
      4.400     2.400     1.600 peak  4635 spectrum    1 weight  0.11000E+01 volume  0.50235E-03 ppm1      0.964 ppm2      7.641 CV     1
 ASSI { 4636}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 130  and name HN  ))
      4.100     2.100     1.900 peak  4636 spectrum    1 weight  0.11000E+01 volume  0.46072E-03 ppm1      0.964 ppm2      7.794 CV     1
 ASSI { 4637}
   (  segid "    " and resid 59   and name HG2%)
   (( segid "    " and resid 106  and name HZ  ))
      5.600     5.600     0.400 peak  4637 spectrum    1 weight  0.11000E+01 volume  0.44938E-03 ppm1      1.446 ppm2      7.300 CV     1
 ASSI { 4638}
   (  segid "    " and resid 59   and name HG2%)
   (( segid "    " and resid 57   and name HN  ))
      6.000     6.000     0.000 peak  4638 spectrum    1 weight  0.11000E+01 volume  0.26935E-04 ppm1      1.442 ppm2      9.170 CV     1
 ASSI { 4641}
   (  segid "    " and resid 59   and name HG2%)
   (( segid "    " and resid 55   and name HA  ))
      4.300     4.300     1.700 peak  4641 spectrum    1 weight  0.11000E+01 volume  0.76921E-04 ppm1      1.442 ppm2      4.142 CV     1
 ASSI { 4642}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 66   and name HN  ))
      6.000     6.000     0.000 peak  4642 spectrum    1 weight  0.11000E+01 volume  0.12275E-04 ppm1      1.334 ppm2      7.525 CV     1
 ASSI { 4643}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 71   and name HD22))
      5.900     4.300     0.100 peak  4643 spectrum    1 weight  0.11000E+01 volume  0.11975E-03 ppm1      1.334 ppm2      7.018 CV     1
 ASSI { 4644}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 67   and name HG2%)
      4.900     4.900     1.100 peak  4644 spectrum    1 weight  0.11000E+01 volume  0.72358E-03 ppm1      1.328 ppm2     -0.056 CV     1
 ASSI { 4648}
   (  segid "    " and resid 124  and name HB% )
   (( segid "    " and resid 126  and name HN  ))
      6.000     6.000     0.000 peak  4648 spectrum    1 weight  0.11000E+01 volume  0.77682E-04 ppm1      1.376 ppm2      8.943 CV     1
 ASSI { 4652}
   (  segid "    " and resid 124  and name HB% )
   (( segid "    " and resid 125  and name HN  ))
      3.400     1.400     1.400 peak  4652 spectrum    1 weight  0.11000E+01 volume  0.21739E-02 ppm1      1.379 ppm2      7.545 CV     1
 ASSI { 4655}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 67   and name HN  ))
      6.000     6.000     0.000 peak  4655 spectrum    1 weight  0.11000E+01 volume  0.13838E-03 ppm1      1.776 ppm2      9.299 CV     1
 ASSI { 4656}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 71   and name HB1 ))
      5.600     5.600     0.400 peak  4656 spectrum    1 weight  0.11000E+01 volume  0.15366E-04 ppm1      1.778 ppm2      2.503 CV     1
 ASSI { 4658}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 106  and name HB2 ))
      6.000     5.500     0.000 peak  4658 spectrum    1 weight  0.11000E+01 volume  0.62583E-04 ppm1      1.779 ppm2      3.168 CV     1
 ASSI { 4659}
   (  segid "    " and resid 72   and name HB% )
   (( segid "    " and resid 75   and name HB2 ))
      5.000     3.100     1.000 peak  4659 spectrum    1 weight  0.11000E+01 volume  0.22243E-03 ppm1      1.787 ppm2      2.222 CV     1
 ASSI { 4660}
   (  segid "    " and resid 124  and name HB% )
   (( segid "    " and resid 125  and name HA  ))
      4.000     2.000     2.000 peak  4660 spectrum    1 weight  0.11000E+01 volume  0.60849E-03 ppm1      1.380 ppm2      4.616 CV     1
 ASSI { 4662}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 92   and name HN  ))
      5.100     3.300     0.900 peak  4662 spectrum    1 weight  0.11000E+01 volume  0.33906E-03 ppm1      1.150 ppm2      7.623 CV     1
 ASSI { 4663}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 94   and name HA  ))
      6.000     5.000     0.000 peak  4663 spectrum    1 weight  0.11000E+01 volume  0.32881E-04 ppm1      1.167 ppm2      4.525 CV     1
 ASSI { 4667}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HA  ))
      6.000     4.800     0.000 peak  4667 spectrum    1 weight  0.11000E+01 volume  0.95874E-04 ppm1      0.802 ppm2      5.125 CV     1
 ASSI { 4672}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HN  ))
      3.600     1.600     1.600 peak  4672 spectrum    1 weight  0.11000E+01 volume  0.12314E-02 ppm1      0.793 ppm2      8.057 CV     1
 ASSI { 4673}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 89   and name HN  ))
      4.200     4.200     1.800 peak  4673 spectrum    1 weight  0.11000E+01 volume  0.98230E-03 ppm1      0.791 ppm2      8.203 CV     1
 ASSI { 4676}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 90   and name HH2 ))
      3.700     3.700     2.300 peak  4676 spectrum    1 weight  0.11000E+01 volume  0.18948E-03 ppm1      0.878 ppm2      6.808 CV     1
 ASSI { 4677}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 101  and name HN  ))
      5.200     3.400     0.800 peak  4677 spectrum    1 weight  0.11000E+01 volume  0.23785E-04 ppm1      0.870 ppm2      8.639 CV     1
 ASSI { 4678}
   (  segid "    " and resid 126  and name HD1%)
   (( segid "    " and resid 126  and name HG  ))
      2.500     0.800     0.800 peak  4678 spectrum    1 weight  0.11000E+01 volume  0.56383E-02 ppm1      0.869 ppm2      1.758 CV     1
 ASSI { 4679}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HG  ))
      2.300     0.700     0.700 peak  4679 spectrum    1 weight  0.11000E+01 volume  0.62728E-02 ppm1      0.870 ppm2      1.499 CV     1
 ASSI { 4680}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 68   and name HA  ))
      6.000     6.000     0.000 peak  4680 spectrum    1 weight  0.11000E+01 volume  0.57934E-04 ppm1      0.797 ppm2      4.536 CV     1
 ASSI { 4683}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 66   and name HE2 ))
      4.700     2.700     1.300 peak  4683 spectrum    1 weight  0.11000E+01 volume  0.36587E-03 ppm1      0.794 ppm2      2.913 CV     1
 ASSI { 4684}
   (( segid "    " and resid 108  and name HG  ))
   (( segid "    " and resid 108  and name HA  ))
      2.900     1.100     1.100 peak  4684 spectrum    1 weight  0.11000E+01 volume  0.12634E-02 ppm1      1.542 ppm2      4.094 CV     1
 ASSI { 4686}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 69   and name HA1 ))
      3.000     3.000     3.000 peak  4686 spectrum    1 weight  0.11000E+01 volume  0.68711E-03 ppm1      1.546 ppm2      3.580 CV     1
 ASSI { 4687}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 111  and name HN  ))
      4.000     4.000     2.000 peak  4687 spectrum    1 weight  0.11000E+01 volume  0.10274E-02 ppm1      1.161 ppm2      8.372 CV     1
 ASSI { 4690}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 44   and name HE1 ))
      5.300     5.300     0.700 peak  4690 spectrum    1 weight  0.11000E+01 volume  0.19670E-03 ppm1      1.156 ppm2      9.415 CV     1
 ASSI { 4691}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 109  and name HN  ))
      6.000     6.000     0.000 peak  4691 spectrum    1 weight  0.11000E+01 volume  0.15455E-04 ppm1      1.158 ppm2      8.724 CV     1
 ASSI { 4692}
   (  segid "    " and resid 108  and name HD2%)
   (( segid "    " and resid 95   and name HN  ))
      5.800     4.200     0.200 peak  4692 spectrum    1 weight  0.11000E+01 volume  0.12275E-04 ppm1      1.163 ppm2      8.240 CV     1
 ASSI { 4694}
   (  segid "    " and resid 108  and name HD1%)
   (  segid "    " and resid 130  and name HD2%)
      4.500     2.500     1.500 peak  4694 spectrum    1 weight  0.11000E+01 volume  0.25554E-03 ppm1      1.197 ppm2      0.556 CV     1
 ASSI { 4695}
   (( segid "    " and resid 108  and name HG  ))
   (( segid "    " and resid 108  and name HB2 ))
      2.900     1.000     1.000 peak  4695 spectrum    1 weight  0.11000E+01 volume  0.13626E-02 ppm1      1.538 ppm2      2.606 CV     1
 ASSI { 4696}
   (  segid "    " and resid 70   and name HB% )
   (( segid "    " and resid 73   and name HN  ))
      5.200     3.400     0.800 peak  4696 spectrum    1 weight  0.11000E+01 volume  0.30361E-03 ppm1      1.295 ppm2      8.739 CV     1
 ASSI { 4697}
   (  segid "    " and resid 70   and name HB% )
   (( segid "    " and resid 69   and name HA1 ))
      6.000     5.400     0.000 peak  4697 spectrum    1 weight  0.11000E+01 volume  0.10629E-03 ppm1      1.300 ppm2      3.572 CV     1
 ASSI { 4698}
   (  segid "    " and resid 70   and name HB% )
   (( segid "    " and resid 71   and name HB2 ))
      5.600     3.900     0.400 peak  4698 spectrum    1 weight  0.11000E+01 volume  0.26184E-03 ppm1      1.296 ppm2      2.847 CV     1
 ASSI { 4700}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 105  and name HB1 ))
      6.000     6.000     0.000 peak  4700 spectrum    1 weight  0.11000E+01 volume  0.77008E-04 ppm1      1.817 ppm2      2.180 CV     1
 ASSI { 4701}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 106  and name HA  ))
      4.700     2.800     1.300 peak  4701 spectrum    1 weight  0.11000E+01 volume  0.53497E-03 ppm1      1.822 ppm2      4.247 CV     1
 ASSI { 4705}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 106  and name HN  ))
      5.300     3.500     0.700 peak  4705 spectrum    1 weight  0.11000E+01 volume  0.21077E-04 ppm1      1.166 ppm2      9.511 CV     1
 ASSI { 4706}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 112  and name HN  ))
      6.000     5.600     0.000 peak  4706 spectrum    1 weight  0.11000E+01 volume  0.51603E-04 ppm1      1.174 ppm2      8.223 CV     1
 ASSI { 4707}
   (  segid "    " and resid 109  and name HB% )
   (( segid "    " and resid 90   and name HA  ))
      2.600     2.600     3.400 peak  4707 spectrum    1 weight  0.11000E+01 volume  0.13918E-02 ppm1      1.170 ppm2      3.817 CV     1
 ASSI { 4710}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 88   and name HN  ))
      6.000     6.000     0.000 peak  4710 spectrum    1 weight  0.11000E+01 volume  0.56224E-04 ppm1      0.729 ppm2      7.282 CV     1
 ASSI { 4711}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 76   and name HN  ))
      3.900     1.900     1.900 peak  4711 spectrum    1 weight  0.11000E+01 volume  0.14171E-03 ppm1      0.732 ppm2      8.453 CV     1
 ASSI { 4713}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 113  and name HG11))
      2.300     2.300     3.700 peak  4713 spectrum    1 weight  0.11000E+01 volume  0.17829E-01 ppm1      2.093 ppm2      0.758 CV     1
 ASSI { 4714}
   (  segid "    " and resid 76   and name HE% )
   (( segid "    " and resid 73   and name HA  ))
      2.900     2.900     3.100 peak  4714 spectrum    1 weight  0.11000E+01 volume  0.35827E-02 ppm1      2.093 ppm2      3.949 CV     1
 ASSI { 4715}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 40   and name HA  ))
      6.000     6.000     0.000 peak  4715 spectrum    1 weight  0.11000E+01 volume  0.23299E-03 ppm1      0.828 ppm2      4.619 CV     1
 ASSI { 4719}
   (  segid "    " and resid 77   and name HG1%)
   (( segid "    " and resid 77   and name HN  ))
      5.100     3.300     0.900 peak  4719 spectrum    1 weight  0.11000E+01 volume  0.40611E-03 ppm1      1.050 ppm2      8.632 CV     1
 ASSI { 4721}
   (  segid "    " and resid 77   and name HG1%)
   (( segid "    " and resid 74   and name HD2 ))
      3.500     3.500     2.500 peak  4721 spectrum    1 weight  0.11000E+01 volume  0.23953E-03 ppm1      1.048 ppm2      1.768 CV     1
 ASSI { 4725}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 74   and name HE2 ))
      3.100     3.100     2.900 peak  4725 spectrum    1 weight  0.11000E+01 volume  0.49103E-03 ppm1      1.047 ppm2      2.960 CV     1
 ASSI { 4727}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 74   and name HB2 ))
      5.600     3.900     0.400 peak  4727 spectrum    1 weight  0.11000E+01 volume  0.21312E-03 ppm1      1.044 ppm2      1.995 CV     1
 ASSI { 4728}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 74   and name HD2 ))
      3.200     3.200     2.800 peak  4728 spectrum    1 weight  0.11000E+01 volume  0.45827E-03 ppm1      1.044 ppm2      1.751 CV     1
 ASSI { 4730}
   (  segid "    " and resid 131  and name HG1%)
   (( segid "    " and resid 131  and name HN  ))
      3.800     1.800     1.800 peak  4730 spectrum    1 weight  0.11000E+01 volume  0.58411E-03 ppm1      0.790 ppm2      7.137 CV     1
 ASSI { 4735}
   (  segid "    " and resid 131  and name HG1%)
   (( segid "    " and resid 132  and name HD1 ))
      4.300     2.300     1.700 peak  4735 spectrum    1 weight  0.11000E+01 volume  0.10224E-02 ppm1      0.788 ppm2      3.217 CV     1
 ASSI { 4738}
   (  segid "    " and resid 45   and name HG1%)
   (( segid "    " and resid 45   and name HB  ))
      2.100     0.500     0.500 peak  4738 spectrum    1 weight  0.11000E+01 volume  0.14352E-01 ppm1      0.805 ppm2      2.119 CV     1
 ASSI { 4740}
   (  segid "    " and resid 131  and name HG1%)
   (( segid "    " and resid 132  and name HG1 ))
      4.300     2.300     1.700 peak  4740 spectrum    1 weight  0.11000E+01 volume  0.16295E-02 ppm1      0.790 ppm2      1.745 CV     1
 ASSI { 4741}
   (  segid "    " and resid 131  and name HG1%)
   (( segid "    " and resid 130  and name HB1 ))
      1.800     1.800     4.200 peak  4741 spectrum    1 weight  0.11000E+01 volume  0.14726E-01 ppm1      0.790 ppm2      1.488 CV     1
 ASSI { 4743}
   (  segid "    " and resid 45   and name HG1%)
   (  segid "    " and resid 46   and name HG1%)
      3.100     3.100     2.900 peak  4743 spectrum    1 weight  0.11000E+01 volume  0.58295E-02 ppm1      0.804 ppm2     -0.206 CV     1
 ASSI { 4744}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 64   and name HD22))
      6.000     6.000     0.000 peak  4744 spectrum    1 weight  0.11000E+01 volume  0.15413E-03 ppm1      0.899 ppm2      6.979 CV     1
 ASSI { 4748}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 118  and name HN  ))
      3.900     1.900     1.900 peak  4748 spectrum    1 weight  0.11000E+01 volume  0.12136E-02 ppm1      0.651 ppm2      7.798 CV     1
 ASSI { 4753}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 120  and name HB1 ))
      3.600     1.600     1.600 peak  4753 spectrum    1 weight  0.11000E+01 volume  0.32818E-02 ppm1      0.652 ppm2      2.861 CV     1
 ASSI { 4754}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 115  and name HB  ))
      2.000     0.500     0.500 peak  4754 spectrum    1 weight  0.11000E+01 volume  0.12232E-01 ppm1      0.652 ppm2      2.036 CV     1
 ASSI { 4755}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 120  and name HD2 ))
      5.100     3.300     0.900 peak  4755 spectrum    1 weight  0.11000E+01 volume  0.52552E-03 ppm1      0.679 ppm2      7.182 CV     1
 ASSI { 4765}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 82   and name HD1 ))
      4.400     2.500     1.600 peak  4765 spectrum    1 weight  0.11000E+01 volume  0.67733E-03 ppm1      1.098 ppm2      3.351 CV     1
 ASSI { 4768}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 84   and name HA  ))
      4.500     4.500     1.500 peak  4768 spectrum    1 weight  0.11000E+01 volume  0.85444E-03 ppm1      1.091 ppm2      4.019 CV     1
 ASSI { 4771}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 85   and name HB  ))
      2.200     0.600     0.600 peak  4771 spectrum    1 weight  0.11000E+01 volume  0.67656E-02 ppm1      1.098 ppm2      2.133 CV     1
 ASSI { 4775}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 63   and name HN  ))
      5.400     3.700     0.600 peak  4775 spectrum    1 weight  0.11000E+01 volume  0.19051E-03 ppm1      0.904 ppm2      8.725 CV     1
 ASSI { 4778}
   (  segid "    " and resid 117  and name HD2%)
   (( segid "    " and resid 117  and name HN  ))
      4.400     2.400     1.600 peak  4778 spectrum    1 weight  0.11000E+01 volume  0.98394E-03 ppm1      0.920 ppm2      9.054 CV     1
 ASSI { 4781}
   (  segid "    " and resid 117  and name HD2%)
   (( segid "    " and resid 118  and name HN  ))
      3.200     3.200     2.800 peak  4781 spectrum    1 weight  0.11000E+01 volume  0.47049E-03 ppm1      0.919 ppm2      7.767 CV     1
 ASSI { 4782}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 96   and name HN  ))
      4.000     2.000     2.000 peak  4782 spectrum    1 weight  0.11000E+01 volume  0.57086E-03 ppm1      0.920 ppm2      7.839 CV     1
 ASSI { 4783}
   (  segid "    " and resid 95   and name HG1%)
   (  segid "    " and resid 135  and name HZ% )
      6.000     6.000     0.000 peak  4783 spectrum    1 weight  0.11000E+01 volume  0.19163E-04 ppm1      0.917 ppm2      7.945 CV     1
 ASSI { 4784}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 95   and name HN  ))
      4.700     2.800     1.300 peak  4784 spectrum    1 weight  0.11000E+01 volume  0.26172E-03 ppm1      0.903 ppm2      8.266 CV     1
 ASSI { 4787}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 131  and name HA  ))
      4.700     4.700     1.300 peak  4787 spectrum    1 weight  0.11000E+01 volume  0.52644E-03 ppm1      0.902 ppm2      3.686 CV     1
 ASSI { 4793}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 116  and name HA  ))
      6.000     6.000     0.000 peak  4793 spectrum    1 weight  0.11000E+01 volume  0.13379E-03 ppm1      0.983 ppm2      4.521 CV     1
 ASSI { 4797}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 113  and name HN  ))
      5.400     3.600     0.600 peak  4797 spectrum    1 weight  0.11000E+01 volume  0.30558E-03 ppm1      0.806 ppm2      7.700 CV     1
 ASSI { 4801}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 109  and name HA  ))
      3.500     1.500     1.500 peak  4801 spectrum    1 weight  0.11000E+01 volume  0.87896E-03 ppm1      0.814 ppm2      3.632 CV     1
 ASSI { 4802}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 89   and name HA  ))
      3.700     1.700     1.700 peak  4802 spectrum    1 weight  0.11000E+01 volume  0.53381E-03 ppm1      0.810 ppm2      3.467 CV     1
 ASSI { 4804}
   (  segid "    " and resid 112  and name HD2%)
   (( segid "    " and resid 127  and name HD1 ))
      5.000     3.100     1.000 peak  4804 spectrum    1 weight  0.11000E+01 volume  0.11222E-03 ppm1      0.727 ppm2      3.469 CV     1
 ASSI { 4805}
   (( segid "    " and resid 126  and name HG  ))
   (( segid "    " and resid 126  and name HN  ))
      5.000     3.200     1.000 peak  4805 spectrum    1 weight  0.11000E+01 volume  0.19278E-03 ppm1      1.711 ppm2      8.977 CV     1
 ASSI { 4808}
   (  segid "    " and resid 122  and name HD1%)
   (( segid "    " and resid 122  and name HB1 ))
      3.200     1.300     1.300 peak  4808 spectrum    1 weight  0.11000E+01 volume  0.14805E-02 ppm1      0.793 ppm2      1.145 CV     1
 ASSI { 4809}
   (  segid "    " and resid 122  and name HD1%)
   (( segid "    " and resid 121  and name HB2 ))
      2.300     2.300     3.700 peak  4809 spectrum    1 weight  0.11000E+01 volume  0.29231E-02 ppm1      0.791 ppm2      2.014 CV     1
 ASSI { 4811}
   (  segid "    " and resid 122  and name HD2%)
   (( segid "    " and resid 122  and name HA  ))
      3.300     1.400     1.400 peak  4811 spectrum    1 weight  0.11000E+01 volume  0.16431E-02 ppm1      0.861 ppm2      4.411 CV     1
 ASSI { 4813}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 89   and name HA  ))
      4.300     2.300     1.700 peak  4813 spectrum    1 weight  0.11000E+01 volume  0.29602E-03 ppm1      0.669 ppm2      3.477 CV     1
 ASSI { 4816}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 126  and name HN  ))
      4.100     2.200     1.900 peak  4816 spectrum    1 weight  0.11000E+01 volume  0.86263E-03 ppm1      0.665 ppm2      8.956 CV     1
 ASSI { 4818}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 125  and name HA  ))
      4.100     2.100     1.900 peak  4818 spectrum    1 weight  0.11000E+01 volume  0.71920E-03 ppm1      0.666 ppm2      4.625 CV     1
 ASSI { 4820}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 123  and name HB2 ))
      4.200     4.200     1.800 peak  4820 spectrum    1 weight  0.11000E+01 volume  0.13838E-02 ppm1      0.669 ppm2      2.312 CV     1
 ASSI { 4821}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 126  and name HB2 ))
      2.600     2.600     3.400 peak  4821 spectrum    1 weight  0.11000E+01 volume  0.10539E-01 ppm1      0.671 ppm2      1.546 CV     1
 ASSI { 4822}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 92   and name HG  ))
      1.900     0.500     0.500 peak  4822 spectrum    1 weight  0.11000E+01 volume  0.18010E-01 ppm1      0.668 ppm2      1.774 CV     1
 ASSI { 4823}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 123  and name HG2 ))
      3.000     3.000     3.000 peak  4823 spectrum    1 weight  0.11000E+01 volume  0.42619E-02 ppm1      0.663 ppm2      1.909 CV     1
 ASSI { 4824}
   (  segid "    " and resid 92   and name HD2%)
   (( segid "    " and resid 92   and name HB1 ))
      2.300     0.700     0.700 peak  4824 spectrum    1 weight  0.11000E+01 volume  0.54619E-02 ppm1      0.665 ppm2      1.055 CV     1
 ASSI { 4825}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HD1 ))
      3.200     1.300     1.300 peak  4825 spectrum    1 weight  0.11000E+01 volume  0.17414E-02 ppm1      2.157 ppm2      3.336 CV     1
 ASSI { 4827}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HA  ))
      4.800     2.900     1.200 peak  4827 spectrum    1 weight  0.11000E+01 volume  0.34073E-03 ppm1      2.148 ppm2      4.486 CV     1
 ASSI { 4829}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 81   and name HB2 ))
      3.700     1.700     1.700 peak  4829 spectrum    1 weight  0.11000E+01 volume  0.54561E-02 ppm1      2.149 ppm2      1.556 CV     1
 ASSI { 4830}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 84   and name HN  ))
      6.000     4.800     0.000 peak  4830 spectrum    1 weight  0.11000E+01 volume  0.15811E-03 ppm1      2.075 ppm2      7.015 CV     1
 ASSI { 4832}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HB2 ))
      2.700     0.900     0.900 peak  4832 spectrum    1 weight  0.11000E+01 volume  0.70557E-02 ppm1      2.109 ppm2      2.465 CV     1
 ASSI { 4833}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 130  and name HN  ))
      5.600     3.900     0.400 peak  4833 spectrum    1 weight  0.11000E+01 volume  0.18463E-03 ppm1      2.236 ppm2      7.849 CV     1
 ASSI { 4834}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 129  and name HN  ))
      4.500     2.500     1.500 peak  4834 spectrum    1 weight  0.11000E+01 volume  0.17874E-03 ppm1      2.228 ppm2      8.011 CV     1
 ASSI { 4835}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 129  and name HN  ))
      5.000     3.200     1.000 peak  4835 spectrum    1 weight  0.11000E+01 volume  0.37968E-03 ppm1      2.083 ppm2      8.038 CV     1
 ASSI { 4836}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name HD2 ))
      2.300     0.700     0.700 peak  4836 spectrum    1 weight  0.11000E+01 volume  0.33205E-02 ppm1      2.112 ppm2      4.136 CV     1
 ASSI { 4837}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 129  and name HN  ))
      3.700     1.700     1.700 peak  4837 spectrum    1 weight  0.11000E+01 volume  0.16858E-02 ppm1      2.128 ppm2      8.000 CV     1
 ASSI { 4846}
   (( segid "    " and resid 112  and name HG  ))
   (( segid "    " and resid 130  and name HB1 ))
      2.600     2.600     3.400 peak  4846 spectrum    1 weight  0.11000E+01 volume  0.66206E-02 ppm1      1.953 ppm2      1.490 CV     1
 ASSI { 4853}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 73   and name HB1 ))
      2.300     0.600     0.600 peak  4853 spectrum    1 weight  0.11000E+01 volume  0.55111E-02 ppm1      1.163 ppm2      1.646 CV     1
 ASSI { 4854}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 98   and name HB1 ))
      3.000     3.000     3.000 peak  4854 spectrum    1 weight  0.11000E+01 volume  0.62944E-03 ppm1      0.922 ppm2      2.391 CV     1
 ASSI { 4858}
   (( segid "    " and resid 48   and name HG1 ))
   (( segid "    " and resid 48   and name HB1 ))
      2.000     2.000     4.000 peak  4858 spectrum    1 weight  0.11000E+01 volume  0.34812E-01 ppm1      1.358 ppm2      1.646 CV     1
 ASSI { 4860}
   (( segid "    " and resid 67   and name HG12))
   (( segid "    " and resid 102  and name HN  ))
      4.600     2.600     1.400 peak  4860 spectrum    1 weight  0.11000E+01 volume  0.40879E-03 ppm1      1.441 ppm2      9.148 CV     1
 ASSI { 4863}
   (( segid "    " and resid 67   and name HG12))
   (( segid "    " and resid 66   and name HA  ))
      4.700     2.800     1.300 peak  4863 spectrum    1 weight  0.11000E+01 volume  0.24768E-03 ppm1      1.443 ppm2      5.405 CV     1
 ASSI { 4866}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 101  and name HN  ))
      6.000     5.700     0.000 peak  4866 spectrum    1 weight  0.11000E+01 volume  0.31144E-04 ppm1      1.457 ppm2      8.635 CV     1
 ASSI { 4867}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 67   and name HN  ))
      6.000     5.800     0.000 peak  4867 spectrum    1 weight  0.11000E+01 volume  0.20164E-04 ppm1      1.455 ppm2      9.303 CV     1
 ASSI { 4868}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 67   and name HN  ))
      5.200     3.400     0.800 peak  4868 spectrum    1 weight  0.11000E+01 volume  0.19552E-03 ppm1      1.311 ppm2      9.299 CV     1
 ASSI { 4870}
   (( segid "    " and resid 116  and name HG2 ))
   (( segid "    " and resid 113  and name HA  ))
      3.500     1.500     1.500 peak  4870 spectrum    1 weight  0.11000E+01 volume  0.39051E-03 ppm1      1.457 ppm2      3.276 CV     1
 ASSI { 4871}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 66   and name HE1 ))
      2.600     0.800     0.800 peak  4871 spectrum    1 weight  0.11000E+01 volume  0.28308E-02 ppm1      1.297 ppm2      3.087 CV     1
 ASSI { 4873}
   (( segid "    " and resid 116  and name HG1 ))
   (( segid "    " and resid 113  and name HA  ))
      4.100     2.100     1.900 peak  4873 spectrum    1 weight  0.11000E+01 volume  0.58893E-03 ppm1      1.302 ppm2      3.293 CV     1
 ASSI { 4874}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 102  and name HB1 ))
      6.000     5.200     0.000 peak  4874 spectrum    1 weight  0.11000E+01 volume  0.77509E-04 ppm1      1.461 ppm2      2.562 CV     1
 ASSI { 4875}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 102  and name HB1 ))
      4.300     2.300     1.700 peak  4875 spectrum    1 weight  0.11000E+01 volume  0.38551E-03 ppm1      1.301 ppm2      2.578 CV     1
 ASSI { 4879}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 132  and name HA  ))
      4.000     2.000     2.000 peak  4879 spectrum    1 weight  0.11000E+01 volume  0.80664E-03 ppm1      1.099 ppm2      2.679 CV     1
 ASSI { 4880}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 132  and name HA  ))
      6.000     4.600     0.000 peak  4880 spectrum    1 weight  0.11000E+01 volume  0.63113E-04 ppm1      1.391 ppm2      2.692 CV     1
 ASSI { 4881}
   (( segid "    " and resid 114  and name HG1 ))
   (( segid "    " and resid 111  and name HE1 ))
      4.300     2.300     1.700 peak  4881 spectrum    1 weight  0.11000E+01 volume  0.35695E-03 ppm1      1.184 ppm2      7.585 CV     1
 ASSI { 4882}
   (( segid "    " and resid 114  and name HG1 ))
   (( segid "    " and resid 111  and name HA  ))
      4.100     2.100     1.900 peak  4882 spectrum    1 weight  0.11000E+01 volume  0.64212E-03 ppm1      1.197 ppm2      4.088 CV     1
 ASSI { 4883}
   (( segid "    " and resid 114  and name HG1 ))
   (( segid "    " and resid 118  and name HG2 ))
      5.100     3.200     0.900 peak  4883 spectrum    1 weight  0.11000E+01 volume  0.10185E-03 ppm1      1.189 ppm2      2.538 CV     1
 ASSI { 4886}
   (( segid "    " and resid 116  and name HG1 ))
   (( segid "    " and resid 119  and name HN  ))
      3.600     3.600     2.400 peak  4886 spectrum    1 weight  0.11000E+01 volume  0.10307E-02 ppm1      1.290 ppm2      7.910 CV     1
 ASSI { 4887}
   (( segid "    " and resid 116  and name HG1 ))
   (( segid "    " and resid 117  and name HN  ))
      5.900     4.300     0.100 peak  4887 spectrum    1 weight  0.11000E+01 volume  0.27435E-04 ppm1      1.299 ppm2      9.059 CV     1
 ASSI { 4889}
   (( segid "    " and resid 135  and name HG2 ))
   (  segid "    " and resid 135  and name HZ% )
      4.000     2.000     2.000 peak  4889 spectrum    1 weight  0.11000E+01 volume  0.79161E-03 ppm1      1.408 ppm2      7.926 CV     1
 ASSI { 4893}
   (( segid "    " and resid 91   and name HG1 ))
   (( segid "    " and resid 91   and name HN  ))
      3.700     1.700     1.700 peak  4893 spectrum    1 weight  0.11000E+01 volume  0.11680E-02 ppm1      1.547 ppm2      7.491 CV     1
 ASSI { 4895}
   (( segid "    " and resid 91   and name HG2 ))
   (( segid "    " and resid 90   and name HD1 ))
      5.800     4.200     0.200 peak  4895 spectrum    1 weight  0.11000E+01 volume  0.12955E-03 ppm1      1.541 ppm2      7.143 CV     1
 ASSI { 4896}
   (( segid "    " and resid 91   and name HG1 ))
   (( segid "    " and resid 90   and name HB1 ))
      6.000     6.000     0.000 peak  4896 spectrum    1 weight  0.11000E+01 volume  0.21168E-03 ppm1      1.497 ppm2      3.330 CV     1
 ASSI { 4899}
   (( segid "    " and resid 78   and name HG1 ))
   (( segid "    " and resid 78   and name HB1 ))
      2.500     0.800     0.800 peak  4899 spectrum    1 weight  0.11000E+01 volume  0.96640E-02 ppm1      1.431 ppm2      1.969 CV     1
 ASSI { 4903}
   (( segid "    " and resid 73   and name HD2 ))
   (( segid "    " and resid 75   and name HN  ))
      3.800     3.800     2.200 peak  4903 spectrum    1 weight  0.11000E+01 volume  0.16969E-02 ppm1      1.272 ppm2      7.286 CV     1
 ASSI { 4905}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 66   and name HN  ))
      3.500     1.500     1.500 peak  4905 spectrum    1 weight  0.11000E+01 volume  0.10164E-02 ppm1      1.464 ppm2      7.588 CV     1
 ASSI { 4910}
   (( segid "    " and resid 78   and name HG2 ))
   (( segid "    " and resid 79   and name HN  ))
      3.600     1.600     1.600 peak  4910 spectrum    1 weight  0.11000E+01 volume  0.99598E-03 ppm1      1.692 ppm2      7.539 CV     1
 ASSI { 4911}
   (  segid "    " and resid 117  and name HD1%)
   (( segid "    " and resid 119  and name HN  ))
      3.100     3.100     2.900 peak  4911 spectrum    1 weight  0.11000E+01 volume  0.59394E-03 ppm1      0.864 ppm2      7.910 CV     1
 ASSI { 4913}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 81   and name HN  ))
      4.100     2.100     1.900 peak  4913 spectrum    1 weight  0.11000E+01 volume  0.11333E-02 ppm1      0.854 ppm2      7.487 CV     1
 ASSI { 4914}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 113  and name HN  ))
      4.100     4.100     1.900 peak  4914 spectrum    1 weight  0.11000E+01 volume  0.13286E-02 ppm1      0.853 ppm2      7.696 CV     1
 ASSI { 4915}
   (  segid "    " and resid 126  and name HD1%)
   (( segid "    " and resid 126  and name HA  ))
      3.300     1.300     1.300 peak  4915 spectrum    1 weight  0.11000E+01 volume  0.14042E-02 ppm1      0.858 ppm2      4.190 CV     1
 ASSI { 4916}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 99   and name HA1 ))
      2.800     2.800     3.200 peak  4916 spectrum    1 weight  0.11000E+01 volume  0.10908E-02 ppm1      0.869 ppm2      3.777 CV     1
 ASSI { 4917}
   (  segid "    " and resid 126  and name HD1%)
   (( segid "    " and resid 127  and name HD1 ))
      5.400     3.700     0.600 peak  4917 spectrum    1 weight  0.11000E+01 volume  0.20279E-03 ppm1      0.869 ppm2      3.518 CV     1
 ASSI { 4920}
   (  segid "    " and resid 112  and name HD1%)
   (( segid "    " and resid 112  and name HN  ))
      4.600     2.600     1.400 peak  4920 spectrum    1 weight  0.11000E+01 volume  0.64737E-03 ppm1      0.817 ppm2      8.206 CV     1
 ASSI { 4923}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HN  ))
      6.000     5.000     0.000 peak  4923 spectrum    1 weight  0.11000E+01 volume  0.21254E-04 ppm1      2.107 ppm2      7.923 CV     1
 ASSI { 4924}
   (( segid "    " and resid 113  and name HG12))
   (( segid "    " and resid 76   and name HA  ))
      6.000     6.000     0.000 peak  4924 spectrum    1 weight  0.11000E+01 volume  0.59196E-05 ppm1      0.761 ppm2      3.986 CV     1
 ASSI { 4927}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HN  ))
      6.000     4.900     0.000 peak  4927 spectrum    1 weight  0.11000E+01 volume  0.21106E-04 ppm1      4.665 ppm2      7.790 CV     1
 ASSI {    1}
   (( segid "    " and resid 44   and name HZ2 ))
   (  segid "    " and resid 46   and name HG2%)
      3.500     1.600     1.600 peak     1 spectrum    1 weight  0.11000E+01 volume  0.56720E-03 ppm1      7.241 ppm2      0.505 CV     1
 ASSI {    2}
   (( segid "    " and resid 44   and name HZ2 ))
   (  segid "    " and resid 108  and name HD2%)
      3.300     1.400     1.400 peak     2 spectrum    1 weight  0.11000E+01 volume  0.16988E-02 ppm1      7.236 ppm2      1.178 CV     1
 ASSI {    4}
   (( segid "    " and resid 44   and name HZ2 ))
   (( segid "    " and resid 108  and name HB1 ))
      3.400     1.500     1.500 peak     4 spectrum    1 weight  0.11000E+01 volume  0.30619E-02 ppm1      7.237 ppm2      1.803 CV     1
 ASSI {    5}
   (( segid "    " and resid 44   and name HZ2 ))
   (( segid "    " and resid 108  and name HB2 ))
      3.400     1.400     1.400 peak     5 spectrum    1 weight  0.11000E+01 volume  0.83295E-03 ppm1      7.237 ppm2      2.600 CV     1
 ASSI {    6}
   (( segid "    " and resid 44   and name HZ2 ))
   (( segid "    " and resid 108  and name HA  ))
      3.300     1.300     1.300 peak     6 spectrum    1 weight  0.11000E+01 volume  0.69598E-03 ppm1      7.235 ppm2      4.048 CV     1
 ASSI {    9}
   (( segid "    " and resid 44   and name HD1 ))
   (  segid "    " and resid 130  and name HD1%)
      3.500     3.500     2.500 peak     9 spectrum    1 weight  0.11000E+01 volume  0.99873E-03 ppm1      7.477 ppm2      0.806 CV     1
 ASSI {   10}
   (( segid "    " and resid 44   and name HD1 ))
   (( segid "    " and resid 130  and name HB2 ))
      4.600     2.600     1.400 peak    10 spectrum    1 weight  0.11000E+01 volume  0.28496E-03 ppm1      7.479 ppm2      1.706 CV     1
 ASSI {   11}
   (( segid "    " and resid 44   and name HD1 ))
   (( segid "    " and resid 44   and name HB1 ))
      4.500     2.600     1.500 peak    11 spectrum    1 weight  0.11000E+01 volume  0.18769E-03 ppm1      7.508 ppm2      2.824 CV     1
 ASSI {   12}
   (( segid "    " and resid 44   and name HD1 ))
   (( segid "    " and resid 44   and name HB2 ))
      4.000     2.000     2.000 peak    12 spectrum    1 weight  0.11000E+01 volume  0.35209E-03 ppm1      7.475 ppm2      3.525 CV     1
 ASSI {   14}
   (( segid "    " and resid 90   and name HZ2 ))
   (  segid "    " and resid 101  and name HD2%)
      3.900     1.900     1.900 peak    14 spectrum    1 weight  0.11000E+01 volume  0.51786E-03 ppm1      7.155 ppm2      0.077 CV     1
 ASSI {   15}
   (( segid "    " and resid 90   and name HZ2 ))
   (  segid "    " and resid 100  and name HD1%)
      4.900     4.900     1.100 peak    15 spectrum    1 weight  0.11000E+01 volume  0.45895E-03 ppm1      7.162 ppm2      0.849 CV     1
 ASSI {   16}
   (( segid "    " and resid 90   and name HZ2 ))
   (( segid "    " and resid 94   and name HB1 ))
      3.900     1.900     1.900 peak    16 spectrum    1 weight  0.11000E+01 volume  0.41785E-03 ppm1      7.166 ppm2      1.198 CV     1
 ASSI {   17}
   (( segid "    " and resid 90   and name HZ2 ))
   (( segid "    " and resid 101  and name HG  ))
      3.800     1.800     1.800 peak    17 spectrum    1 weight  0.11000E+01 volume  0.60555E-03 ppm1      7.158 ppm2      1.567 CV     1
 ASSI {   19}
   (( segid "    " and resid 90   and name HZ2 ))
   (( segid "    " and resid 94   and name HB2 ))
      3.800     1.800     1.800 peak    19 spectrum    1 weight  0.11000E+01 volume  0.29318E-03 ppm1      7.160 ppm2      2.231 CV     1
 ASSI {   26}
   (( segid "    " and resid 111  and name HD2 ))
   (  segid "    " and resid 108  and name HD1%)
      4.100     4.100     1.900 peak    26 spectrum    1 weight  0.11000E+01 volume  0.60415E-03 ppm1      6.263 ppm2      1.165 CV     1
 ASSI {   27}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 112  and name HG  ))
      3.700     1.700     1.700 peak    27 spectrum    1 weight  0.11000E+01 volume  0.42744E-03 ppm1      6.254 ppm2      1.976 CV     1
 ASSI {   28}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HB1 ))
      3.500     1.500     1.500 peak    28 spectrum    1 weight  0.11000E+01 volume  0.30962E-03 ppm1      6.258 ppm2      3.013 CV     1
 ASSI {   30}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 112  and name HA  ))
      3.900     1.900     1.900 peak    30 spectrum    1 weight  0.11000E+01 volume  0.30825E-03 ppm1      6.258 ppm2      3.838 CV     1
 ASSI {   31}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HA  ))
      4.600     2.700     1.400 peak    31 spectrum    1 weight  0.11000E+01 volume  0.25756E-03 ppm1      6.268 ppm2      4.087 CV     1
 ASSI {   32}
   (  segid "    " and resid 58   and name HE% )
   (( segid "    " and resid 62   and name HG1 ))
      3.800     1.800     1.800 peak    32 spectrum    1 weight  0.11000E+01 volume  0.83844E-03 ppm1      6.877 ppm2      1.244 CV     1
 ASSI {   33}
   (  segid "    " and resid 58   and name HE% )
   (( segid "    " and resid 62   and name HG2 ))
      3.200     3.200     2.800 peak    33 spectrum    1 weight  0.11000E+01 volume  0.81103E-03 ppm1      6.879 ppm2      1.870 CV     1
 ASSI {   37}
   (( segid "    " and resid 129  and name HD2 ))
   (  segid "    " and resid 130  and name HD2%)
      3.700     1.700     1.700 peak    37 spectrum    1 weight  0.11000E+01 volume  0.13042E-02 ppm1      6.885 ppm2      0.607 CV     1
 ASSI {   38}
   (  segid "    " and resid 53   and name HE% )
   (  segid "    " and resid 46   and name HG2%)
      3.000     1.100     1.100 peak    38 spectrum    1 weight  0.11000E+01 volume  0.15455E-02 ppm1      6.738 ppm2      0.503 CV     1
 ASSI {   40}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 110  and name HB1 ))
      3.300     3.300     2.700 peak    40 spectrum    1 weight  0.11000E+01 volume  0.69911E-03 ppm1      6.733 ppm2      1.378 CV     1
 ASSI {   41}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 50   and name HG2 ))
      4.400     2.400     1.600 peak    41 spectrum    1 weight  0.11000E+01 volume  0.12019E-02 ppm1      6.735 ppm2      1.825 CV     1
 ASSI {   42}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 50   and name HB2 ))
      3.300     3.300     2.700 peak    42 spectrum    1 weight  0.11000E+01 volume  0.19180E-02 ppm1      6.736 ppm2      2.306 CV     1
 ASSI {   43}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 111  and name HB2 ))
      3.100     3.100     2.900 peak    43 spectrum    1 weight  0.11000E+01 volume  0.81599E-03 ppm1      6.738 ppm2      3.257 CV     1
 ASSI {   44}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 51   and name HD2 ))
      2.600     2.600     3.400 peak    44 spectrum    1 weight  0.11000E+01 volume  0.10960E-02 ppm1      6.737 ppm2      3.785 CV     1
 ASSI {   45}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 50   and name HA  ))
      3.700     1.700     1.700 peak    45 spectrum    1 weight  0.11000E+01 volume  0.10908E-02 ppm1      6.739 ppm2      4.049 CV     1
 ASSI {   55}
   (  segid "    " and resid 58   and name HE% )
   (( segid "    " and resid 57   and name HB1 ))
      3.600     1.600     1.600 peak    55 spectrum    1 weight  0.11000E+01 volume  0.12193E-02 ppm1      6.879 ppm2      3.076 CV     1
 ASSI {   58}
   (  segid "    " and resid 58   and name HE% )
   (( segid "    " and resid 55   and name HA  ))
      2.900     2.900     3.100 peak    58 spectrum    1 weight  0.11000E+01 volume  0.66307E-03 ppm1      6.879 ppm2      4.145 CV     1
 ASSI {   60}
   (( segid "    " and resid 90   and name HZ3 ))
   (  segid "    " and resid 101  and name HD2%)
      3.800     1.800     1.800 peak    60 spectrum    1 weight  0.11000E+01 volume  0.61788E-03 ppm1      6.843 ppm2      0.061 CV     1
 ASSI {   61}
   (( segid "    " and resid 90   and name HH2 ))
   (  segid "    " and resid 101  and name HD2%)
      3.600     1.600     1.600 peak    61 spectrum    1 weight  0.11000E+01 volume  0.74257E-03 ppm1      6.778 ppm2      0.062 CV     1
 ASSI {   62}
   (( segid "    " and resid 120  and name HD2 ))
   (  segid "    " and resid 115  and name HG1%)
      2.400     0.700     0.700 peak    62 spectrum    1 weight  0.11000E+01 volume  0.34538E-02 ppm1      7.176 ppm2      0.667 CV     1
 ASSI {   63}
   (( segid "    " and resid 120  and name HD2 ))
   (( segid "    " and resid 118  and name HB2 ))
      2.200     2.200     3.800 peak    63 spectrum    1 weight  0.11000E+01 volume  0.62487E-02 ppm1      7.175 ppm2      2.162 CV     1
 ASSI {   65}
   (( segid "    " and resid 120  and name HD2 ))
   (( segid "    " and resid 120  and name HB1 ))
      2.700     0.900     0.900 peak    65 spectrum    1 weight  0.11000E+01 volume  0.15837E-02 ppm1      7.176 ppm2      2.868 CV     1
 ASSI {   66}
   (( segid "    " and resid 120  and name HD2 ))
   (( segid "    " and resid 120  and name HB2 ))
      3.600     1.600     1.600 peak    66 spectrum    1 weight  0.11000E+01 volume  0.15029E-02 ppm1      7.174 ppm2      3.067 CV     1
 ASSI {   68}
   (( segid "    " and resid 120  and name HD2 ))
   (( segid "    " and resid 115  and name HA  ))
      3.000     1.100     1.100 peak    68 spectrum    1 weight  0.11000E+01 volume  0.23003E-02 ppm1      7.176 ppm2      3.728 CV     1
 ASSI {   70}
   (( segid "    " and resid 138  and name HD2 ))
   (( segid "    " and resid 138  and name HB2 ))
      2.900     1.100     1.100 peak    70 spectrum    1 weight  0.11000E+01 volume  0.28455E-02 ppm1      7.142 ppm2      3.134 CV     1
 ASSI {   72}
   (( segid "    " and resid 44   and name HH2 ))
   (( segid "    " and resid 108  and name HA  ))
      3.700     1.700     1.700 peak    72 spectrum    1 weight  0.11000E+01 volume  0.10220E-02 ppm1      7.322 ppm2      4.051 CV     1
 ASSI {   73}
   (( segid "    " and resid 44   and name HH2 ))
   (( segid "    " and resid 108  and name HB2 ))
      3.500     3.500     2.500 peak    73 spectrum    1 weight  0.11000E+01 volume  0.26989E-03 ppm1      7.352 ppm2      2.549 CV     1
 ASSI {   74}
   (( segid "    " and resid 44   and name HH2 ))
   (( segid "    " and resid 112  and name HG  ))
      4.400     2.400     1.600 peak    74 spectrum    1 weight  0.11000E+01 volume  0.78226E-03 ppm1      7.318 ppm2      1.982 CV     1
 ASSI {   75}
   (( segid "    " and resid 44   and name HH2 ))
   (( segid "    " and resid 108  and name HB1 ))
      3.300     1.400     1.400 peak    75 spectrum    1 weight  0.11000E+01 volume  0.29839E-02 ppm1      7.321 ppm2      1.811 CV     1
 ASSI {   76}
   (( segid "    " and resid 44   and name HH2 ))
   (  segid "    " and resid 46   and name HG2%)
      4.200     2.200     1.800 peak    76 spectrum    1 weight  0.11000E+01 volume  0.41648E-03 ppm1      7.318 ppm2      0.507 CV     1
 ASSI {   77}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 91   and name HA  ))
      2.700     0.900     0.900 peak    77 spectrum    1 weight  0.11000E+01 volume  0.31688E-02 ppm1      7.126 ppm2      3.891 CV     1
 ASSI {   78}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 90   and name HB2 ))
      3.800     1.800     1.800 peak    78 spectrum    1 weight  0.11000E+01 volume  0.13084E-02 ppm1      7.128 ppm2      3.422 CV     1
 ASSI {   79}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 91   and name HB1 ))
      3.000     1.100     1.100 peak    79 spectrum    1 weight  0.11000E+01 volume  0.13303E-02 ppm1      7.130 ppm2      1.970 CV     1
 ASSI {   80}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 91   and name HG1 ))
      4.800     2.900     1.200 peak    80 spectrum    1 weight  0.11000E+01 volume  0.71790E-03 ppm1      7.123 ppm2      1.581 CV     1
 ASSI {   87}
   (( segid "    " and resid 106  and name HZ  ))
   (( segid "    " and resid 56   and name HG11))
      3.100     3.100     2.900 peak    87 spectrum    1 weight  0.11000E+01 volume  0.41237E-03 ppm1      7.283 ppm2      1.278 CV     1
 ASSI {   88}
   (( segid "    " and resid 106  and name HZ  ))
   (  segid "    " and resid 56   and name HD1%)
      4.600     2.700     1.400 peak    88 spectrum    1 weight  0.11000E+01 volume  0.33291E-03 ppm1      7.280 ppm2      1.064 CV     1
 ASSI {   96}
   (( segid "    " and resid 111  and name HE1 ))
   (( segid "    " and resid 111  and name HB1 ))
      5.300     3.500     0.700 peak    96 spectrum    1 weight  0.11000E+01 volume  0.23564E-03 ppm1      7.551 ppm2      2.981 CV     1
 ASSI {   97}
   (( segid "    " and resid 129  and name HE1 ))
   (  segid "    " and resid 130  and name HD1%)
      4.300     2.300     1.700 peak    97 spectrum    1 weight  0.11000E+01 volume  0.83295E-03 ppm1      7.784 ppm2      0.783 CV     1
 ASSI {   98}
   (( segid "    " and resid 129  and name HE1 ))
   (( segid "    " and resid 127  and name HG1 ))
      3.800     1.800     1.800 peak    98 spectrum    1 weight  0.11000E+01 volume  0.11933E-02 ppm1      7.786 ppm2      1.547 CV     1
 ASSI {  100}
   (( segid "    " and resid 129  and name HE1 ))
   (( segid "    " and resid 127  and name HG2 ))
      3.400     1.400     1.400 peak   100 spectrum    1 weight  0.11000E+01 volume  0.17056E-02 ppm1      7.784 ppm2      2.122 CV     1
 ASSI {  101}
   (( segid "    " and resid 129  and name HE1 ))
   (( segid "    " and resid 127  and name HB2 ))
      3.100     1.200     1.200 peak   101 spectrum    1 weight  0.11000E+01 volume  0.12769E-02 ppm1      7.783 ppm2      2.482 CV     1
 ASSI {  102}
   (( segid "    " and resid 129  and name HE1 ))
   (( segid "    " and resid 128  and name HD2 ))
      3.700     1.700     1.700 peak   102 spectrum    1 weight  0.11000E+01 volume  0.40141E-03 ppm1      7.785 ppm2      3.891 CV     1
 ASSI {  103}
   (( segid "    " and resid 129  and name HE1 ))
   (( segid "    " and resid 127  and name HD2 ))
      5.400     3.700     0.600 peak   103 spectrum    1 weight  0.11000E+01 volume  0.31510E-03 ppm1      7.787 ppm2      4.123 CV     1
 ASSI {  104}
   (( segid "    " and resid 111  and name HE1 ))
   (  segid "    " and resid 115  and name HG2%)
      3.900     1.900     1.900 peak   104 spectrum    1 weight  0.11000E+01 volume  0.58772E-03 ppm1      7.553 ppm2      0.668 CV     1
 ASSI {  107}
   (  segid "    " and resid 57   and name HD% )
   (  segid "    " and resid 67   and name HD1%)
      3.000     3.000     3.000 peak   107 spectrum    1 weight  0.11000E+01 volume  0.11590E-02 ppm1      7.582 ppm2      0.449 CV     1
 ASSI {  108}
   (  segid "    " and resid 57   and name HD% )
   (( segid "    " and resid 62   and name HB1 ))
      3.600     3.600     2.400 peak   108 spectrum    1 weight  0.11000E+01 volume  0.43703E-03 ppm1      7.592 ppm2      1.146 CV     1
 ASSI {  109}
   (  segid "    " and resid 57   and name HD% )
   (( segid "    " and resid 62   and name HG2 ))
      4.200     2.200     1.800 peak   109 spectrum    1 weight  0.11000E+01 volume  0.49185E-03 ppm1      7.590 ppm2      1.837 CV     1
 ASSI {  112}
   (  segid "    " and resid 57   and name HD% )
   (( segid "    " and resid 58   and name HA  ))
      3.700     1.800     1.800 peak   112 spectrum    1 weight  0.11000E+01 volume  0.30688E-03 ppm1      7.584 ppm2      3.993 CV     1
 ASSI {  127}
   (  segid "    " and resid 106  and name HD% )
   (( segid "    " and resid 56   and name HB  ))
      3.300     3.300     2.700 peak   127 spectrum    1 weight  0.11000E+01 volume  0.15193E-02 ppm1      7.432 ppm2      2.400 CV     1
 ASSI {  140}
   (  segid "    " and resid 53   and name HD% )
   (( segid "    " and resid 51   and name HD2 ))
      2.600     2.600     3.400 peak   140 spectrum    1 weight  0.11000E+01 volume  0.13659E-02 ppm1      6.741 ppm2      3.788 CV     1
 ASSI {  142}
   (( segid "    " and resid 57   and name HZ  ))
   (( segid "    " and resid 57   and name HB2 ))
      4.300     4.300     1.700 peak   142 spectrum    1 weight  0.11000E+01 volume  0.60006E-03 ppm1      6.816 ppm2      3.221 CV     1
 ASSI {  143}
   (  segid "    " and resid 53   and name HD% )
   (( segid "    " and resid 50   and name HB2 ))
      4.100     2.100     1.900 peak   143 spectrum    1 weight  0.11000E+01 volume  0.63802E-03 ppm1      6.745 ppm2      2.321 CV     1
 ASSI {  144}
   (  segid "    " and resid 53   and name HD% )
   (( segid "    " and resid 50   and name HG2 ))
      3.700     1.700     1.700 peak   144 spectrum    1 weight  0.11000E+01 volume  0.21812E-02 ppm1      6.747 ppm2      1.826 CV     1
 ASSI {  145}
   (( segid "    " and resid 57   and name HZ  ))
   (( segid "    " and resid 62   and name HG2 ))
      3.700     1.700     1.700 peak   145 spectrum    1 weight  0.11000E+01 volume  0.81103E-03 ppm1      6.829 ppm2      1.823 CV     1
 ASSI {  146}
   (( segid "    " and resid 57   and name HZ  ))
   (( segid "    " and resid 67   and name HG12))
      4.600     2.600     1.400 peak   146 spectrum    1 weight  0.11000E+01 volume  0.73842E-03 ppm1      6.831 ppm2      1.475 CV     1
 ASSI {  148}
   (  segid "    " and resid 53   and name HD% )
   (  segid "    " and resid 52   and name HG2%)
      2.900     2.900     3.100 peak   148 spectrum    1 weight  0.11000E+01 volume  0.18194E-02 ppm1      6.748 ppm2      1.093 CV     1
 ASSI {  149}
   (( segid "    " and resid 57   and name HZ  ))
   (( segid "    " and resid 62   and name HG1 ))
      3.900     1.900     1.900 peak   149 spectrum    1 weight  0.11000E+01 volume  0.40278E-03 ppm1      6.835 ppm2      1.226 CV     1
 ASSI {  150}
   (( segid "    " and resid 57   and name HZ  ))
   (  segid "    " and resid 67   and name HD1%)
      5.100     5.100     0.900 peak   150 spectrum    1 weight  0.11000E+01 volume  0.69733E-03 ppm1      6.829 ppm2      0.458 CV     1
 ASSI {  156}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 62   and name HG1 ))
      3.600     1.600     1.600 peak   156 spectrum    1 weight  0.11000E+01 volume  0.25715E-03 ppm1      7.262 ppm2      1.281 CV     1
 ASSI {  157}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 103  and name HB1 ))
      3.600     1.600     1.600 peak   157 spectrum    1 weight  0.11000E+01 volume  0.23427E-03 ppm1      7.261 ppm2      1.727 CV     1
 ASSI {  162}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 94   and name HB1 ))
      4.000     2.000     2.000 peak   162 spectrum    1 weight  0.11000E+01 volume  0.31784E-03 ppm1      7.128 ppm2      1.190 CV     1
 ASSI {  163}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 94   and name HB2 ))
      4.700     2.800     1.300 peak   163 spectrum    1 weight  0.11000E+01 volume  0.25482E-03 ppm1      7.120 ppm2      2.227 CV     1
 ASSI {  168}
   (( segid "    " and resid 44   and name HH2 ))
   (( segid "    " and resid 46   and name HB  ))
      4.400     2.400     1.600 peak   168 spectrum    1 weight  0.11000E+01 volume  0.33291E-03 ppm1      7.334 ppm2     -1.223 CV     1
 ASSI {  169}
   (( segid "    " and resid 44   and name HH2 ))
   (  segid "    " and resid 46   and name HG1%)
      4.600     2.600     1.400 peak   169 spectrum    1 weight  0.11000E+01 volume  0.19454E-03 ppm1      7.316 ppm2     -0.198 CV     1
 ASSI {  170}
   (( segid "    " and resid 90   and name HH2 ))
   (  segid "    " and resid 101  and name HD1%)
      3.500     1.500     1.500 peak   170 spectrum    1 weight  0.11000E+01 volume  0.10028E-02 ppm1      6.777 ppm2      0.835 CV     1
 ASSI {  171}
   (( segid "    " and resid 90   and name HH2 ))
   (( segid "    " and resid 101  and name HG  ))
      2.700     0.900     0.900 peak   171 spectrum    1 weight  0.11000E+01 volume  0.11878E-02 ppm1      6.784 ppm2      1.577 CV     1
 ASSI {  172}
   (( segid "    " and resid 90   and name HH2 ))
   (  segid "    " and resid 72   and name HB% )
      3.600     1.600     1.600 peak   172 spectrum    1 weight  0.11000E+01 volume  0.10974E-02 ppm1      6.777 ppm2      1.779 CV     1
 ASSI {  173}
   (( segid "    " and resid 90   and name HH2 ))
   (( segid "    " and resid 69   and name HA1 ))
      4.000     2.000     2.000 peak   173 spectrum    1 weight  0.11000E+01 volume  0.59731E-03 ppm1      6.772 ppm2      3.580 CV     1
 ASSI {  179}
   (( segid "    " and resid 90   and name HZ3 ))
   (( segid "    " and resid 101  and name HG  ))
      3.000     1.100     1.100 peak   179 spectrum    1 weight  0.11000E+01 volume  0.98090E-03 ppm1      6.845 ppm2      1.571 CV     1
 ASSI {  181}
   (( segid "    " and resid 90   and name HZ3 ))
   (( segid "    " and resid 69   and name HA1 ))
      5.100     3.300     0.900 peak   181 spectrum    1 weight  0.11000E+01 volume  0.30551E-03 ppm1      6.837 ppm2      3.566 CV     1
 ASSI {  182}
   (( segid "    " and resid 90   and name HZ3 ))
   (( segid "    " and resid 69   and name HA2 ))
      3.400     1.400     1.400 peak   182 spectrum    1 weight  0.11000E+01 volume  0.61514E-03 ppm1      6.847 ppm2      3.817 CV     1
 ASSI {  186}
   (( segid "    " and resid 44   and name HZ3 ))
   (( segid "    " and resid 46   and name HB  ))
      4.300     2.300     1.700 peak   186 spectrum    1 weight  0.11000E+01 volume  0.30962E-03 ppm1      7.107 ppm2     -1.235 CV     1
 ASSI {  193}
   (( segid "    " and resid 90   and name HE3 ))
   (  segid "    " and resid 76   and name HE% )
      2.900     1.000     1.000 peak   193 spectrum    1 weight  0.11000E+01 volume  0.13454E-02 ppm1      7.302 ppm2      2.119 CV     1
 ASSI {  195}
   (( segid "    " and resid 90   and name HE3 ))
   (  segid "    " and resid 109  and name HB% )
      3.900     1.900     1.900 peak   195 spectrum    1 weight  0.11000E+01 volume  0.60964E-03 ppm1      7.305 ppm2      1.198 CV     1
 ASSI {  196}
   (( segid "    " and resid 90   and name HE3 ))
   (  segid "    " and resid 101  and name HD1%)
      3.200     1.200     1.200 peak   196 spectrum    1 weight  0.11000E+01 volume  0.13577E-02 ppm1      7.309 ppm2      0.829 CV     1
 ASSI {  198}
   (( segid "    " and resid 90   and name HE3 ))
   (( segid "    " and resid 101  and name HG  ))
      4.700     2.800     1.300 peak   198 spectrum    1 weight  0.11000E+01 volume  0.22194E-03 ppm1      7.305 ppm2      1.588 CV     1
 ASSI {  200}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 46   and name HB  ))
      3.400     3.400     2.600 peak   200 spectrum    1 weight  0.11000E+01 volume  0.23016E-03 ppm1      6.248 ppm2     -1.203 CV     1
 ASSI {  201}
   (( segid "    " and resid 111  and name HD2 ))
   (  segid "    " and resid 130  and name HD2%)
      3.000     1.100     1.100 peak   201 spectrum    1 weight  0.11000E+01 volume  0.13645E-02 ppm1      6.259 ppm2      0.616 CV     1
 ASSI {  202}
   (( segid "    " and resid 129  and name HD2 ))
   (( segid "    " and resid 127  and name HG2 ))
      4.000     2.000     2.000 peak   202 spectrum    1 weight  0.11000E+01 volume  0.30414E-03 ppm1      6.893 ppm2      2.130 CV     1
 ASSI {  205}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 91   and name HD1 ))
      4.500     2.500     1.500 peak   205 spectrum    1 weight  0.11000E+01 volume  0.73842E-03 ppm1      7.121 ppm2      1.714 CV     1
 ASSI {  206}
   (( segid "    " and resid 44   and name HH2 ))
   (  segid "    " and resid 108  and name HD1%)
      3.800     1.800     1.800 peak   206 spectrum    1 weight  0.11000E+01 volume  0.24934E-03 ppm1      7.318 ppm2      1.173 CV     1
 ASSI {  213}
   (( segid "    " and resid 57   and name HZ  ))
   (( segid "    " and resid 62   and name HD1 ))
      5.000     3.100     1.000 peak   213 spectrum    1 weight  0.11000E+01 volume  0.43703E-03 ppm1      6.829 ppm2      3.083 CV     1
 ASSI {  216}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 62   and name HB2 ))
      4.500     2.600     1.500 peak   216 spectrum    1 weight  0.11000E+01 volume  0.21372E-03 ppm1      7.258 ppm2      1.497 CV     1

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1 -50.376  32.260  28.319
    2    H2   GLY   1           HT2      GLY   1 -51.340  33.379  27.490
    3    H3   GLY   1           HT3      GLY   1 -49.648  33.413  27.314
    4    HA2  GLY   1           HA1      GLY   1 -49.668  31.267  26.240
    5    HA3  GLY   1           HA2      GLY   1 -51.410  31.189  26.453
    6    HA   PRO   2           HA       PRO   2 -50.834  32.989  22.334
    7    HB2  PRO   2           HB2      PRO   2 -52.821  31.458  21.176
    8    HB3  PRO   2           HB1      PRO   2 -51.126  30.996  21.295
    9    HG2  PRO   2           HG2      PRO   2 -53.387  29.835  22.633
   10    HG3  PRO   2           HG1      PRO   2 -51.693  29.330  22.699
   11    HD2  PRO   2           HD2      PRO   2 -53.252  30.905  24.625
   12    HD3  PRO   2           HD1      PRO   2 -51.723  30.035  24.853
   13    H    LEU   3           HN       LEU   3 -53.139  33.408  24.584
   14    HA   LEU   3           HA       LEU   3 -54.867  34.997  22.811
   15    HG   LEU   3           HG       LEU   3 -57.834  34.347  24.945
   16    HB2  LEU   3           HB2      LEU   3 -55.831  33.213  24.409
   17    HB3  LEU   3           HB1      LEU   3 -55.436  34.328  25.697
   18   HD11  LEU   3          HD11      LEU   3 -58.078  36.764  24.991
   19   HD12  LEU   3          HD12      LEU   3 -56.357  36.959  24.655
   20   HD13  LEU   3          HD13      LEU   3 -56.884  36.227  26.171
   21   HD21  LEU   3          HD21      LEU   3 -56.673  35.648  22.488
   22   HD22  LEU   3          HD22      LEU   3 -58.388  35.514  22.880
   23   HD23  LEU   3          HD23      LEU   3 -57.439  34.062  22.559
   24    H    GLY   4           HN       GLY   4 -54.609  37.143  22.834
   25    HA2  GLY   4           HA2      GLY   4 -54.202  39.261  23.764
   26    HA3  GLY   4           HA1      GLY   4 -53.631  38.487  25.239
   27    H    SER   5           HN       SER   5 -52.224  36.870  22.828
   28    HA   SER   5           HA       SER   5 -50.204  38.663  21.936
   29    HG   SER   5           HG       SER   5 -47.959  38.402  22.333
   30    HB2  SER   5           HB2      SER   5 -49.410  38.207  24.273
   31    HB3  SER   5           HB1      SER   5 -49.355  36.491  23.878
   32    H    GLU   6           HN       GLU   6 -49.416  37.893  20.047
   33    HA   GLU   6           HA       GLU   6 -50.564  35.449  19.083
   34    HB2  GLU   6           HB2      GLU   6 -49.293  35.999  16.970
   35    HB3  GLU   6           HB1      GLU   6 -50.481  37.186  17.484
   36    HG2  GLU   6           HG2      GLU   6 -47.550  37.449  18.102
   37    HG3  GLU   6           HG1      GLU   6 -48.274  38.066  16.620
   38    H    SER   7           HN       SER   7 -49.772  33.545  19.411
   39    HA   SER   7           HA       SER   7 -46.998  33.166  20.125
   40    HG   SER   7           HG       SER   7 -46.736  30.960  21.190
   41    HB2  SER   7           HB2      SER   7 -48.812  31.913  21.292
   42    HB3  SER   7           HB1      SER   7 -49.199  31.110  19.771
   43    H    LEU   8           HN       LEU   8 -45.719  33.453  18.405
   44    HA   LEU   8           HA       LEU   8 -46.461  32.335  15.831
   45    HG   LEU   8           HG       LEU   8 -42.989  33.228  16.897
   46    HB2  LEU   8           HB2      LEU   8 -44.571  33.509  14.916
   47    HB3  LEU   8           HB1      LEU   8 -45.489  34.604  15.923
   48   HD11  LEU   8          HD11      LEU   8 -41.791  35.295  16.379
   49   HD12  LEU   8          HD12      LEU   8 -43.235  35.934  15.595
   50   HD13  LEU   8          HD13      LEU   8 -42.418  34.524  14.921
   51   HD21  LEU   8          HD21      LEU   8 -44.459  34.133  18.628
   52   HD22  LEU   8          HD22      LEU   8 -44.433  35.707  17.831
   53   HD23  LEU   8          HD23      LEU   8 -42.953  35.044  18.524
   54    H    MET   9           HN       MET   9 -45.464  30.654  14.841
   55    HA   MET   9           HA       MET   9 -43.977  28.812  16.432
   56    HB2  MET   9           HB2      MET   9 -44.400  28.834  13.430
   57    HB3  MET   9           HB1      MET   9 -43.867  27.460  14.391
   58    HG2  MET   9           HG2      MET   9 -46.552  28.808  14.593
   59    HG3  MET   9           HG1      MET   9 -46.222  27.292  13.758
   60    HE1  MET   9           HE1      MET   9 -44.219  25.799  15.615
   61    HE2  MET   9           HE2      MET   9 -45.659  25.000  14.982
   62    HE3  MET   9           HE3      MET   9 -45.278  24.899  16.701
   63    HA   PRO  10           HA       PRO  10 -39.819  30.256  16.014
   64    HB2  PRO  10           HB2      PRO  10 -38.666  27.773  15.318
   65    HB3  PRO  10           HB1      PRO  10 -38.829  28.442  16.943
   66    HG2  PRO  10           HG2      PRO  10 -40.540  26.463  15.527
   67    HG3  PRO  10           HG1      PRO  10 -40.140  26.580  17.250
   68    HD2  PRO  10           HD2      PRO  10 -42.544  27.310  16.342
   69    HD3  PRO  10           HD1      PRO  10 -41.741  28.225  17.638
   70    H    SER  11           HN       SER  11 -40.724  27.846  13.551
   71    HA   SER  11           HA       SER  11 -39.493  29.587  11.535
   72    HG   SER  11           HG       SER  11 -38.908  28.550   9.636
   73    HB2  SER  11           HB2      SER  11 -38.616  27.240  11.682
   74    HB3  SER  11           HB1      SER  11 -40.228  26.659  11.260
   75    H    GLN  12           HN       GLN  12 -40.946  30.854  10.589
   76    HA   GLN  12           HA       GLN  12 -43.743  30.178  10.683
   77    HB2  GLN  12           HB2      GLN  12 -42.936  32.499  11.031
   78    HB3  GLN  12           HB1      GLN  12 -42.377  32.532   9.363
   79    HG2  GLN  12           HG2      GLN  12 -44.491  33.678   9.567
   80    HG3  GLN  12           HG1      GLN  12 -44.670  32.225   8.587
   81   HE21  GLN  12          HE21      GLN  12 -44.409  32.173  12.069
   82   HE22  GLN  12          HE22      GLN  12 -46.030  31.656  12.368
   83    H    VAL  13           HN       VAL  13 -44.163  28.473   9.359
   84    HA   VAL  13           HA       VAL  13 -43.535  28.826   6.504
   85    HB   VAL  13           HB       VAL  13 -43.859  26.388   6.254
   86   HG11  VAL  13          HG11      VAL  13 -41.831  27.150   8.354
   87   HG12  VAL  13          HG12      VAL  13 -41.615  27.270   6.608
   88   HG13  VAL  13          HG13      VAL  13 -41.793  25.689   7.370
   89   HG21  VAL  13          HG21      VAL  13 -43.941  24.964   8.251
   90   HG22  VAL  13          HG22      VAL  13 -45.370  25.989   8.106
   91   HG23  VAL  13          HG23      VAL  13 -44.100  26.406   9.256
   92    H    VAL  14           HN       VAL  14 -45.131  28.671   4.989
   93    HA   VAL  14           HA       VAL  14 -47.856  28.805   6.076
   94    HB   VAL  14           HB       VAL  14 -47.279  30.865   5.002
   95   HG11  VAL  14          HG11      VAL  14 -45.427  30.124   3.629
   96   HG12  VAL  14          HG12      VAL  14 -46.596  31.018   2.657
   97   HG13  VAL  14          HG13      VAL  14 -46.534  29.258   2.564
   98   HG21  VAL  14          HG21      VAL  14 -48.982  30.990   3.229
   99   HG22  VAL  14          HG22      VAL  14 -49.554  30.128   4.657
  100   HG23  VAL  14          HG23      VAL  14 -49.079  29.228   3.217
  101    H    LYS  15           HN       LYS  15 -48.986  27.012   5.826
  102    HA   LYS  15           HA       LYS  15 -48.521  25.346   3.459
  103    HB2  LYS  15           HB2      LYS  15 -49.916  24.735   6.071
  104    HB3  LYS  15           HB1      LYS  15 -49.858  23.630   4.704
  105    HG2  LYS  15           HG2      LYS  15 -47.436  23.538   4.855
  106    HG3  LYS  15           HG1      LYS  15 -47.464  24.694   6.184
  107    HD2  LYS  15           HD2      LYS  15 -48.627  23.130   7.595
  108    HD3  LYS  15           HD1      LYS  15 -48.806  21.994   6.255
  109    HE2  LYS  15           HE2      LYS  15 -46.412  21.670   6.159
  110    HE3  LYS  15           HE1      LYS  15 -46.161  22.901   7.393
  111    HZ1  LYS  15           HZ1      LYS  15 -47.679  20.383   7.859
  112    HZ2  LYS  15           HZ2      LYS  15 -47.181  21.523   9.017
  113    HZ3  LYS  15           HZ3      LYS  15 -46.031  20.582   8.206
  114    H    GLY  16           HN       GLY  16 -49.632  26.590   1.971
  115    HA2  GLY  16           HA2      GLY  16 -52.256  27.606   2.436
  116    HA3  GLY  16           HA1      GLY  16 -51.407  27.584   0.901
  117    H    GLY  17           HN       GLY  17 -53.977  26.360   2.624
  118    HA2  GLY  17           HA2      GLY  17 -55.702  25.037   1.806
  119    HA3  GLY  17           HA1      GLY  17 -54.696  24.627   0.424
  120    H    ALA  18           HN       ALA  18 -52.858  24.144   3.111
  121    HA   ALA  18           HA       ALA  18 -53.429  21.264   3.011
  122    HB1  ALA  18           HB1      ALA  18 -50.915  22.675   3.888
  123    HB2  ALA  18           HB2      ALA  18 -51.183  21.957   2.298
  124    HB3  ALA  18           HB3      ALA  18 -51.145  20.934   3.734
  125    H    PHE  19           HN       PHE  19 -54.965  21.017   4.590
  126    HA   PHE  19           HA       PHE  19 -54.538  22.025   7.250
  127    HD1  PHE  19           HD1      PHE  19 -57.241  21.706   4.433
  128    HD2  PHE  19           HD2      PHE  19 -56.615  18.149   6.692
  129    HE1  PHE  19           HE1      PHE  19 -58.214  20.376   2.607
  130    HE2  PHE  19           HE2      PHE  19 -57.578  16.818   4.863
  131    HZ   PHE  19           HZ       PHE  19 -58.380  17.931   2.819
  132    HB2  PHE  19           HB2      PHE  19 -56.466  20.319   7.734
  133    HB3  PHE  19           HB1      PHE  19 -56.812  21.789   6.835
  134    H    ASP  20           HN       ASP  20 -52.918  21.267   8.389
  135    HA   ASP  20           HA       ASP  20 -51.790  18.665   7.735
  136    HB2  ASP  20           HB2      ASP  20 -50.409  20.768   7.885
  137    HB3  ASP  20           HB1      ASP  20 -50.693  20.753   9.623
  138    H    GLY  21           HN       GLY  21 -52.096  16.918   8.906
  139    HA2  GLY  21           HA2      GLY  21 -52.778  17.245  11.756
  140    HA3  GLY  21           HA1      GLY  21 -53.525  16.017  10.740
  141    H    THR  22           HN       THR  22 -50.283  17.148  11.670
  142    HA   THR  22           HA       THR  22 -49.057  14.624  11.265
  143    HB   THR  22           HB       THR  22 -48.116  16.986  12.911
  144    HG1  THR  22           HG1      THR  22 -48.394  17.430  10.639
  145   HG21  THR  22          HG21      THR  22 -45.881  16.009  12.705
  146   HG22  THR  22          HG22      THR  22 -46.558  14.617  11.860
  147   HG23  THR  22          HG23      THR  22 -46.972  14.909  13.549
  148    H    MET  23           HN       MET  23 -49.571  12.885  12.415
  149    HA   MET  23           HA       MET  23 -50.470  13.021  15.133
  150    HB2  MET  23           HB2      MET  23 -49.627  10.650  13.451
  151    HB3  MET  23           HB1      MET  23 -50.369  10.545  15.040
  152    HG2  MET  23           HG2      MET  23 -52.388  11.579  14.201
  153    HG3  MET  23           HG1      MET  23 -51.648  11.781  12.615
  154    HE1  MET  23           HE1      MET  23 -50.937   9.756  11.063
  155    HE2  MET  23           HE2      MET  23 -51.267   8.063  11.428
  156    HE3  MET  23           HE3      MET  23 -50.059   8.946  12.362
  157    H    ASN  24           HN       ASN  24 -49.026  13.714  16.574
  158    HA   ASN  24           HA       ASN  24 -46.220  13.118  16.295
  159    HB2  ASN  24           HB2      ASN  24 -47.768  14.676  18.369
  160    HB3  ASN  24           HB1      ASN  24 -46.030  14.431  18.450
  161   HD21  ASN  24          HD21      ASN  24 -48.625  16.040  16.788
  162   HD22  ASN  24          HD22      ASN  24 -47.635  17.134  15.894
  163    H    GLY  25           HN       GLY  25 -44.940  12.169  17.980
  164    HA2  GLY  25           HA2      GLY  25 -44.976  11.022  20.172
  165    HA3  GLY  25           HA1      GLY  25 -46.415  10.201  19.602
  166    HA   PRO  26           HA       PRO  26 -43.472   7.360  17.599
  167    HB2  PRO  26           HB2      PRO  26 -43.876   7.757  14.792
  168    HB3  PRO  26           HB1      PRO  26 -44.563   6.497  15.820
  169    HG2  PRO  26           HG2      PRO  26 -46.024   8.503  14.621
  170    HG3  PRO  26           HG1      PRO  26 -46.534   7.614  16.065
  171    HD2  PRO  26           HD2      PRO  26 -45.270  10.318  15.856
  172    HD3  PRO  26           HD1      PRO  26 -46.576   9.764  16.928
  173    H    PHE  27           HN       PHE  27 -41.314   7.403  17.337
  174    HA   PHE  27           HA       PHE  27 -40.157   9.598  15.746
  175    HD1  PHE  27           HD1      PHE  27 -39.048  11.775  16.475
  176    HD2  PHE  27           HD2      PHE  27 -36.702   8.646  18.155
  177    HE1  PHE  27           HE1      PHE  27 -36.997  13.025  15.930
  178    HE2  PHE  27           HE2      PHE  27 -34.650   9.888  17.611
  179    HZ   PHE  27           HZ       PHE  27 -34.791  12.081  16.497
  180    HB2  PHE  27           HB2      PHE  27 -39.948  10.042  18.191
  181    HB3  PHE  27           HB1      PHE  27 -39.011   8.561  18.345
  182    H    GLY  28           HN       GLY  28 -38.712   9.001  14.272
  183    HA2  GLY  28           HA2      GLY  28 -36.801   6.977  14.531
  184    HA3  GLY  28           HA1      GLY  28 -38.193   6.286  13.710
  185    H    HIS  29           HN       HIS  29 -35.607   6.562  12.557
  186    HA   HIS  29           HA       HIS  29 -36.334   7.858  10.122
  187    HD1  HIS  29           HD1      HIS  29 -36.366  10.996   9.493
  188    HD2  HIS  29           HD2      HIS  29 -32.576   9.297   9.155
  189    HE1  HIS  29           HE1      HIS  29 -35.362  11.970   7.392
  190    HE2  HIS  29           HE2      HIS  29 -33.032  11.018   7.269
  191    HB2  HIS  29           HB2      HIS  29 -35.572   9.781  11.612
  192    HB3  HIS  29           HB1      HIS  29 -33.973   9.052  11.590
  193    H    GLY  30           HN       GLY  30 -35.496   6.602   8.585
  194    HA2  GLY  30           HA2      GLY  30 -32.757   5.634   8.823
  195    HA3  GLY  30           HA1      GLY  30 -34.006   4.401   8.774
  196    H    TYR  31           HN       TYR  31 -31.864   6.085   6.951
  197    HA   TYR  31           HA       TYR  31 -33.512   6.087   4.534
  198    HD1  TYR  31           HD2      TYR  31 -29.402   6.014   3.699
  199    HD2  TYR  31           HD1      TYR  31 -30.889   8.549   6.778
  200    HE1  TYR  31           HE2      TYR  31 -27.153   6.124   4.687
  201    HE2  TYR  31           HE1      TYR  31 -28.643   8.661   7.777
  202    HH   TYR  31           HH       TYR  31 -26.582   7.419   7.819
  203    HB2  TYR  31           HB2      TYR  31 -31.565   7.220   3.478
  204    HB3  TYR  31           HB1      TYR  31 -32.225   8.104   4.846
  205    H    GLY  32           HN       GLY  32 -32.306   5.306   2.489
  206    HA2  GLY  32           HA2      GLY  32 -31.656   2.537   2.930
  207    HA3  GLY  32           HA1      GLY  32 -31.710   3.364   1.377
  208    H    GLU  33           HN       GLU  33 -29.760   2.440   4.066
  209    HA   GLU  33           HA       GLU  33 -27.416   3.874   3.250
  210    HB2  GLU  33           HB2      GLU  33 -26.300   2.543   5.043
  211    HB3  GLU  33           HB1      GLU  33 -27.700   3.446   5.603
  212    HG2  GLU  33           HG2      GLU  33 -29.034   1.353   5.429
  213    HG3  GLU  33           HG1      GLU  33 -27.552   0.496   5.017
  214    H    GLY  34           HN       GLY  34 -25.798   3.211   1.963
  215    HA2  GLY  34           HA2      GLY  34 -26.143   0.771   0.460
  216    HA3  GLY  34           HA1      GLY  34 -24.856   1.953   0.254
  217    H    ALA  35           HN       ALA  35 -25.810  -0.994   1.697
  218    HA   ALA  35           HA       ALA  35 -23.632  -1.197   3.544
  219    HB1  ALA  35           HB1      ALA  35 -25.743  -2.332   3.969
  220    HB2  ALA  35           HB2      ALA  35 -24.414  -3.490   3.880
  221    HB3  ALA  35           HB3      ALA  35 -25.521  -3.313   2.518
  222    H    GLY  36           HN       GLY  36 -21.607  -1.582   2.999
  223    HA2  GLY  36           HA2      GLY  36 -21.069  -3.086   0.526
  224    HA3  GLY  36           HA1      GLY  36 -19.943  -1.977   1.300
  225    H    GLU  37           HN       GLU  37 -21.032  -5.198   1.073
  226    HA   GLU  37           HA       GLU  37 -19.782  -6.055   3.533
  227    HB2  GLU  37           HB2      GLU  37 -20.526  -8.308   2.786
  228    HB3  GLU  37           HB1      GLU  37 -21.833  -7.146   2.916
  229    HG2  GLU  37           HG2      GLU  37 -21.758  -6.814   0.489
  230    HG3  GLU  37           HG1      GLU  37 -20.476  -8.018   0.372
  231    H    GLY  38           HN       GLY  38 -18.519  -8.341   3.054
  232    HA2  GLY  38           HA2      GLY  38 -16.130  -7.446   1.696
  233    HA3  GLY  38           HA1      GLY  38 -16.309  -8.947   2.590
  234    H    ILE  39           HN       ILE  39 -17.469  -7.368  -0.340
  235    HA   ILE  39           HA       ILE  39 -17.798  -9.745  -1.844
  236    HB   ILE  39           HB       ILE  39 -17.660  -8.210  -3.823
  237   HG12  ILE  39          HG12      ILE  39 -17.014  -6.221  -1.644
  238   HG13  ILE  39          HG11      ILE  39 -16.096  -6.570  -3.101
  239   HG21  ILE  39          HG21      ILE  39 -19.785  -8.643  -2.739
  240   HG22  ILE  39          HG22      ILE  39 -19.715  -6.968  -3.287
  241   HG23  ILE  39          HG23      ILE  39 -19.485  -7.348  -1.578
  242   HD11  ILE  39          HD11      ILE  39 -17.181  -4.448  -3.328
  243   HD12  ILE  39          HD12      ILE  39 -18.745  -5.164  -2.944
  244   HD13  ILE  39          HD13      ILE  39 -17.920  -5.598  -4.442
  245    H    ASP  40           HN       ASP  40 -16.330 -10.499  -3.576
  246    HA   ASP  40           HA       ASP  40 -13.675 -10.611  -2.492
  247    HB2  ASP  40           HB2      ASP  40 -14.954 -11.881  -4.908
  248    HB3  ASP  40           HB1      ASP  40 -13.238 -12.064  -4.551
  249    H    ASP  41           HN       ASP  41 -13.420  -8.273  -2.697
  250    HA   ASP  41           HA       ASP  41 -12.088  -7.687  -5.264
  251    HB2  ASP  41           HB2      ASP  41 -13.875  -5.890  -3.639
  252    HB3  ASP  41           HB1      ASP  41 -12.625  -5.213  -4.674
  253    H    VAL  42           HN       VAL  42 -10.053  -8.187  -4.577
  254    HA   VAL  42           HA       VAL  42  -9.040  -6.538  -2.365
  255    HB   VAL  42           HB       VAL  42  -8.795  -8.841  -1.778
  256   HG11  VAL  42          HG11      VAL  42  -8.967  -9.841  -3.995
  257   HG12  VAL  42          HG12      VAL  42  -7.580 -10.472  -3.110
  258   HG13  VAL  42          HG13      VAL  42  -7.341  -9.275  -4.382
  259   HG21  VAL  42          HG21      VAL  42  -6.947  -7.372  -1.173
  260   HG22  VAL  42          HG22      VAL  42  -6.128  -7.759  -2.686
  261   HG23  VAL  42          HG23      VAL  42  -6.377  -9.016  -1.472
  262    H    GLU  43           HN       GLU  43  -8.519  -4.737  -3.487
  263    HA   GLU  43           HA       GLU  43  -6.203  -4.963  -5.233
  264    HB2  GLU  43           HB2      GLU  43  -8.080  -4.864  -6.777
  265    HB3  GLU  43           HB1      GLU  43  -8.699  -3.424  -5.976
  266    HG2  GLU  43           HG2      GLU  43  -6.687  -2.198  -6.651
  267    HG3  GLU  43           HG1      GLU  43  -6.083  -3.651  -7.447
  268    H    TRP  44           HN       TRP  44  -4.835  -4.010  -3.846
  269    HA   TRP  44           HA       TRP  44  -5.428  -1.552  -2.518
  270    HD1  TRP  44           HD1      TRP  44  -3.697   0.471  -1.914
  271    HE1  TRP  44           HE1      TRP  44  -1.466   1.593  -1.289
  272    HE3  TRP  44           HE3      TRP  44  -0.751  -3.619  -1.802
  273    HZ2  TRP  44           HZ2      TRP  44   1.242   0.779  -0.837
  274    HZ3  TRP  44           HZ3      TRP  44   1.634  -3.407  -1.313
  275    HH2  TRP  44           HH2      TRP  44   2.611  -1.240  -0.810
  276    HB2  TRP  44           HB2      TRP  44  -3.825  -2.897  -1.419
  277    HB3  TRP  44           HB1      TRP  44  -2.919  -3.171  -2.904
  278    H    VAL  45           HN       VAL  45  -4.839   0.424  -3.032
  279    HA   VAL  45           HA       VAL  45  -5.102   1.309  -5.607
  280    HB   VAL  45           HB       VAL  45  -3.710   2.803  -3.391
  281   HG11  VAL  45          HG11      VAL  45  -3.669   3.937  -5.544
  282   HG12  VAL  45          HG12      VAL  45  -4.720   4.783  -4.408
  283   HG13  VAL  45          HG13      VAL  45  -5.422   3.776  -5.675
  284   HG21  VAL  45          HG21      VAL  45  -5.680   1.948  -2.373
  285   HG22  VAL  45          HG22      VAL  45  -6.648   2.283  -3.808
  286   HG23  VAL  45          HG23      VAL  45  -6.043   3.616  -2.825
  287    H    VAL  46           HN       VAL  46  -2.229  -0.008  -4.265
  288    HA   VAL  46           HA       VAL  46  -0.456   1.538  -5.927
  289    HB   VAL  46           HB       VAL  46  -0.074  -0.592  -3.862
  290   HG11  VAL  46          HG11      VAL  46   1.137  -1.586  -5.724
  291   HG12  VAL  46          HG12      VAL  46   2.262  -0.941  -4.526
  292   HG13  VAL  46          HG13      VAL  46   1.962  -0.059  -6.024
  293   HG21  VAL  46          HG21      VAL  46   1.373   1.948  -4.607
  294   HG22  VAL  46          HG22      VAL  46   1.685   0.970  -3.174
  295   HG23  VAL  46          HG23      VAL  46   0.133   1.786  -3.367
  296    H    GLY  47           HN       GLY  47  -2.257  -1.384  -6.317
  297    HA2  GLY  47           HA2      GLY  47  -0.681  -2.639  -8.281
  298    HA3  GLY  47           HA1      GLY  47  -2.432  -2.806  -8.125
  299    H    LYS  48           HN       LYS  48  -2.325   0.319  -8.430
  300    HA   LYS  48           HA       LYS  48  -2.377   0.245 -11.350
  301    HB2  LYS  48           HB2      LYS  48  -3.887   2.278 -10.979
  302    HB3  LYS  48           HB1      LYS  48  -4.530   0.678 -10.659
  303    HG2  LYS  48           HG2      LYS  48  -3.804   1.189  -8.224
  304    HG3  LYS  48           HG1      LYS  48  -3.811   2.865  -8.778
  305    HD2  LYS  48           HD2      LYS  48  -5.964   2.299  -7.808
  306    HD3  LYS  48           HD1      LYS  48  -6.132   2.588  -9.541
  307    HE2  LYS  48           HE2      LYS  48  -6.027   0.139  -9.914
  308    HE3  LYS  48           HE1      LYS  48  -5.990  -0.097  -8.170
  309    HZ1  LYS  48           HZ1      LYS  48  -8.212  -0.396  -8.894
  310    HZ2  LYS  48           HZ2      LYS  48  -8.199   1.054  -9.781
  311    HZ3  LYS  48           HZ3      LYS  48  -8.156   1.097  -8.086
  312    H    ASP  49           HN       ASP  49  -0.450   1.362  -8.909
  313    HA   ASP  49           HA       ASP  49   0.589   3.489 -10.666
  314    HB2  ASP  49           HB2      ASP  49  -0.737   4.396  -8.678
  315    HB3  ASP  49           HB1      ASP  49   0.558   3.779  -7.659
  316    H    LYS  50           HN       LYS  50   1.155   0.622  -9.295
  317    HA   LYS  50           HA       LYS  50   3.675   0.681  -8.177
  318    HB2  LYS  50           HB2      LYS  50   2.172  -1.321  -8.299
  319    HB3  LYS  50           HB1      LYS  50   2.633  -1.495  -9.991
  320    HG2  LYS  50           HG2      LYS  50   4.974  -1.771  -9.316
  321    HG3  LYS  50           HG1      LYS  50   4.492  -1.630  -7.622
  322    HD2  LYS  50           HD2      LYS  50   3.027  -3.603  -7.927
  323    HD3  LYS  50           HD1      LYS  50   3.651  -3.773  -9.568
  324    HE2  LYS  50           HE2      LYS  50   5.353  -3.817  -7.085
  325    HE3  LYS  50           HE1      LYS  50   4.732  -5.256  -7.884
  326    HZ1  LYS  50           HZ1      LYS  50   5.926  -4.516  -9.910
  327    HZ2  LYS  50           HZ2      LYS  50   6.946  -4.895  -8.611
  328    HZ3  LYS  50           HZ3      LYS  50   6.639  -3.277  -8.997
  329    HA   PRO  51           HA       PRO  51   5.251   0.165 -12.974
  330    HB2  PRO  51           HB2      PRO  51   3.289   2.313 -13.703
  331    HB3  PRO  51           HB1      PRO  51   4.057   1.093 -14.732
  332    HG2  PRO  51           HG2      PRO  51   1.571   0.751 -13.871
  333    HG3  PRO  51           HG1      PRO  51   2.698  -0.616 -13.935
  334    HD2  PRO  51           HD2      PRO  51   1.670   0.883 -11.590
  335    HD3  PRO  51           HD1      PRO  51   2.224  -0.808 -11.705
  336    H    THR  52           HN       THR  52   4.129   3.039 -11.230
  337    HA   THR  52           HA       THR  52   6.134   4.777 -12.313
  338    HB   THR  52           HB       THR  52   4.495   5.140  -9.787
  339    HG1  THR  52           HG1      THR  52   2.833   5.543 -11.046
  340   HG21  THR  52          HG21      THR  52   4.818   7.549 -10.270
  341   HG22  THR  52          HG22      THR  52   5.880   7.112 -11.609
  342   HG23  THR  52          HG23      THR  52   6.335   6.708  -9.954
  343    H    TYR  53           HN       TYR  53   5.649   3.065  -9.260
  344    HA   TYR  53           HA       TYR  53   8.060   4.079  -8.059
  345    HD1  TYR  53           HD2      TYR  53   6.350   5.321  -6.752
  346    HD2  TYR  53           HD1      TYR  53   4.415   1.539  -6.569
  347    HE1  TYR  53           HE2      TYR  53   4.244   6.427  -6.141
  348    HE2  TYR  53           HE1      TYR  53   2.310   2.639  -5.975
  349    HH   TYR  53           HH       TYR  53   1.657   5.716  -6.444
  350    HB2  TYR  53           HB2      TYR  53   6.586   1.619  -7.241
  351    HB3  TYR  53           HB1      TYR  53   7.489   2.719  -6.219
  352    H    ASP  54           HN       ASP  54   7.113   1.423  -9.991
  353    HA   ASP  54           HA       ASP  54   9.320  -0.311  -9.279
  354    HB2  ASP  54           HB2      ASP  54   7.080  -1.174  -9.900
  355    HB3  ASP  54           HB1      ASP  54   7.247  -0.471 -11.502
  356    H    GLU  55           HN       GLU  55   8.441   1.922 -11.867
  357    HA   GLU  55           HA       GLU  55  10.670   1.295 -13.515
  358    HB2  GLU  55           HB2      GLU  55  10.141   3.277 -14.772
  359    HB3  GLU  55           HB1      GLU  55   8.644   2.461 -14.366
  360    HG2  GLU  55           HG2      GLU  55   7.922   4.446 -13.738
  361    HG3  GLU  55           HG1      GLU  55   8.919   4.222 -12.291
  362    H    ILE  56           HN       ILE  56  10.106   3.661 -10.920
  363    HA   ILE  56           HA       ILE  56  12.705   4.802 -11.097
  364    HB   ILE  56           HB       ILE  56  10.907   4.662  -8.664
  365   HG12  ILE  56          HG12      ILE  56  11.155   6.903 -10.678
  366   HG13  ILE  56          HG11      ILE  56   9.894   5.670 -10.755
  367   HG21  ILE  56          HG21      ILE  56  13.174   6.527  -9.360
  368   HG22  ILE  56          HG22      ILE  56  13.209   5.258  -8.135
  369   HG23  ILE  56          HG23      ILE  56  12.143   6.646  -7.934
  370   HD11  ILE  56          HD11      ILE  56   9.092   7.716  -9.723
  371   HD12  ILE  56          HD12      ILE  56  10.336   7.590  -8.479
  372   HD13  ILE  56          HD13      ILE  56   9.064   6.371  -8.584
  373    H    PHE  57           HN       PHE  57  11.322   2.044  -9.502
  374    HA   PHE  57           HA       PHE  57  13.348   1.242  -7.797
  375    HD1  PHE  57           HD2      PHE  57  12.945  -0.834  -6.120
  376    HD2  PHE  57           HD1      PHE  57  12.069  -2.436  -9.960
  377    HE1  PHE  57           HE2      PHE  57  13.816  -3.018  -5.407
  378    HE2  PHE  57           HE1      PHE  57  12.927  -4.630  -9.250
  379    HZ   PHE  57           HZ       PHE  57  13.804  -4.924  -6.971
  380    HB2  PHE  57           HB2      PHE  57  11.208   0.167  -7.764
  381    HB3  PHE  57           HB1      PHE  57  11.359  -0.319  -9.443
  382    H    TYR  58           HN       TYR  58  12.877   0.260 -11.218
  383    HA   TYR  58           HA       TYR  58  15.461  -0.970 -11.335
  384    HD1  TYR  58           HD1      TYR  58  11.722  -1.514 -12.272
  385    HD2  TYR  58           HD2      TYR  58  15.423  -3.331 -13.308
  386    HE1  TYR  58           HE1      TYR  58  10.751  -3.726 -11.838
  387    HE2  TYR  58           HE2      TYR  58  14.461  -5.554 -12.875
  388    HH   TYR  58           HH       TYR  58  11.068  -6.014 -12.330
  389    HB2  TYR  58           HB2      TYR  58  13.442  -0.266 -13.460
  390    HB3  TYR  58           HB1      TYR  58  14.996  -1.008 -13.841
  391    H    THR  59           HN       THR  59  14.265   2.219 -11.799
  392    HA   THR  59           HA       THR  59  16.382   3.246 -13.381
  393    HB   THR  59           HB       THR  59  14.275   4.531 -11.648
  394    HG1  THR  59           HG1      THR  59  13.253   4.495 -13.490
  395   HG21  THR  59          HG21      THR  59  14.970   6.706 -12.536
  396   HG22  THR  59          HG22      THR  59  16.381   5.947 -13.271
  397   HG23  THR  59          HG23      THR  59  16.217   5.991 -11.515
  398    H    LEU  60           HN       LEU  60  15.903   2.841  -9.915
  399    HA   LEU  60           HA       LEU  60  18.361   4.222  -9.259
  400    HG   LEU  60           HG       LEU  60  15.430   4.640  -8.149
  401    HB2  LEU  60           HB2      LEU  60  16.484   2.534  -7.590
  402    HB3  LEU  60           HB1      LEU  60  17.890   3.375  -6.947
  403   HD11  LEU  60          HD11      LEU  60  15.265   3.737  -5.839
  404   HD12  LEU  60          HD12      LEU  60  15.040   5.481  -5.951
  405   HD13  LEU  60          HD13      LEU  60  16.571   4.826  -5.372
  406   HD21  LEU  60          HD21      LEU  60  17.943   5.945  -7.106
  407   HD22  LEU  60          HD22      LEU  60  16.472   6.779  -7.602
  408   HD23  LEU  60          HD23      LEU  60  17.425   5.894  -8.792
  409    H    SER  61           HN       SER  61  17.554   1.241 -10.470
  410    HA   SER  61           HA       SER  61  18.768  -0.569 -11.046
  411    HG   SER  61           HG       SER  61  21.734  -1.257  -9.956
  412    HB2  SER  61           HB2      SER  61  20.692   0.925 -11.381
  413    HB3  SER  61           HB1      SER  61  21.100   0.789  -9.671
  414    HA   PRO  62           HA       PRO  62  18.116  -2.542  -7.052
  415    HB2  PRO  62           HB2      PRO  62  16.585  -4.553  -7.993
  416    HB3  PRO  62           HB1      PRO  62  15.936  -2.943  -7.666
  417    HG2  PRO  62           HG2      PRO  62  16.571  -4.240 -10.253
  418    HG3  PRO  62           HG1      PRO  62  15.346  -3.020  -9.870
  419    HD2  PRO  62           HD2      PRO  62  17.848  -2.565 -11.082
  420    HD3  PRO  62           HD1      PRO  62  16.739  -1.337 -10.437
  421    H    VAL  63           HN       VAL  63  18.459  -4.855  -6.388
  422    HA   VAL  63           HA       VAL  63  20.351  -6.297  -8.105
  423    HB   VAL  63           HB       VAL  63  20.777  -5.665  -5.170
  424   HG11  VAL  63          HG11      VAL  63  22.461  -7.372  -7.007
  425   HG12  VAL  63          HG12      VAL  63  21.430  -7.964  -5.701
  426   HG13  VAL  63          HG13      VAL  63  22.833  -6.960  -5.333
  427   HG21  VAL  63          HG21      VAL  63  22.821  -4.550  -5.921
  428   HG22  VAL  63          HG22      VAL  63  21.384  -3.816  -6.632
  429   HG23  VAL  63          HG23      VAL  63  22.395  -4.891  -7.599
  430    H    ASN  64           HN       ASN  64  19.380  -8.185  -8.449
  431    HA   ASN  64           HA       ASN  64  18.578 -10.264  -8.048
  432    HB2  ASN  64           HB2      ASN  64  18.974  -9.625  -5.113
  433    HB3  ASN  64           HB1      ASN  64  18.666 -11.226  -5.791
  434   HD21  ASN  64          HD21      ASN  64  20.376 -10.328  -8.149
  435   HD22  ASN  64          HD22      ASN  64  21.999 -10.595  -7.606
  436    H    GLY  65           HN       GLY  65  16.913  -7.757  -7.965
  437    HA2  GLY  65           HA2      GLY  65  14.600  -7.807  -8.425
  438    HA3  GLY  65           HA1      GLY  65  14.459  -9.248  -7.432
  439    H    LYS  66           HN       LYS  66  16.231  -6.556  -6.224
  440    HA   LYS  66           HA       LYS  66  14.084  -5.103  -5.096
  441    HB2  LYS  66           HB2      LYS  66  14.296  -5.619  -2.764
  442    HB3  LYS  66           HB1      LYS  66  14.043  -7.132  -3.608
  443    HG2  LYS  66           HG2      LYS  66  16.697  -6.113  -2.622
  444    HG3  LYS  66           HG1      LYS  66  15.698  -7.311  -1.810
  445    HD2  LYS  66           HD2      LYS  66  16.515  -7.774  -4.629
  446    HD3  LYS  66           HD1      LYS  66  17.696  -8.024  -3.351
  447    HE2  LYS  66           HE2      LYS  66  16.652 -10.127  -3.841
  448    HE3  LYS  66           HE1      LYS  66  16.120  -9.585  -2.263
  449    HZ1  LYS  66           HZ1      LYS  66  14.554  -9.357  -4.775
  450    HZ2  LYS  66           HZ2      LYS  66  14.036  -8.852  -3.252
  451    HZ3  LYS  66           HZ3      LYS  66  14.290 -10.494  -3.552
  452    H    ILE  67           HN       ILE  67  14.866  -3.211  -3.937
  453    HA   ILE  67           HA       ILE  67  17.573  -2.556  -4.786
  454    HB   ILE  67           HB       ILE  67  17.073  -0.285  -3.728
  455   HG12  ILE  67          HG12      ILE  67  14.338  -1.588  -3.537
  456   HG13  ILE  67          HG11      ILE  67  15.272  -0.819  -2.258
  457   HG21  ILE  67          HG21      ILE  67  16.997  -0.682  -6.135
  458   HG22  ILE  67          HG22      ILE  67  15.684   0.397  -5.667
  459   HG23  ILE  67          HG23      ILE  67  15.348  -1.298  -6.023
  460   HD11  ILE  67          HD11      ILE  67  13.958   0.550  -4.597
  461   HD12  ILE  67          HD12      ILE  67  14.972   1.348  -3.393
  462   HD13  ILE  67          HD13      ILE  67  13.447   0.606  -2.908
  463    H    THR  68           HN       THR  68  19.283  -2.416  -3.513
  464    HA   THR  68           HA       THR  68  19.324  -3.264  -0.851
  465    HB   THR  68           HB       THR  68  21.534  -2.006  -0.769
  466    HG1  THR  68           HG1      THR  68  22.268  -1.216  -2.829
  467   HG21  THR  68          HG21      THR  68  21.485  -4.347  -1.370
  468   HG22  THR  68          HG22      THR  68  22.645  -3.507  -2.400
  469   HG23  THR  68          HG23      THR  68  21.059  -3.944  -3.033
  470    H    GLY  69           HN       GLY  69  18.872  -2.167   1.012
  471    HA2  GLY  69           HA2      GLY  69  17.070  -0.105   0.919
  472    HA3  GLY  69           HA1      GLY  69  18.003  -0.523   2.335
  473    H    ALA  70           HN       ALA  70  20.552   0.172   0.945
  474    HA   ALA  70           HA       ALA  70  21.008   2.784   1.635
  475    HB1  ALA  70           HB1      ALA  70  22.869   2.774   0.079
  476    HB2  ALA  70           HB2      ALA  70  22.195   1.372  -0.751
  477    HB3  ALA  70           HB3      ALA  70  22.758   1.224   0.914
  478    H    ASN  71           HN       ASN  71  20.006   1.684  -1.636
  479    HA   ASN  71           HA       ASN  71  19.890   4.379  -2.587
  480    HB2  ASN  71           HB2      ASN  71  19.279   3.500  -4.701
  481    HB3  ASN  71           HB1      ASN  71  20.381   2.328  -4.015
  482   HD21  ASN  71          HD21      ASN  71  19.804   0.313  -3.821
  483   HD22  ASN  71          HD22      ASN  71  18.224  -0.287  -4.166
  484    H    ALA  72           HN       ALA  72  17.655   2.165  -1.155
  485    HA   ALA  72           HA       ALA  72  15.244   3.507  -1.877
  486    HB1  ALA  72           HB1      ALA  72  14.271   2.244   0.010
  487    HB2  ALA  72           HB2      ALA  72  15.891   1.702   0.451
  488    HB3  ALA  72           HB3      ALA  72  15.189   1.221  -1.095
  489    H    LYS  73           HN       LYS  73  17.550   3.728   0.741
  490    HA   LYS  73           HA       LYS  73  16.127   5.632   2.284
  491    HB2  LYS  73           HB2      LYS  73  19.101   5.064   2.204
  492    HB3  LYS  73           HB1      LYS  73  18.295   6.055   3.407
  493    HG2  LYS  73           HG2      LYS  73  17.926   3.107   2.956
  494    HG3  LYS  73           HG1      LYS  73  18.690   3.894   4.339
  495    HD2  LYS  73           HD2      LYS  73  15.834   4.397   3.563
  496    HD3  LYS  73           HD1      LYS  73  16.304   3.090   4.649
  497    HE2  LYS  73           HE2      LYS  73  16.920   6.020   5.077
  498    HE3  LYS  73           HE1      LYS  73  15.590   5.140   5.843
  499    HZ1  LYS  73           HZ1      LYS  73  17.671   5.400   7.202
  500    HZ2  LYS  73           HZ2      LYS  73  18.433   4.328   6.134
  501    HZ3  LYS  73           HZ3      LYS  73  17.103   3.810   7.048
  502    H    LYS  74           HN       LYS  74  18.534   5.865  -0.274
  503    HA   LYS  74           HA       LYS  74  18.950   8.622  -0.303
  504    HB2  LYS  74           HB2      LYS  74  18.610   7.009  -2.790
  505    HB3  LYS  74           HB1      LYS  74  19.627   8.398  -2.557
  506    HG2  LYS  74           HG2      LYS  74  20.051   5.585  -1.638
  507    HG3  LYS  74           HG1      LYS  74  21.077   6.566  -2.678
  508    HD2  LYS  74           HD2      LYS  74  20.577   7.238   0.211
  509    HD3  LYS  74           HD1      LYS  74  21.878   6.170  -0.298
  510    HE2  LYS  74           HE2      LYS  74  21.500   9.060  -1.029
  511    HE3  LYS  74           HE1      LYS  74  22.742   8.366   0.011
  512    HZ1  LYS  74           HZ1      LYS  74  22.443   7.889  -2.907
  513    HZ2  LYS  74           HZ2      LYS  74  23.608   7.155  -1.919
  514    HZ3  LYS  74           HZ3      LYS  74  23.639   8.833  -2.166
  515    H    GLU  75           HN       GLU  75  16.605   6.674  -1.980
  516    HA   GLU  75           HA       GLU  75  15.184   8.631  -3.345
  517    HB2  GLU  75           HB2      GLU  75  15.108   5.958  -3.232
  518    HB3  GLU  75           HB1      GLU  75  13.702   6.299  -2.241
  519    HG2  GLU  75           HG2      GLU  75  13.597   5.956  -4.876
  520    HG3  GLU  75           HG1      GLU  75  12.456   6.960  -3.995
  521    H    MET  76           HN       MET  76  14.381   7.223  -0.163
  522    HA   MET  76           HA       MET  76  12.221   9.048   0.222
  523    HB2  MET  76           HB2      MET  76  12.286   8.135   2.609
  524    HB3  MET  76           HB1      MET  76  11.914   7.015   1.308
  525    HG2  MET  76           HG2      MET  76  14.137   6.133   1.359
  526    HG3  MET  76           HG1      MET  76  14.635   7.338   2.541
  527    HE1  MET  76           HE1      MET  76  11.251   5.300   2.380
  528    HE2  MET  76           HE2      MET  76  11.652   3.911   3.394
  529    HE3  MET  76           HE3      MET  76  12.471   4.146   1.850
  530    H    VAL  77           HN       VAL  77  15.613   9.200   0.887
  531    HA   VAL  77           HA       VAL  77  15.495  11.344   2.778
  532    HB   VAL  77           HB       VAL  77  17.662  10.150   1.098
  533   HG11  VAL  77          HG11      VAL  77  18.024  12.551   0.795
  534   HG12  VAL  77          HG12      VAL  77  19.271  11.840   1.821
  535   HG13  VAL  77          HG13      VAL  77  17.969  12.784   2.545
  536   HG21  VAL  77          HG21      VAL  77  17.177   9.196   3.268
  537   HG22  VAL  77          HG22      VAL  77  17.379  10.772   4.032
  538   HG23  VAL  77          HG23      VAL  77  18.763   9.968   3.290
  539    H    LYS  78           HN       LYS  78  15.916  11.203  -0.759
  540    HA   LYS  78           HA       LYS  78  16.121  14.030  -1.061
  541    HB2  LYS  78           HB2      LYS  78  15.978  13.624  -3.428
  542    HB3  LYS  78           HB1      LYS  78  16.984  12.371  -2.712
  543    HG2  LYS  78           HG2      LYS  78  15.008  10.876  -2.690
  544    HG3  LYS  78           HG1      LYS  78  14.115  12.121  -3.562
  545    HD2  LYS  78           HD2      LYS  78  14.886  10.571  -5.164
  546    HD3  LYS  78           HD1      LYS  78  15.892  12.011  -5.315
  547    HE2  LYS  78           HE2      LYS  78  17.726  10.982  -4.307
  548    HE3  LYS  78           HE1      LYS  78  16.736   9.705  -3.598
  549    HZ1  LYS  78           HZ1      LYS  78  16.373   8.783  -5.780
  550    HZ2  LYS  78           HZ2      LYS  78  18.042   8.923  -5.492
  551    HZ3  LYS  78           HZ3      LYS  78  17.260  10.041  -6.501
  552    H    SER  79           HN       SER  79  13.538  11.876  -0.583
  553    HA   SER  79           HA       SER  79  11.384  13.369  -1.589
  554    HG   SER  79           HG       SER  79  12.011  10.672  -1.364
  555    HB2  SER  79           HB2      SER  79  11.527  11.533   0.815
  556    HB3  SER  79           HB1      SER  79  10.026  12.120   0.082
  557    H    LYS  80           HN       LYS  80  13.607  14.287   0.715
  558    HA   LYS  80           HA       LYS  80  13.862  16.258   1.794
  559    HB2  LYS  80           HB2      LYS  80  11.097  16.920   0.769
  560    HB3  LYS  80           HB1      LYS  80  12.183  18.052   1.577
  561    HG2  LYS  80           HG2      LYS  80  13.826  17.646  -0.261
  562    HG3  LYS  80           HG1      LYS  80  12.570  16.721  -1.089
  563    HD2  LYS  80           HD2      LYS  80  11.121  18.702  -1.081
  564    HD3  LYS  80           HD1      LYS  80  12.391  19.625  -0.272
  565    HE2  LYS  80           HE2      LYS  80  12.552  18.372  -3.014
  566    HE3  LYS  80           HE1      LYS  80  12.378  20.090  -2.659
  567    HZ1  LYS  80           HZ1      LYS  80  14.708  18.383  -1.955
  568    HZ2  LYS  80           HZ2      LYS  80  14.551  20.019  -1.551
  569    HZ3  LYS  80           HZ3      LYS  80  14.664  19.555  -3.177
  570    H    LEU  81           HN       LEU  81  13.782  14.727   3.605
  571    HA   LEU  81           HA       LEU  81  11.663  15.496   5.470
  572    HG   LEU  81           HG       LEU  81  10.914  13.578   3.266
  573    HB2  LEU  81           HB2      LEU  81  12.525  12.647   5.034
  574    HB3  LEU  81           HB1      LEU  81  11.365  13.217   6.209
  575   HD11  LEU  81          HD11      LEU  81  10.031  11.291   5.018
  576   HD12  LEU  81          HD12      LEU  81  11.214  11.193   3.716
  577   HD13  LEU  81          HD13      LEU  81   9.530  11.569   3.348
  578   HD21  LEU  81          HD21      LEU  81   8.596  13.812   3.997
  579   HD22  LEU  81          HD22      LEU  81   9.634  14.983   4.810
  580   HD23  LEU  81          HD23      LEU  81   9.090  13.542   5.669
  581    HA   PRO  82           HA       PRO  82  15.009  14.989   8.474
  582    HB2  PRO  82           HB2      PRO  82  13.558  14.852  10.716
  583    HB3  PRO  82           HB1      PRO  82  13.667  16.373   9.805
  584    HG2  PRO  82           HG2      PRO  82  11.476  14.324   9.816
  585    HG3  PRO  82           HG1      PRO  82  11.355  16.086   9.878
  586    HD2  PRO  82           HD2      PRO  82  11.032  14.609   7.609
  587    HD3  PRO  82           HD1      PRO  82  11.569  16.306   7.619
  588    H    ASN  83           HN       ASN  83  15.609  13.343  10.162
  589    HA   ASN  83           HA       ASN  83  15.260  10.716   9.168
  590    HB2  ASN  83           HB2      ASN  83  16.453  11.836  11.682
  591    HB3  ASN  83           HB1      ASN  83  16.302  10.096  11.459
  592   HD21  ASN  83          HD21      ASN  83  16.826  12.075   8.658
  593   HD22  ASN  83          HD22      ASN  83  18.496  11.681   8.441
  594    H    THR  84           HN       THR  84  13.379  12.583  11.313
  595    HA   THR  84           HA       THR  84  12.098  10.581  12.808
  596    HB   THR  84           HB       THR  84  10.676  13.077  11.919
  597    HG1  THR  84           HG1      THR  84  12.609  13.045  14.020
  598   HG21  THR  84          HG21      THR  84  10.856  11.612  14.560
  599   HG22  THR  84          HG22      THR  84   9.514  11.526  13.421
  600   HG23  THR  84          HG23      THR  84   9.874  13.044  14.241
  601    H    VAL  85           HN       VAL  85  10.692  12.415  10.096
  602    HA   VAL  85           HA       VAL  85   8.560  10.657   9.588
  603    HB   VAL  85           HB       VAL  85   9.864  12.535   7.607
  604   HG11  VAL  85          HG11      VAL  85   8.300  10.931   6.625
  605   HG12  VAL  85          HG12      VAL  85   7.657  12.572   6.568
  606   HG13  VAL  85          HG13      VAL  85   7.061  11.432   7.775
  607   HG21  VAL  85          HG21      VAL  85   8.186  14.181   8.359
  608   HG22  VAL  85          HG22      VAL  85   9.315  13.746   9.644
  609   HG23  VAL  85          HG23      VAL  85   7.689  13.068   9.634
  610    H    LEU  86           HN       LEU  86  11.739  10.979   8.112
  611    HA   LEU  86           HA       LEU  86  11.568   9.113   6.081
  612    HG   LEU  86           HG       LEU  86  14.240   7.803   6.314
  613    HB2  LEU  86           HB2      LEU  86  13.401  10.674   6.396
  614    HB3  LEU  86           HB1      LEU  86  13.908   9.820   7.855
  615   HD11  LEU  86          HD11      LEU  86  14.109  10.022   4.290
  616   HD12  LEU  86          HD12      LEU  86  13.023   8.637   4.408
  617   HD13  LEU  86          HD13      LEU  86  14.719   8.398   3.985
  618   HD21  LEU  86          HD21      LEU  86  16.468   8.590   5.683
  619   HD22  LEU  86          HD22      LEU  86  16.050   9.051   7.336
  620   HD23  LEU  86          HD23      LEU  86  15.972  10.244   6.042
  621    H    GLY  87           HN       GLY  87  12.704   8.650   9.420
  622    HA2  GLY  87           HA2      GLY  87  13.324   5.932   9.209
  623    HA3  GLY  87           HA1      GLY  87  12.938   6.771  10.707
  624    H    LYS  88           HN       LYS  88  10.286   7.531  10.157
  625    HA   LYS  88           HA       LYS  88   9.112   4.957  10.618
  626    HB2  LYS  88           HB2      LYS  88   7.098   6.057  11.267
  627    HB3  LYS  88           HB1      LYS  88   8.454   6.889  11.997
  628    HG2  LYS  88           HG2      LYS  88   8.234   8.728  10.524
  629    HG3  LYS  88           HG1      LYS  88   7.097   7.842   9.501
  630    HD2  LYS  88           HD2      LYS  88   5.474   7.794  11.311
  631    HD3  LYS  88           HD1      LYS  88   6.615   8.604  12.381
  632    HE2  LYS  88           HE2      LYS  88   6.528  10.604  11.041
  633    HE3  LYS  88           HE1      LYS  88   5.528   9.797   9.831
  634    HZ1  LYS  88           HZ1      LYS  88   3.717   9.693  11.313
  635    HZ2  LYS  88           HZ2      LYS  88   4.315  11.271  11.463
  636    HZ3  LYS  88           HZ3      LYS  88   4.667  10.113  12.653
  637    H    ILE  89           HN       ILE  89   9.465   6.981   7.868
  638    HA   ILE  89           HA       ILE  89   7.295   5.820   6.404
  639    HB   ILE  89           HB       ILE  89   9.808   7.216   5.491
  640   HG12  ILE  89          HG12      ILE  89   6.880   7.940   5.519
  641   HG13  ILE  89          HG11      ILE  89   8.186   8.712   6.410
  642   HG21  ILE  89          HG21      ILE  89   7.611   6.129   3.739
  643   HG22  ILE  89          HG22      ILE  89   9.263   5.517   3.832
  644   HG23  ILE  89          HG23      ILE  89   8.959   7.138   3.211
  645   HD11  ILE  89          HD11      ILE  89   7.481  10.079   4.543
  646   HD12  ILE  89          HD12      ILE  89   7.823   8.758   3.424
  647   HD13  ILE  89          HD13      ILE  89   9.139   9.519   4.318
  648    H    TRP  90           HN       TRP  90  10.774   5.182   6.660
  649    HA   TRP  90           HA       TRP  90  10.915   2.933   5.026
  650    HD1  TRP  90           HD1      TRP  90  13.161   1.080   8.351
  651    HE1  TRP  90           HE1      TRP  90  14.463  -0.851   7.233
  652    HE3  TRP  90           HE3      TRP  90  13.239   2.831   3.539
  653    HZ2  TRP  90           HZ2      TRP  90  15.402  -1.522   4.663
  654    HZ3  TRP  90           HZ3      TRP  90  14.371   1.484   1.826
  655    HH2  TRP  90           HH2      TRP  90  15.423  -0.646   2.368
  656    HB2  TRP  90           HB2      TRP  90  12.904   3.987   5.994
  657    HB3  TRP  90           HB1      TRP  90  12.419   3.452   7.591
  658    H    LYS  91           HN       LYS  91  10.286   3.040   8.534
  659    HA   LYS  91           HA       LYS  91  10.013   0.211   8.720
  660    HB2  LYS  91           HB2      LYS  91   9.477   0.572  11.034
  661    HB3  LYS  91           HB1      LYS  91  10.813   1.611  10.572
  662    HG2  LYS  91           HG2      LYS  91   9.263   3.503  10.379
  663    HG3  LYS  91           HG1      LYS  91   7.948   2.456  10.911
  664    HD2  LYS  91           HD2      LYS  91   8.600   3.568  12.859
  665    HD3  LYS  91           HD1      LYS  91   9.407   2.004  12.973
  666    HE2  LYS  91           HE2      LYS  91  10.774   4.424  11.828
  667    HE3  LYS  91           HE1      LYS  91  10.780   4.083  13.555
  668    HZ1  LYS  91           HZ1      LYS  91  12.768   3.247  12.483
  669    HZ2  LYS  91           HZ2      LYS  91  11.847   2.297  11.429
  670    HZ3  LYS  91           HZ3      LYS  91  11.848   1.958  13.087
  671    H    LEU  92           HN       LEU  92   7.822   2.668   7.787
  672    HA   LEU  92           HA       LEU  92   5.517   0.994   8.410
  673    HG   LEU  92           HG       LEU  92   3.304   2.232   7.133
  674    HB2  LEU  92           HB2      LEU  92   5.593   3.560   8.592
  675    HB3  LEU  92           HB1      LEU  92   5.436   3.552   6.835
  676   HD11  LEU  92          HD11      LEU  92   3.636   3.049  10.013
  677   HD12  LEU  92          HD12      LEU  92   3.817   1.402   9.397
  678   HD13  LEU  92          HD13      LEU  92   2.253   2.218   9.304
  679   HD21  LEU  92          HD21      LEU  92   3.433   4.962   8.414
  680   HD22  LEU  92          HD22      LEU  92   1.968   4.176   7.826
  681   HD23  LEU  92          HD23      LEU  92   3.244   4.628   6.693
  682    H    ALA  93           HN       ALA  93   7.644   1.733   5.772
  683    HA   ALA  93           HA       ALA  93   5.823   0.690   3.755
  684    HB1  ALA  93           HB1      ALA  93   7.257   2.611   3.226
  685    HB2  ALA  93           HB2      ALA  93   7.588   1.239   2.169
  686    HB3  ALA  93           HB3      ALA  93   8.686   1.612   3.497
  687    H    ASP  94           HN       ASP  94   8.885  -0.230   5.306
  688    HA   ASP  94           HA       ASP  94   8.845  -2.783   3.882
  689    HB2  ASP  94           HB2      ASP  94  10.992  -1.495   4.168
  690    HB3  ASP  94           HB1      ASP  94  10.892  -1.820   5.891
  691    H    VAL  95           HN       VAL  95   7.492  -4.191   4.707
  692    HA   VAL  95           HA       VAL  95   6.679  -4.148   7.428
  693    HB   VAL  95           HB       VAL  95   6.166  -6.323   5.406
  694   HG11  VAL  95          HG11      VAL  95   5.615  -7.002   7.656
  695   HG12  VAL  95          HG12      VAL  95   4.129  -6.719   6.749
  696   HG13  VAL  95          HG13      VAL  95   4.695  -5.519   7.912
  697   HG21  VAL  95          HG21      VAL  95   4.077  -5.135   4.889
  698   HG22  VAL  95          HG22      VAL  95   5.501  -4.178   4.478
  699   HG23  VAL  95          HG23      VAL  95   4.585  -3.810   5.939
  700    H    ASP  96           HN       ASP  96   9.080  -5.867   5.650
  701    HA   ASP  96           HA       ASP  96   9.468  -7.834   7.760
  702    HB2  ASP  96           HB2      ASP  96  11.519  -7.465   5.687
  703    HB3  ASP  96           HB1      ASP  96  10.775  -8.965   6.265
  704    H    LYS  97           HN       LYS  97  10.704  -4.816   6.645
  705    HA   LYS  97           HA       LYS  97  12.290  -3.375   7.341
  706    HB2  LYS  97           HB2      LYS  97  12.183  -4.931   9.937
  707    HB3  LYS  97           HB1      LYS  97  12.786  -3.287   9.720
  708    HG2  LYS  97           HG2      LYS  97  10.562  -2.557   9.049
  709    HG3  LYS  97           HG1      LYS  97   9.953  -4.192   9.242
  710    HD2  LYS  97           HD2      LYS  97  10.635  -4.056  11.657
  711    HD3  LYS  97           HD1      LYS  97  10.970  -2.341  11.388
  712    HE2  LYS  97           HE2      LYS  97   8.657  -2.000  10.666
  713    HE3  LYS  97           HE1      LYS  97   8.320  -3.711  10.927
  714    HZ1  LYS  97           HZ1      LYS  97   9.080  -3.222  13.321
  715    HZ2  LYS  97           HZ2      LYS  97   7.542  -2.708  12.840
  716    HZ3  LYS  97           HZ3      LYS  97   8.815  -1.594  12.923
  717    H    ASP  98           HN       ASP  98  13.344  -4.785   5.685
  718    HA   ASP  98           HA       ASP  98  15.216  -6.796   6.592
  719    HB2  ASP  98           HB2      ASP  98  14.895  -5.704   3.792
  720    HB3  ASP  98           HB1      ASP  98  15.606  -7.244   4.269
  721    H    GLY  99           HN       GLY  99  15.287  -3.495   5.498
  722    HA2  GLY  99           HA2      GLY  99  17.209  -2.090   5.422
  723    HA3  GLY  99           HA1      GLY  99  18.225  -3.531   5.460
  724    H    LEU 100           HN       LEU 100  15.546  -3.789   3.458
  725    HA   LEU 100           HA       LEU 100  16.662  -2.557   1.109
  726    HG   LEU 100           HG       LEU 100  16.108  -5.976   2.411
  727    HB2  LEU 100           HB2      LEU 100  16.552  -4.644  -0.238
  728    HB3  LEU 100           HB1      LEU 100  17.819  -4.654   0.968
  729   HD11  LEU 100          HD11      LEU 100  14.165  -5.684   1.014
  730   HD12  LEU 100          HD12      LEU 100  14.613  -7.391   1.042
  731   HD13  LEU 100          HD13      LEU 100  15.005  -6.394  -0.364
  732   HD21  LEU 100          HD21      LEU 100  17.448  -7.190   0.002
  733   HD22  LEU 100          HD22      LEU 100  16.922  -8.064   1.441
  734   HD23  LEU 100          HD23      LEU 100  18.205  -6.861   1.561
  735    H    LEU 101           HN       LEU 101  14.968  -3.339  -0.826
  736    HA   LEU 101           HA       LEU 101  12.278  -3.447   0.188
  737    HG   LEU 101           HG       LEU 101  13.355  -0.770   1.308
  738    HB2  LEU 101           HB2      LEU 101  13.364  -0.956  -1.136
  739    HB3  LEU 101           HB1      LEU 101  11.653  -1.351  -1.127
  740   HD11  LEU 101          HD11      LEU 101  12.799   1.178  -0.125
  741   HD12  LEU 101          HD12      LEU 101  12.052   1.253   1.471
  742   HD13  LEU 101          HD13      LEU 101  11.089   0.790   0.066
  743   HD21  LEU 101          HD21      LEU 101  10.425  -1.417   1.047
  744   HD22  LEU 101          HD22      LEU 101  11.201  -0.807   2.503
  745   HD23  LEU 101          HD23      LEU 101  11.651  -2.389   1.861
  746    H    ASP 102           HN       ASP 102  11.333  -4.780  -1.276
  747    HA   ASP 102           HA       ASP 102  12.651  -5.120  -3.813
  748    HB2  ASP 102           HB2      ASP 102  11.182  -6.951  -4.189
  749    HB3  ASP 102           HB1      ASP 102  11.807  -7.058  -2.557
  750    H    ASP 103           HN       ASP 103  10.678  -5.558  -5.654
  751    HA   ASP 103           HA       ASP 103  10.287  -2.926  -6.550
  752    HB2  ASP 103           HB2      ASP 103   8.782  -3.980  -8.273
  753    HB3  ASP 103           HB1      ASP 103  10.415  -4.665  -8.170
  754    H    GLU 104           HN       GLU 104   8.195  -5.029  -4.674
  755    HA   GLU 104           HA       GLU 104   5.931  -3.212  -4.971
  756    HB2  GLU 104           HB2      GLU 104   5.784  -5.776  -4.769
  757    HB3  GLU 104           HB1      GLU 104   6.090  -5.519  -3.054
  758    HG2  GLU 104           HG2      GLU 104   3.812  -5.535  -3.097
  759    HG3  GLU 104           HG1      GLU 104   4.152  -3.804  -3.249
  760    H    GLU 105           HN       GLU 105   8.493  -3.964  -2.744
  761    HA   GLU 105           HA       GLU 105   7.356  -2.514  -0.559
  762    HB2  GLU 105           HB2      GLU 105   9.674  -4.149  -1.002
  763    HB3  GLU 105           HB1      GLU 105  10.145  -2.651  -0.217
  764    HG2  GLU 105           HG2      GLU 105   8.937  -3.076   1.670
  765    HG3  GLU 105           HG1      GLU 105   7.738  -4.040   0.815
  766    H    PHE 106           HN       PHE 106   9.434  -1.716  -3.258
  767    HA   PHE 106           HA       PHE 106   9.868   0.994  -2.429
  768    HD1  PHE 106           HD2      PHE 106   9.164   2.846  -4.223
  769    HD2  PHE 106           HD1      PHE 106  12.658   0.989  -5.739
  770    HE1  PHE 106           HE2      PHE 106   9.992   5.021  -5.014
  771    HE2  PHE 106           HE1      PHE 106  13.481   3.142  -6.525
  772    HZ   PHE 106           HZ       PHE 106  12.153   5.172  -6.149
  773    HB2  PHE 106           HB2      PHE 106  11.245  -0.203  -4.191
  774    HB3  PHE 106           HB1      PHE 106   9.860  -0.100  -5.262
  775    H    ALA 107           HN       ALA 107   7.438  -0.814  -4.221
  776    HA   ALA 107           HA       ALA 107   5.942   1.311  -5.235
  777    HB1  ALA 107           HB1      ALA 107   5.570  -1.038  -5.821
  778    HB2  ALA 107           HB2      ALA 107   4.081  -0.244  -5.309
  779    HB3  ALA 107           HB3      ALA 107   4.929  -1.331  -4.205
  780    H    LEU 108           HN       LEU 108   5.727  -0.336  -2.102
  781    HA   LEU 108           HA       LEU 108   3.700   1.373  -1.069
  782    HG   LEU 108           HG       LEU 108   2.677   0.238   0.857
  783    HB2  LEU 108           HB2      LEU 108   4.502  -0.990  -0.301
  784    HB3  LEU 108           HB1      LEU 108   5.674  -0.086   0.652
  785   HD11  LEU 108          HD11      LEU 108   3.372  -1.945   1.597
  786   HD12  LEU 108          HD12      LEU 108   2.905  -0.941   2.970
  787   HD13  LEU 108          HD13      LEU 108   4.611  -1.225   2.623
  788   HD21  LEU 108          HD21      LEU 108   3.189   1.430   2.931
  789   HD22  LEU 108          HD22      LEU 108   3.863   2.244   1.520
  790   HD23  LEU 108          HD23      LEU 108   4.911   1.298   2.577
  791    H    ALA 109           HN       ALA 109   7.232   1.228  -0.616
  792    HA   ALA 109           HA       ALA 109   7.678   3.249   1.172
  793    HB1  ALA 109           HB1      ALA 109   9.846   3.585   0.115
  794    HB2  ALA 109           HB2      ALA 109   9.298   2.693  -1.305
  795    HB3  ALA 109           HB3      ALA 109   9.454   1.871   0.247
  796    H    ASN 110           HN       ASN 110   7.526   3.660  -2.357
  797    HA   ASN 110           HA       ASN 110   7.700   6.497  -2.215
  798    HB2  ASN 110           HB2      ASN 110   8.462   5.023  -4.137
  799    HB3  ASN 110           HB1      ASN 110   6.767   4.914  -4.600
  800   HD21  ASN 110          HD21      ASN 110   9.557   6.949  -4.395
  801   HD22  ASN 110          HD22      ASN 110   8.925   8.263  -5.319
  802    H    HIS 111           HN       HIS 111   5.101   4.177  -2.085
  803    HA   HIS 111           HA       HIS 111   3.063   5.942  -3.044
  804    HD1  HIS 111           HD1      HIS 111   1.000   4.747  -4.382
  805    HD2  HIS 111           HD2      HIS 111   0.089   4.044  -0.385
  806    HE1  HIS 111           HE1      HIS 111  -1.495   5.007  -4.201
  807    HE2  HIS 111           HE2      HIS 111  -1.994   4.808  -1.735
  808    HB2  HIS 111           HB2      HIS 111   2.863   3.417  -2.910
  809    HB3  HIS 111           HB1      HIS 111   2.670   3.609  -1.167
  810    H    LEU 112           HN       LEU 112   4.321   5.062   0.140
  811    HA   LEU 112           HA       LEU 112   2.542   6.801   1.549
  812    HG   LEU 112           HG       LEU 112   3.073   3.887   2.260
  813    HB2  LEU 112           HB2      LEU 112   5.049   5.324   2.325
  814    HB3  LEU 112           HB1      LEU 112   4.241   6.429   3.434
  815   HD11  LEU 112          HD11      LEU 112   3.073   3.138   4.576
  816   HD12  LEU 112          HD12      LEU 112   3.812   4.658   5.081
  817   HD13  LEU 112          HD13      LEU 112   4.704   3.547   4.043
  818   HD21  LEU 112          HD21      LEU 112   1.809   5.896   4.127
  819   HD22  LEU 112          HD22      LEU 112   1.117   4.352   3.627
  820   HD23  LEU 112          HD23      LEU 112   1.365   5.631   2.439
  821    H    ILE 113           HN       ILE 113   5.707   7.129   0.089
  822    HA   ILE 113           HA       ILE 113   6.413   9.628   1.115
  823    HB   ILE 113           HB       ILE 113   6.961   8.385  -1.574
  824   HG12  ILE 113          HG12      ILE 113   8.700   8.829   0.866
  825   HG13  ILE 113          HG11      ILE 113   7.955   7.304   0.404
  826   HG21  ILE 113          HG21      ILE 113   8.142  10.924  -0.438
  827   HG22  ILE 113          HG22      ILE 113   7.059  10.814  -1.829
  828   HG23  ILE 113          HG23      ILE 113   8.672  10.106  -1.908
  829   HD11  ILE 113          HD11      ILE 113   9.311   7.234  -1.606
  830   HD12  ILE 113          HD12      ILE 113  10.326   7.394  -0.177
  831   HD13  ILE 113          HD13      ILE 113  10.022   8.795  -1.204
  832    H    LYS 114           HN       LYS 114   4.440   8.839  -1.780
  833    HA   LYS 114           HA       LYS 114   3.805  11.613  -2.138
  834    HB2  LYS 114           HB2      LYS 114   2.079  10.833  -3.771
  835    HB3  LYS 114           HB1      LYS 114   3.719  10.320  -4.118
  836    HG2  LYS 114           HG2      LYS 114   3.237   8.097  -3.326
  837    HG3  LYS 114           HG1      LYS 114   1.619   8.596  -2.826
  838    HD2  LYS 114           HD2      LYS 114   1.588   7.411  -4.981
  839    HD3  LYS 114           HD1      LYS 114   1.025   9.074  -5.139
  840    HE2  LYS 114           HE2      LYS 114   3.298   9.713  -5.922
  841    HE3  LYS 114           HE1      LYS 114   3.754   8.012  -5.871
  842    HZ1  LYS 114           HZ1      LYS 114   2.015   7.539  -7.507
  843    HZ2  LYS 114           HZ2      LYS 114   3.128   8.665  -8.103
  844    HZ3  LYS 114           HZ3      LYS 114   1.610   9.185  -7.572
  845    H    VAL 115           HN       VAL 115   2.479   9.115  -0.168
  846    HA   VAL 115           HA       VAL 115  -0.040  10.340   0.361
  847    HB   VAL 115           HB       VAL 115   1.599   8.353   1.935
  848   HG11  VAL 115          HG11      VAL 115   0.334   9.719   3.530
  849   HG12  VAL 115          HG12      VAL 115  -0.301   8.077   3.441
  850   HG13  VAL 115          HG13      VAL 115  -1.149   9.394   2.630
  851   HG21  VAL 115          HG21      VAL 115   0.570   7.472  -0.067
  852   HG22  VAL 115          HG22      VAL 115  -0.990   8.151   0.397
  853   HG23  VAL 115          HG23      VAL 115  -0.277   6.847   1.346
  854    H    LYS 116           HN       LYS 116   3.136  10.568   1.990
  855    HA   LYS 116           HA       LYS 116   2.221  12.505   3.872
  856    HB2  LYS 116           HB2      LYS 116   4.536  12.943   4.373
  857    HB3  LYS 116           HB1      LYS 116   4.333  11.206   4.174
  858    HG2  LYS 116           HG2      LYS 116   5.399  11.190   2.117
  859    HG3  LYS 116           HG1      LYS 116   5.200  12.925   1.895
  860    HD2  LYS 116           HD2      LYS 116   6.752  13.244   3.833
  861    HD3  LYS 116           HD1      LYS 116   7.088  11.507   3.762
  862    HE2  LYS 116           HE2      LYS 116   8.780  12.532   2.463
  863    HE3  LYS 116           HE1      LYS 116   7.622  11.879   1.302
  864    HZ1  LYS 116           HZ1      LYS 116   8.340  14.157   0.761
  865    HZ2  LYS 116           HZ2      LYS 116   7.675  14.709   2.219
  866    HZ3  LYS 116           HZ3      LYS 116   6.672  14.060   1.025
  867    H    LEU 117           HN       LEU 117   3.276  12.588   0.587
  868    HA   LEU 117           HA       LEU 117   3.870  15.360   0.405
  869    HG   LEU 117           HG       LEU 117   4.465  16.094  -1.819
  870    HB2  LEU 117           HB2      LEU 117   4.632  13.521  -1.143
  871    HB3  LEU 117           HB1      LEU 117   2.999  13.494  -1.802
  872   HD11  LEU 117          HD11      LEU 117   5.574  15.505  -3.913
  873   HD12  LEU 117          HD12      LEU 117   5.008  13.843  -3.754
  874   HD13  LEU 117          HD13      LEU 117   6.153  14.501  -2.584
  875   HD21  LEU 117          HD21      LEU 117   2.631  14.712  -3.780
  876   HD22  LEU 117          HD22      LEU 117   3.253  16.356  -3.922
  877   HD23  LEU 117          HD23      LEU 117   2.151  15.939  -2.609
  878    H    GLU 118           HN       GLU 118   0.981  13.483   0.315
  879    HA   GLU 118           HA       GLU 118  -0.817  15.230  -0.904
  880    HB2  GLU 118           HB2      GLU 118  -1.181  13.257   1.348
  881    HB3  GLU 118           HB1      GLU 118  -2.517  14.108   0.587
  882    HG2  GLU 118           HG2      GLU 118  -0.622  12.550  -1.104
  883    HG3  GLU 118           HG1      GLU 118  -1.866  11.704  -0.172
  884    H    GLY 119           HN       GLY 119   0.948  15.648   1.957
  885    HA2  GLY 119           HA2      GLY 119   0.987  17.846   2.937
  886    HA3  GLY 119           HA1      GLY 119  -0.743  17.957   2.649
  887    H    HIS 120           HN       HIS 120   0.097  14.899   3.706
  888    HA   HIS 120           HA       HIS 120  -0.189  15.607   6.527
  889    HD1  HIS 120           HD1      HIS 120  -2.111  11.966   7.375
  890    HD2  HIS 120           HD2      HIS 120  -1.889  12.760   3.291
  891    HE1  HIS 120           HE1      HIS 120  -2.374   9.748   6.237
  892    HE2  HIS 120           HE2      HIS 120  -2.522  10.297   3.775
  893    HB2  HIS 120           HB2      HIS 120  -2.096  14.391   6.908
  894    HB3  HIS 120           HB1      HIS 120  -2.416  14.905   5.259
  895    H    GLU 121           HN       GLU 121   1.007  14.385   7.852
  896    HA   GLU 121           HA       GLU 121   2.995  12.682   6.736
  897    HB2  GLU 121           HB2      GLU 121   3.720  12.366   9.077
  898    HB3  GLU 121           HB1      GLU 121   3.518  14.061   8.656
  899    HG2  GLU 121           HG2      GLU 121   1.467  14.191   9.849
  900    HG3  GLU 121           HG1      GLU 121   1.427  12.442  10.081
  901    H    LEU 122           HN       LEU 122   3.453  10.494   7.601
  902    HA   LEU 122           HA       LEU 122   1.173   8.802   7.298
  903    HG   LEU 122           HG       LEU 122   4.223   9.170   6.093
  904    HB2  LEU 122           HB2      LEU 122   3.930   8.010   8.214
  905    HB3  LEU 122           HB1      LEU 122   2.702   6.968   7.495
  906   HD11  LEU 122          HD11      LEU 122   4.268   6.172   5.806
  907   HD12  LEU 122          HD12      LEU 122   5.546   7.179   6.487
  908   HD13  LEU 122          HD13      LEU 122   5.134   7.313   4.778
  909   HD21  LEU 122          HD21      LEU 122   3.055   8.420   4.075
  910   HD22  LEU 122          HD22      LEU 122   1.930   9.050   5.278
  911   HD23  LEU 122          HD23      LEU 122   2.089   7.309   5.047
  912    HA   PRO 123           HA       PRO 123   0.178   8.717  11.571
  913    HB2  PRO 123           HB2      PRO 123  -1.958   7.112  11.433
  914    HB3  PRO 123           HB1      PRO 123  -1.944   8.699  10.658
  915    HG2  PRO 123           HG2      PRO 123  -1.706   6.000   9.445
  916    HG3  PRO 123           HG1      PRO 123  -2.399   7.481   8.768
  917    HD2  PRO 123           HD2      PRO 123   0.188   6.415   8.294
  918    HD3  PRO 123           HD1      PRO 123  -0.433   7.988   7.756
  919    H    ALA 124           HN       ALA 124   1.971   6.400  10.327
  920    HA   ALA 124           HA       ALA 124   3.075   4.592  11.135
  921    HB1  ALA 124           HB1      ALA 124   1.904   5.443  13.788
  922    HB2  ALA 124           HB2      ALA 124   3.450   5.964  13.116
  923    HB3  ALA 124           HB3      ALA 124   3.210   4.278  13.567
  924    H    ASP 125           HN       ASP 125   0.167   4.469  10.303
  925    HA   ASP 125           HA       ASP 125  -0.476   1.866  11.523
  926    HB2  ASP 125           HB2      ASP 125  -2.245   3.605  11.783
  927    HB3  ASP 125           HB1      ASP 125  -2.328   3.731  10.025
  928    H    LEU 126           HN       LEU 126  -0.745   0.126  10.197
  929    HA   LEU 126           HA       LEU 126  -0.280   0.568   7.324
  930    HG   LEU 126           HG       LEU 126   2.248  -0.078   6.943
  931    HB2  LEU 126           HB2      LEU 126   1.404  -0.747   9.072
  932    HB3  LEU 126           HB1      LEU 126   0.480  -2.061   8.365
  933   HD11  LEU 126          HD11      LEU 126   3.489  -2.047   6.277
  934   HD12  LEU 126          HD12      LEU 126   2.329  -3.086   7.105
  935   HD13  LEU 126          HD13      LEU 126   3.346  -1.984   8.034
  936   HD21  LEU 126          HD21      LEU 126   1.599  -1.177   4.852
  937   HD22  LEU 126          HD22      LEU 126   0.223  -0.386   5.626
  938   HD23  LEU 126          HD23      LEU 126   0.406  -2.137   5.731
  939    HA   PRO 127           HA       PRO 127  -4.301  -1.434   7.549
  940    HB2  PRO 127           HB2      PRO 127  -4.865  -0.410   4.935
  941    HB3  PRO 127           HB1      PRO 127  -5.463   0.182   6.487
  942    HG2  PRO 127           HG2      PRO 127  -3.753   1.559   4.826
  943    HG3  PRO 127           HG1      PRO 127  -3.919   1.849   6.570
  944    HD2  PRO 127           HD2      PRO 127  -1.843   0.287   5.094
  945    HD3  PRO 127           HD1      PRO 127  -1.660   1.362   6.493
  946    HA   PRO 128           HA       PRO 128  -3.549  -5.135   5.229
  947    HB2  PRO 128           HB2      PRO 128  -6.146  -6.001   4.973
  948    HB3  PRO 128           HB1      PRO 128  -5.165  -6.202   6.436
  949    HG2  PRO 128           HG2      PRO 128  -7.238  -4.138   5.811
  950    HG3  PRO 128           HG1      PRO 128  -6.944  -5.009   7.325
  951    HD2  PRO 128           HD2      PRO 128  -6.127  -2.472   6.951
  952    HD3  PRO 128           HD1      PRO 128  -5.189  -3.623   7.923
  953    H    HIS 129           HN       HIS 129  -5.472  -2.538   4.040
  954    HA   HIS 129           HA       HIS 129  -5.522  -3.707   1.355
  955    HD1  HIS 129           HD1      HIS 129  -7.904  -1.466   4.294
  956    HD2  HIS 129           HD2      HIS 129  -6.065   0.832   1.346
  957    HE1  HIS 129           HE1      HIS 129  -7.826   0.881   5.201
  958    HE2  HIS 129           HE2      HIS 129  -6.995   2.275   3.276
  959    HB2  HIS 129           HB2      HIS 129  -6.911  -1.766   0.713
  960    HB3  HIS 129           HB1      HIS 129  -7.622  -2.674   2.028
  961    H    LEU 130           HN       LEU 130  -3.097  -2.710   2.837
  962    HA   LEU 130           HA       LEU 130  -2.012  -1.268   0.549
  963    HG   LEU 130           HG       LEU 130  -1.001   0.741   0.532
  964    HB2  LEU 130           HB2      LEU 130  -2.850   0.228   2.538
  965    HB3  LEU 130           HB1      LEU 130  -1.311  -0.226   3.237
  966   HD11  LEU 130          HD11      LEU 130  -1.547   3.068   0.974
  967   HD12  LEU 130          HD12      LEU 130  -2.200   2.628   2.552
  968   HD13  LEU 130          HD13      LEU 130  -2.988   2.055   1.080
  969   HD21  LEU 130          HD21      LEU 130   0.049   1.697   3.187
  970   HD22  LEU 130          HD22      LEU 130   0.664   2.162   1.600
  971   HD23  LEU 130          HD23      LEU 130   0.809   0.492   2.148
  972    H    VAL 131           HN       VAL 131  -1.823  -3.850   2.310
  973    HA   VAL 131           HA       VAL 131   1.045  -3.808   2.810
  974    HB   VAL 131           HB       VAL 131   0.734  -6.131   3.675
  975   HG11  VAL 131          HG11      VAL 131   0.726  -4.250   5.198
  976   HG12  VAL 131          HG12      VAL 131  -0.428  -5.469   5.738
  977   HG13  VAL 131          HG13      VAL 131  -1.000  -4.007   4.934
  978   HG21  VAL 131          HG21      VAL 131  -1.519  -6.962   4.111
  979   HG22  VAL 131          HG22      VAL 131  -1.243  -6.752   2.382
  980   HG23  VAL 131          HG23      VAL 131  -2.206  -5.573   3.271
  981    HA   PRO 132           HA       PRO 132   1.968  -5.285  -1.263
  982    HB2  PRO 132           HB2      PRO 132   4.300  -6.507   0.141
  983    HB3  PRO 132           HB1      PRO 132   4.270  -5.453  -1.276
  984    HG2  PRO 132           HG2      PRO 132   5.023  -4.542   1.119
  985    HG3  PRO 132           HG1      PRO 132   4.105  -3.529  -0.011
  986    HD2  PRO 132           HD2      PRO 132   3.200  -4.928   2.461
  987    HD3  PRO 132           HD1      PRO 132   2.659  -3.378   1.769
  988    HA   PRO 133           HA       PRO 133   0.210  -9.344  -1.578
  989    HB2  PRO 133           HB2      PRO 133   2.686  -9.935  -3.162
  990    HB3  PRO 133           HB1      PRO 133   1.000 -10.334  -3.522
  991    HG2  PRO 133           HG2      PRO 133   2.206  -8.242  -4.681
  992    HG3  PRO 133           HG1      PRO 133   0.493  -8.180  -4.208
  993    HD2  PRO 133           HD2      PRO 133   2.832  -6.821  -3.018
  994    HD3  PRO 133           HD1      PRO 133   1.113  -6.392  -2.945
  995    H    SER 134           HN       SER 134   3.744  -9.446  -1.122
  996    HA   SER 134           HA       SER 134   3.925 -12.050  -0.133
  997    HG   SER 134           HG       SER 134   6.400 -12.352   0.685
  998    HB2  SER 134           HB2      SER 134   5.871 -10.877  -0.920
  999    HB3  SER 134           HB1      SER 134   5.675  -9.630   0.307
 1000    H    LYS 135           HN       LYS 135   2.758  -9.223   1.458
 1001    HA   LYS 135           HA       LYS 135   3.003 -10.580   4.050
 1002    HB2  LYS 135           HB2      LYS 135   2.963  -8.080   4.924
 1003    HB3  LYS 135           HB1      LYS 135   4.454  -8.906   4.509
 1004    HG2  LYS 135           HG2      LYS 135   3.033  -7.234   2.473
 1005    HG3  LYS 135           HG1      LYS 135   4.065  -6.490   3.700
 1006    HD2  LYS 135           HD2      LYS 135   4.901  -8.600   1.706
 1007    HD3  LYS 135           HD1      LYS 135   5.318  -6.887   1.650
 1008    HE2  LYS 135           HE2      LYS 135   6.511  -7.112   3.776
 1009    HE3  LYS 135           HE1      LYS 135   6.105  -8.826   3.824
 1010    HZ1  LYS 135           HZ1      LYS 135   7.355  -9.063   1.702
 1011    HZ2  LYS 135           HZ2      LYS 135   8.317  -8.592   3.013
 1012    HZ3  LYS 135           HZ3      LYS 135   7.853  -7.445   1.848
 1013    H    ARG 136           HN       ARG 136   0.836 -10.692   2.208
 1014    HA   ARG 136           HA       ARG 136  -1.348  -9.130   3.113
 1015    HE   ARG 136           HE       ARG 136  -0.630 -12.588  -1.543
 1016    HB2  ARG 136           HB2      ARG 136  -2.681 -10.821   1.890
 1017    HB3  ARG 136           HB1      ARG 136  -1.336 -10.218   0.939
 1018    HG2  ARG 136           HG2      ARG 136  -0.050 -12.232   1.526
 1019    HG3  ARG 136           HG1      ARG 136  -1.458 -12.848   2.389
 1020    HD2  ARG 136           HD2      ARG 136  -2.203 -13.716   0.489
 1021    HD3  ARG 136           HD1      ARG 136  -2.338 -12.081  -0.161
 1022   HH11  ARG 136          HH11      ARG 136  -0.212 -14.556   1.368
 1023   HH12  ARG 136          HH12      ARG 136   1.247 -15.304   0.776
 1024   HH21  ARG 136          HH21      ARG 136   1.256 -13.598  -2.283
 1025   HH22  ARG 136          HH22      ARG 136   2.055 -14.774  -1.290
 1026    H    ARG 137           HN       ARG 137  -1.064  -9.291   5.450
 1027    HA   ARG 137           HA       ARG 137  -2.475 -11.491   6.647
 1028    HE   ARG 137           HE       ARG 137   2.206 -12.741   8.296
 1029    HB2  ARG 137           HB2      ARG 137  -0.425 -12.029   8.132
 1030    HB3  ARG 137           HB1      ARG 137  -0.494 -12.712   6.514
 1031    HG2  ARG 137           HG2      ARG 137   0.812 -10.432   5.975
 1032    HG3  ARG 137           HG1      ARG 137   1.334 -10.691   7.640
 1033    HD2  ARG 137           HD2      ARG 137   1.438 -12.868   5.585
 1034    HD3  ARG 137           HD1      ARG 137   2.756 -11.714   5.765
 1035   HH11  ARG 137          HH11      ARG 137   3.311 -13.914   5.192
 1036   HH12  ARG 137          HH12      ARG 137   4.251 -15.209   5.861
 1037   HH21  ARG 137          HH21      ARG 137   3.443 -14.415   9.198
 1038   HH22  ARG 137          HH22      ARG 137   4.338 -15.487   8.164
 1039    H    HIS 138           HN       HIS 138  -3.430 -10.862   8.481
 1040    HA   HIS 138           HA       HIS 138  -2.475  -8.396   9.776
 1041    HD1  HIS 138           HD1      HIS 138  -5.781  -9.171  12.452
 1042    HD2  HIS 138           HD2      HIS 138  -4.124  -5.945  10.402
 1043    HE1  HIS 138           HE1      HIS 138  -5.993  -7.195  13.995
 1044    HE2  HIS 138           HE2      HIS 138  -4.893  -5.273  12.783
 1045    HB2  HIS 138           HB2      HIS 138  -4.847  -8.388   8.992
 1046    HB3  HIS 138           HB1      HIS 138  -5.175  -9.738  10.075
 1047    H    GLU 139           HN       GLU 139  -1.087  -8.909  11.339
 1048    HA   GLU 139           HA       GLU 139  -1.795 -11.101  13.164
 1049    HB2  GLU 139           HB2      GLU 139   0.942 -10.185  12.252
 1050    HB3  GLU 139           HB1      GLU 139   0.665 -11.360  13.532
 1051    HG2  GLU 139           HG2      GLU 139  -0.304 -12.911  12.016
 1052    HG3  GLU 139           HG1      GLU 139  -0.343 -11.715  10.722
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1 -25.804  33.727  18.091
    2    H2   GLY   1           HT2      GLY   1 -27.310  33.961  18.834
    3    H3   GLY   1           HT3      GLY   1 -27.155  34.136  17.163
    4    HA2  GLY   1           HA1      GLY   1 -26.754  31.605  18.647
    5    HA3  GLY   1           HA2      GLY   1 -28.220  32.034  17.785
    6    HA   PRO   2           HA       PRO   2 -26.857  30.289  14.022
    7    HB2  PRO   2           HB2      PRO   2 -27.131  32.873  12.584
    8    HB3  PRO   2           HB1      PRO   2 -27.921  31.322  12.279
    9    HG2  PRO   2           HG2      PRO   2 -29.272  33.338  13.371
   10    HG3  PRO   2           HG1      PRO   2 -29.529  31.666  13.912
   11    HD2  PRO   2           HD2      PRO   2 -27.945  33.858  15.205
   12    HD3  PRO   2           HD1      PRO   2 -29.025  32.661  15.949
   13    H    LEU   3           HN       LEU   3 -25.498  33.602  14.132
   14    HA   LEU   3           HA       LEU   3 -23.271  32.953  12.529
   15    HG   LEU   3           HG       LEU   3 -24.915  35.158  14.944
   16    HB2  LEU   3           HB2      LEU   3 -22.322  35.122  13.440
   17    HB3  LEU   3           HB1      LEU   3 -23.839  35.216  12.575
   18   HD11  LEU   3          HD11      LEU   3 -22.132  36.109  15.592
   19   HD12  LEU   3          HD12      LEU   3 -22.894  34.634  16.186
   20   HD13  LEU   3          HD13      LEU   3 -23.531  36.208  16.661
   21   HD21  LEU   3          HD21      LEU   3 -25.031  37.029  13.406
   22   HD22  LEU   3          HD22      LEU   3 -23.419  37.551  13.892
   23   HD23  LEU   3          HD23      LEU   3 -24.749  37.602  15.049
   24    H    GLY   4           HN       GLY   4 -21.134  32.588  13.047
   25    HA2  GLY   4           HA2      GLY   4 -19.419  32.095  14.708
   26    HA3  GLY   4           HA1      GLY   4 -20.712  31.578  15.791
   27    H    SER   5           HN       SER   5 -22.162  30.279  13.625
   28    HA   SER   5           HA       SER   5 -20.687  27.775  13.557
   29    HG   SER   5           HG       SER   5 -23.471  28.798  14.716
   30    HB2  SER   5           HB2      SER   5 -23.483  28.373  12.535
   31    HB3  SER   5           HB1      SER   5 -22.786  26.784  12.851
   32    H    GLU   6           HN       GLU   6 -19.367  27.383  11.890
   33    HA   GLU   6           HA       GLU   6 -19.685  28.906   9.444
   34    HB2  GLU   6           HB2      GLU   6 -17.487  27.121  10.464
   35    HB3  GLU   6           HB1      GLU   6 -17.467  27.840   8.858
   36    HG2  GLU   6           HG2      GLU   6 -17.576  29.344  11.462
   37    HG3  GLU   6           HG1      GLU   6 -16.155  29.147  10.438
   38    H    SER   7           HN       SER   7 -20.477  28.149   7.608
   39    HA   SER   7           HA       SER   7 -21.235  25.346   7.418
   40    HG   SER   7           HG       SER   7 -23.515  25.788   5.257
   41    HB2  SER   7           HB2      SER   7 -22.811  27.130   6.694
   42    HB3  SER   7           HB1      SER   7 -21.655  27.628   5.462
   43    H    LEU   8           HN       LEU   8 -19.734  23.963   6.761
   44    HA   LEU   8           HA       LEU   8 -17.567  24.913   5.035
   45    HG   LEU   8           HG       LEU   8 -16.195  22.144   4.771
   46    HB2  LEU   8           HB2      LEU   8 -16.972  23.821   7.160
   47    HB3  LEU   8           HB1      LEU   8 -17.815  22.375   6.647
   48   HD11  LEU   8          HD11      LEU   8 -14.123  23.434   4.852
   49   HD12  LEU   8          HD12      LEU   8 -14.778  24.399   6.177
   50   HD13  LEU   8          HD13      LEU   8 -15.520  24.475   4.580
   51   HD21  LEU   8          HD21      LEU   8 -14.969  22.259   7.524
   52   HD22  LEU   8          HD22      LEU   8 -14.359  21.335   6.151
   53   HD23  LEU   8          HD23      LEU   8 -15.913  20.919   6.874
   54    H    MET   9           HN       MET   9 -18.069  24.713   2.952
   55    HA   MET   9           HA       MET   9 -19.420  22.305   1.988
   56    HB2  MET   9           HB2      MET   9 -18.706  24.899   0.613
   57    HB3  MET   9           HB1      MET   9 -19.399  23.519  -0.224
   58    HG2  MET   9           HG2      MET   9 -20.689  25.009   2.049
   59    HG3  MET   9           HG1      MET   9 -21.073  25.209   0.342
   60    HE1  MET   9           HE1      MET   9 -23.657  24.746   0.827
   61    HE2  MET   9           HE2      MET   9 -23.254  24.618   2.540
   62    HE3  MET   9           HE3      MET   9 -24.230  23.368   1.769
   63    HA   PRO  10           HA       PRO  10 -15.382  20.560   1.273
   64    HB2  PRO  10           HB2      PRO  10 -16.943  18.532  -0.202
   65    HB3  PRO  10           HB1      PRO  10 -15.837  18.329   1.159
   66    HG2  PRO  10           HG2      PRO  10 -18.480  18.089   1.475
   67    HG3  PRO  10           HG1      PRO  10 -17.463  18.826   2.729
   68    HD2  PRO  10           HD2      PRO  10 -19.244  20.139   0.709
   69    HD3  PRO  10           HD1      PRO  10 -18.981  20.548   2.418
   70    H    SER  11           HN       SER  11 -17.803  21.030  -1.248
   71    HA   SER  11           HA       SER  11 -15.629  21.141  -3.224
   72    HG   SER  11           HG       SER  11 -16.402  19.374  -5.289
   73    HB2  SER  11           HB2      SER  11 -17.349  19.241  -3.418
   74    HB3  SER  11           HB1      SER  11 -18.495  20.490  -3.899
   75    H    GLN  12           HN       GLN  12 -15.235  23.301  -3.139
   76    HA   GLN  12           HA       GLN  12 -17.289  24.987  -4.366
   77    HB2  GLN  12           HB2      GLN  12 -17.405  25.453  -1.956
   78    HB3  GLN  12           HB1      GLN  12 -15.672  25.744  -1.917
   79    HG2  GLN  12           HG2      GLN  12 -15.967  27.682  -3.379
   80    HG3  GLN  12           HG1      GLN  12 -17.707  27.393  -3.408
   81   HE21  GLN  12          HE21      GLN  12 -14.995  28.366  -1.436
   82   HE22  GLN  12          HE22      GLN  12 -15.921  29.117  -0.180
   83    H    VAL  13           HN       VAL  13 -16.207  25.023  -6.303
   84    HA   VAL  13           HA       VAL  13 -13.326  25.486  -6.325
   85    HB   VAL  13           HB       VAL  13 -15.197  24.983  -8.648
   86   HG11  VAL  13          HG11      VAL  13 -13.154  24.447  -9.892
   87   HG12  VAL  13          HG12      VAL  13 -12.185  24.886  -8.488
   88   HG13  VAL  13          HG13      VAL  13 -13.141  26.114  -9.318
   89   HG21  VAL  13          HG21      VAL  13 -13.406  23.072  -7.157
   90   HG22  VAL  13          HG22      VAL  13 -14.342  22.693  -8.603
   91   HG23  VAL  13          HG23      VAL  13 -15.168  23.103  -7.100
   92    H    VAL  14           HN       VAL  14 -12.775  27.553  -6.072
   93    HA   VAL  14           HA       VAL  14 -14.328  29.588  -7.536
   94    HB   VAL  14           HB       VAL  14 -12.656  29.979  -5.051
   95   HG11  VAL  14          HG11      VAL  14 -14.441  31.872  -6.575
   96   HG12  VAL  14          HG12      VAL  14 -12.687  31.974  -6.409
   97   HG13  VAL  14          HG13      VAL  14 -13.722  32.211  -5.000
   98   HG21  VAL  14          HG21      VAL  14 -14.835  30.377  -3.942
   99   HG22  VAL  14          HG22      VAL  14 -14.633  28.720  -4.507
  100   HG23  VAL  14          HG23      VAL  14 -15.644  29.843  -5.415
  101    H    LYS  15           HN       LYS  15 -13.293  30.012  -9.372
  102    HA   LYS  15           HA       LYS  15 -10.539  30.998  -9.125
  103    HB2  LYS  15           HB2      LYS  15 -11.734  29.536 -11.498
  104    HB3  LYS  15           HB1      LYS  15 -10.179  30.354 -11.514
  105    HG2  LYS  15           HG2      LYS  15  -9.599  28.796  -9.535
  106    HG3  LYS  15           HG1      LYS  15 -10.979  27.850 -10.093
  107    HD2  LYS  15           HD2      LYS  15  -8.597  28.629 -11.777
  108    HD3  LYS  15           HD1      LYS  15  -8.856  27.048 -11.042
  109    HE2  LYS  15           HE2      LYS  15 -10.850  26.719 -12.379
  110    HE3  LYS  15           HE1      LYS  15 -10.689  28.340 -13.058
  111    HZ1  LYS  15           HZ1      LYS  15  -8.704  26.151 -13.384
  112    HZ2  LYS  15           HZ2      LYS  15  -8.622  27.687 -14.092
  113    HZ3  LYS  15           HZ3      LYS  15  -9.842  26.607 -14.549
  114    H    GLY  16           HN       GLY  16 -10.570  33.131  -9.326
  115    HA2  GLY  16           HA2      GLY  16 -12.890  34.399 -10.576
  116    HA3  GLY  16           HA1      GLY  16 -11.701  35.179  -9.544
  117    H    GLY  17           HN       GLY  17 -12.690  34.547 -12.718
  118    HA2  GLY  17           HA2      GLY  17 -12.031  35.611 -14.660
  119    HA3  GLY  17           HA1      GLY  17 -10.750  36.401 -13.750
  120    H    ALA  18           HN       ALA  18 -10.650  33.105 -13.220
  121    HA   ALA  18           HA       ALA  18  -8.236  32.918 -14.815
  122    HB1  ALA  18           HB1      ALA  18  -8.272  32.179 -12.459
  123    HB2  ALA  18           HB2      ALA  18  -7.778  30.903 -13.571
  124    HB3  ALA  18           HB3      ALA  18  -9.410  30.906 -12.900
  125    H    PHE  19           HN       PHE  19  -8.585  32.482 -16.896
  126    HA   PHE  19           HA       PHE  19 -10.703  30.724 -17.768
  127    HD1  PHE  19           HD2      PHE  19 -12.113  31.734 -19.936
  128    HD2  PHE  19           HD1      PHE  19  -9.033  34.379 -18.655
  129    HE1  PHE  19           HE2      PHE  19 -13.677  33.629 -20.093
  130    HE2  PHE  19           HE1      PHE  19 -10.593  36.274 -18.808
  131    HZ   PHE  19           HZ       PHE  19 -12.917  35.899 -19.532
  132    HB2  PHE  19           HB2      PHE  19  -8.507  32.163 -19.260
  133    HB3  PHE  19           HB1      PHE  19  -9.691  31.123 -20.049
  134    H    ASP  20           HN       ASP  20 -10.493  28.683 -18.637
  135    HA   ASP  20           HA       ASP  20  -7.863  27.404 -18.239
  136    HB2  ASP  20           HB2      ASP  20  -9.909  26.877 -16.638
  137    HB3  ASP  20           HB1      ASP  20 -10.398  25.835 -17.970
  138    H    GLY  21           HN       GLY  21  -7.349  25.675 -19.675
  139    HA2  GLY  21           HA2      GLY  21  -8.569  26.145 -22.300
  140    HA3  GLY  21           HA1      GLY  21  -6.987  25.435 -22.012
  141    H    THR  22           HN       THR  22 -10.063  24.795 -22.983
  142    HA   THR  22           HA       THR  22 -10.224  22.102 -21.900
  143    HB   THR  22           HB       THR  22 -12.307  22.093 -23.493
  144    HG1  THR  22           HG1      THR  22 -12.617  23.918 -24.501
  145   HG21  THR  22          HG21      THR  22 -13.658  23.135 -21.742
  146   HG22  THR  22          HG22      THR  22 -12.209  23.863 -21.044
  147   HG23  THR  22          HG23      THR  22 -12.409  22.111 -21.037
  148    H    MET  23           HN       MET  23  -9.064  20.550 -22.830
  149    HA   MET  23           HA       MET  23  -7.850  20.808 -25.371
  150    HB2  MET  23           HB2      MET  23  -8.194  18.448 -23.540
  151    HB3  MET  23           HB1      MET  23  -7.305  18.354 -25.056
  152    HG2  MET  23           HG2      MET  23  -5.860  20.208 -24.224
  153    HG3  MET  23           HG1      MET  23  -6.670  20.062 -22.668
  154    HE1  MET  23           HE1      MET  23  -3.029  18.546 -22.307
  155    HE2  MET  23           HE2      MET  23  -4.166  19.643 -21.533
  156    HE3  MET  23           HE3      MET  23  -3.620  19.949 -23.183
  157    H    ASN  24           HN       ASN  24  -8.525  20.302 -27.345
  158    HA   ASN  24           HA       ASN  24 -10.846  18.515 -27.613
  159    HB2  ASN  24           HB2      ASN  24 -11.419  19.692 -29.697
  160    HB3  ASN  24           HB1      ASN  24 -11.401  20.803 -28.330
  161   HD21  ASN  24          HD21      ASN  24  -9.954  19.935 -31.328
  162   HD22  ASN  24          HD22      ASN  24  -8.893  21.290 -31.455
  163    H    GLY  25           HN       GLY  25 -10.701  16.840 -29.052
  164    HA2  GLY  25           HA2      GLY  25  -9.545  15.932 -31.059
  165    HA3  GLY  25           HA1      GLY  25  -8.053  16.496 -30.333
  166    HA   PRO  26           HA       PRO  26  -8.109  12.635 -27.825
  167    HB2  PRO  26           HB2      PRO  26  -9.271  13.671 -25.326
  168    HB3  PRO  26           HB1      PRO  26  -7.687  12.940 -25.602
  169    HG2  PRO  26           HG2      PRO  26  -7.956  15.557 -25.092
  170    HG3  PRO  26           HG1      PRO  26  -6.719  14.952 -26.211
  171    HD2  PRO  26           HD2      PRO  26  -9.378  16.198 -26.816
  172    HD3  PRO  26           HD1      PRO  26  -7.803  16.467 -27.595
  173    H    PHE  27           HN       PHE  27  -9.542  11.092 -28.275
  174    HA   PHE  27           HA       PHE  27 -12.394  11.619 -27.865
  175    HD1  PHE  27           HD1      PHE  27 -13.510  12.084 -30.079
  176    HD2  PHE  27           HD2      PHE  27  -9.857  10.198 -31.184
  177    HE1  PHE  27           HE1      PHE  27 -13.347  13.559 -32.045
  178    HE2  PHE  27           HE2      PHE  27  -9.693  11.671 -33.150
  179    HZ   PHE  27           HZ       PHE  27 -11.435  13.355 -33.583
  180    HB2  PHE  27           HB2      PHE  27 -11.039   9.378 -29.382
  181    HB3  PHE  27           HB1      PHE  27 -12.771   9.673 -29.310
  182    H    GLY  28           HN       GLY  28 -13.140  11.013 -25.947
  183    HA2  GLY  28           HA2      GLY  28 -11.812   8.997 -24.382
  184    HA3  GLY  28           HA1      GLY  28 -13.264   9.881 -23.934
  185    H    HIS  29           HN       HIS  29 -12.732   7.058 -23.628
  186    HA   HIS  29           HA       HIS  29 -14.409   5.729 -25.579
  187    HD1  HIS  29           HD1      HIS  29 -10.736   4.601 -23.232
  188    HD2  HIS  29           HD2      HIS  29 -12.681   3.946 -26.856
  189    HE1  HIS  29           HE1      HIS  29  -8.914   4.167 -24.917
  190    HE2  HIS  29           HE2      HIS  29 -10.109   3.893 -27.121
  191    HB2  HIS  29           HB2      HIS  29 -13.196   4.704 -22.995
  192    HB3  HIS  29           HB1      HIS  29 -14.058   3.717 -24.168
  193    H    GLY  30           HN       GLY  30 -16.547   5.500 -25.437
  194    HA2  GLY  30           HA2      GLY  30 -17.834   5.677 -22.823
  195    HA3  GLY  30           HA1      GLY  30 -18.216   6.952 -23.965
  196    H    TYR  31           HN       TYR  31 -19.276   4.145 -22.746
  197    HA   TYR  31           HA       TYR  31 -21.028   3.734 -25.058
  198    HD1  TYR  31           HD1      TYR  31 -21.507   0.571 -22.268
  199    HD2  TYR  31           HD2      TYR  31 -17.633   1.858 -23.464
  200    HE1  TYR  31           HE1      TYR  31 -20.555  -0.420 -20.226
  201    HE2  TYR  31           HE2      TYR  31 -16.673   0.870 -21.431
  202    HH   TYR  31           HH       TYR  31 -17.447   0.272 -19.140
  203    HB2  TYR  31           HB2      TYR  31 -21.091   1.302 -24.547
  204    HB3  TYR  31           HB1      TYR  31 -19.493   1.840 -25.048
  205    H    GLY  32           HN       GLY  32 -23.083   2.592 -24.361
  206    HA2  GLY  32           HA2      GLY  32 -24.298   3.969 -22.218
  207    HA3  GLY  32           HA1      GLY  32 -24.976   2.579 -23.059
  208    H    GLU  33           HN       GLU  33 -23.233   3.696 -20.310
  209    HA   GLU  33           HA       GLU  33 -22.785   0.990 -19.335
  210    HB2  GLU  33           HB2      GLU  33 -21.641   2.303 -17.420
  211    HB3  GLU  33           HB1      GLU  33 -20.853   2.234 -18.987
  212    HG2  GLU  33           HG2      GLU  33 -20.643   4.449 -18.202
  213    HG3  GLU  33           HG1      GLU  33 -21.846   4.478 -19.487
  214    H    GLY  34           HN       GLY  34 -23.305   0.471 -17.098
  215    HA2  GLY  34           HA2      GLY  34 -25.706   1.890 -16.143
  216    HA3  GLY  34           HA1      GLY  34 -25.406   0.177 -15.874
  217    H    ALA  35           HN       ALA  35 -24.998   3.315 -14.688
  218    HA   ALA  35           HA       ALA  35 -22.716   3.501 -13.289
  219    HB1  ALA  35           HB1      ALA  35 -24.440   5.207 -13.239
  220    HB2  ALA  35           HB2      ALA  35 -23.908   4.813 -11.604
  221    HB3  ALA  35           HB3      ALA  35 -25.441   4.186 -12.207
  222    H    GLY  36           HN       GLY  36 -21.624   2.240 -11.994
  223    HA2  GLY  36           HA2      GLY  36 -23.031   0.157 -10.489
  224    HA3  GLY  36           HA1      GLY  36 -21.306   0.203 -10.836
  225    H    GLU  37           HN       GLU  37 -22.996   0.004  -8.321
  226    HA   GLU  37           HA       GLU  37 -22.057   2.354  -6.889
  227    HB2  GLU  37           HB2      GLU  37 -24.428   1.252  -6.761
  228    HB3  GLU  37           HB1      GLU  37 -23.647   0.161  -5.624
  229    HG2  GLU  37           HG2      GLU  37 -23.213   1.881  -4.101
  230    HG3  GLU  37           HG1      GLU  37 -23.484   3.138  -5.304
  231    H    GLY  38           HN       GLY  38 -21.617   1.374  -4.342
  232    HA2  GLY  38           HA2      GLY  38 -18.912   0.541  -4.777
  233    HA3  GLY  38           HA1      GLY  38 -19.632   0.928  -3.229
  234    H    ILE  39           HN       ILE  39 -19.770  -1.530  -5.747
  235    HA   ILE  39           HA       ILE  39 -20.418  -3.694  -4.144
  236    HB   ILE  39           HB       ILE  39 -19.053  -5.036  -5.860
  237   HG12  ILE  39          HG12      ILE  39 -18.800  -2.245  -7.000
  238   HG13  ILE  39          HG11      ILE  39 -17.508  -3.380  -6.647
  239   HG21  ILE  39          HG21      ILE  39 -21.454  -4.832  -5.981
  240   HG22  ILE  39          HG22      ILE  39 -20.762  -4.715  -7.599
  241   HG23  ILE  39          HG23      ILE  39 -21.309  -3.259  -6.766
  242   HD11  ILE  39          HD11      ILE  39 -18.219  -4.797  -8.472
  243   HD12  ILE  39          HD12      ILE  39 -17.955  -3.147  -9.044
  244   HD13  ILE  39          HD13      ILE  39 -19.596  -3.740  -8.787
  245    H    ASP  40           HN       ASP  40 -19.104  -5.234  -3.029
  246    HA   ASP  40           HA       ASP  40 -17.011  -3.891  -1.609
  247    HB2  ASP  40           HB2      ASP  40 -18.562  -6.359  -1.251
  248    HB3  ASP  40           HB1      ASP  40 -16.901  -6.449  -0.676
  249    H    ASP  41           HN       ASP  41 -15.612  -3.602  -3.458
  250    HA   ASP  41           HA       ASP  41 -13.795  -5.933  -3.649
  251    HB2  ASP  41           HB2      ASP  41 -14.852  -5.293  -5.840
  252    HB3  ASP  41           HB1      ASP  41 -14.048  -3.733  -5.717
  253    H    VAL  42           HN       VAL  42 -12.227  -5.592  -2.244
  254    HA   VAL  42           HA       VAL  42 -11.344  -2.943  -1.567
  255    HB   VAL  42           HB       VAL  42 -11.339  -4.582   0.197
  256   HG11  VAL  42          HG11      VAL  42  -9.419  -6.176  -1.490
  257   HG12  VAL  42          HG12      VAL  42 -11.082  -6.608  -1.089
  258   HG13  VAL  42          HG13      VAL  42  -9.858  -6.536   0.179
  259   HG21  VAL  42          HG21      VAL  42  -9.609  -2.884   0.340
  260   HG22  VAL  42          HG22      VAL  42  -8.509  -3.896  -0.596
  261   HG23  VAL  42          HG23      VAL  42  -9.028  -4.410   1.010
  262    H    GLU  43           HN       GLU  43  -9.538  -1.911  -2.226
  263    HA   GLU  43           HA       GLU  43  -7.729  -3.167  -4.106
  264    HB2  GLU  43           HB2      GLU  43  -9.555  -2.390  -5.534
  265    HB3  GLU  43           HB1      GLU  43  -9.473  -0.794  -4.803
  266    HG2  GLU  43           HG2      GLU  43  -7.031  -0.789  -5.641
  267    HG3  GLU  43           HG1      GLU  43  -7.563  -2.103  -6.687
  268    H    TRP  44           HN       TRP  44  -5.779  -2.516  -3.574
  269    HA   TRP  44           HA       TRP  44  -5.420  -0.070  -2.059
  270    HD1  TRP  44           HD1      TRP  44  -3.561   1.298  -1.488
  271    HE1  TRP  44           HE1      TRP  44  -1.204   1.960  -0.713
  272    HE3  TRP  44           HE3      TRP  44  -1.313  -3.233  -1.800
  273    HZ2  TRP  44           HZ2      TRP  44   1.288   0.699  -0.284
  274    HZ3  TRP  44           HZ3      TRP  44   1.055  -3.445  -1.226
  275    HH2  TRP  44           HH2      TRP  44   2.337  -1.521  -0.464
  276    HB2  TRP  44           HB2      TRP  44  -4.225  -2.084  -1.347
  277    HB3  TRP  44           HB1      TRP  44  -3.471  -2.190  -2.930
  278    H    VAL  45           HN       VAL  45  -4.415   1.678  -2.770
  279    HA   VAL  45           HA       VAL  45  -4.784   2.389  -5.453
  280    HB   VAL  45           HB       VAL  45  -3.107   3.830  -3.408
  281   HG11  VAL  45          HG11      VAL  45  -2.930   4.774  -5.629
  282   HG12  VAL  45          HG12      VAL  45  -3.859   5.858  -4.592
  283   HG13  VAL  45          HG13      VAL  45  -4.686   4.840  -5.773
  284   HG21  VAL  45          HG21      VAL  45  -5.216   5.022  -2.797
  285   HG22  VAL  45          HG22      VAL  45  -5.188   3.323  -2.325
  286   HG23  VAL  45          HG23      VAL  45  -6.105   3.831  -3.745
  287    H    VAL  46           HN       VAL  46  -2.199   0.695  -4.063
  288    HA   VAL  46           HA       VAL  46  -0.226   1.812  -5.880
  289    HB   VAL  46           HB       VAL  46   0.053  -0.356  -3.743
  290   HG11  VAL  46          HG11      VAL  46   2.487  -0.060  -4.066
  291   HG12  VAL  46          HG12      VAL  46   2.169   0.952  -5.475
  292   HG13  VAL  46          HG13      VAL  46   1.709  -0.755  -5.492
  293   HG21  VAL  46          HG21      VAL  46   1.023   2.493  -3.892
  294   HG22  VAL  46          HG22      VAL  46   1.350   1.349  -2.589
  295   HG23  VAL  46          HG23      VAL  46  -0.302   1.896  -2.892
  296    H    GLY  47           HN       GLY  47  -2.513  -0.684  -5.950
  297    HA2  GLY  47           HA2      GLY  47  -1.074  -2.461  -7.667
  298    HA3  GLY  47           HA1      GLY  47  -2.827  -2.408  -7.465
  299    H    LYS  48           HN       LYS  48  -2.342   0.622  -8.139
  300    HA   LYS  48           HA       LYS  48  -2.564   0.229 -11.030
  301    HB2  LYS  48           HB2      LYS  48  -3.772   2.473 -10.865
  302    HB3  LYS  48           HB1      LYS  48  -4.611   1.043 -10.285
  303    HG2  LYS  48           HG2      LYS  48  -3.897   1.679  -7.986
  304    HG3  LYS  48           HG1      LYS  48  -3.261   3.177  -8.662
  305    HD2  LYS  48           HD2      LYS  48  -5.552   3.380  -7.681
  306    HD3  LYS  48           HD1      LYS  48  -5.440   3.862  -9.374
  307    HE2  LYS  48           HE2      LYS  48  -6.403   1.795 -10.097
  308    HE3  LYS  48           HE1      LYS  48  -6.333   1.133  -8.464
  309    HZ1  LYS  48           HZ1      LYS  48  -8.038   2.533  -7.749
  310    HZ2  LYS  48           HZ2      LYS  48  -8.555   1.995  -9.269
  311    HZ3  LYS  48           HZ3      LYS  48  -7.912   3.554  -9.100
  312    H    ASP  49           HN       ASP  49  -0.895   2.017  -8.540
  313    HA   ASP  49           HA       ASP  49   0.380   3.661 -10.619
  314    HB2  ASP  49           HB2      ASP  49  -0.857   4.770  -8.671
  315    HB3  ASP  49           HB1      ASP  49   0.454   4.192  -7.650
  316    H    LYS  50           HN       LYS  50   0.870   0.863  -9.264
  317    HA   LYS  50           HA       LYS  50   3.320   0.835  -8.005
  318    HB2  LYS  50           HB2      LYS  50   1.640  -1.061  -8.287
  319    HB3  LYS  50           HB1      LYS  50   2.396  -1.347  -9.852
  320    HG2  LYS  50           HG2      LYS  50   4.588  -1.525  -8.623
  321    HG3  LYS  50           HG1      LYS  50   3.642  -1.551  -7.133
  322    HD2  LYS  50           HD2      LYS  50   2.403  -3.501  -8.022
  323    HD3  LYS  50           HD1      LYS  50   3.494  -3.509  -9.412
  324    HE2  LYS  50           HE2      LYS  50   5.339  -3.519  -7.546
  325    HE3  LYS  50           HE1      LYS  50   4.038  -4.183  -6.564
  326    HZ1  LYS  50           HZ1      LYS  50   5.474  -5.847  -7.686
  327    HZ2  LYS  50           HZ2      LYS  50   4.860  -5.316  -9.173
  328    HZ3  LYS  50           HZ3      LYS  50   3.821  -6.013  -8.026
  329    HA   PRO  51           HA       PRO  51   5.206  -0.014 -12.542
  330    HB2  PRO  51           HB2      PRO  51   4.008   1.881 -14.243
  331    HB3  PRO  51           HB1      PRO  51   3.816   0.123 -14.310
  332    HG2  PRO  51           HG2      PRO  51   2.051   2.181 -13.078
  333    HG3  PRO  51           HG1      PRO  51   1.620   0.669 -13.897
  334    HD2  PRO  51           HD2      PRO  51   1.501   0.868 -11.237
  335    HD3  PRO  51           HD1      PRO  51   2.080  -0.626 -12.018
  336    H    THR  52           HN       THR  52   4.015   3.003 -11.205
  337    HA   THR  52           HA       THR  52   6.109   4.650 -12.240
  338    HB   THR  52           HB       THR  52   4.428   5.181  -9.782
  339    HG1  THR  52           HG1      THR  52   2.746   5.578 -11.040
  340   HG21  THR  52          HG21      THR  52   6.303   6.734 -10.237
  341   HG22  THR  52          HG22      THR  52   4.727   7.516 -10.366
  342   HG23  THR  52          HG23      THR  52   5.610   7.070 -11.826
  343    H    TYR  53           HN       TYR  53   5.493   2.928  -9.245
  344    HA   TYR  53           HA       TYR  53   7.867   3.924  -7.943
  345    HD1  TYR  53           HD2      TYR  53   6.284   5.305  -6.798
  346    HD2  TYR  53           HD1      TYR  53   4.007   1.732  -6.430
  347    HE1  TYR  53           HE2      TYR  53   4.281   6.635  -6.291
  348    HE2  TYR  53           HE1      TYR  53   1.999   3.056  -5.930
  349    HH   TYR  53           HH       TYR  53   1.675   6.193  -6.597
  350    HB2  TYR  53           HB2      TYR  53   6.191   1.571  -7.107
  351    HB3  TYR  53           HB1      TYR  53   7.163   2.617  -6.085
  352    H    ASP  54           HN       ASP  54   6.909   1.229  -9.882
  353    HA   ASP  54           HA       ASP  54   9.212  -0.420  -9.243
  354    HB2  ASP  54           HB2      ASP  54   7.157  -1.512  -9.893
  355    HB3  ASP  54           HB1      ASP  54   7.057  -0.575 -11.379
  356    H    GLU  55           HN       GLU  55   8.288   1.876 -11.802
  357    HA   GLU  55           HA       GLU  55  10.525   1.350 -13.468
  358    HB2  GLU  55           HB2      GLU  55  10.020   3.433 -14.579
  359    HB3  GLU  55           HB1      GLU  55   8.526   2.570 -14.254
  360    HG2  GLU  55           HG2      GLU  55   8.152   4.008 -12.289
  361    HG3  GLU  55           HG1      GLU  55   9.604   4.926 -12.731
  362    H    ILE  56           HN       ILE  56  10.011   3.638 -10.792
  363    HA   ILE  56           HA       ILE  56  12.653   4.683 -10.944
  364    HB   ILE  56           HB       ILE  56  10.887   4.548  -8.493
  365   HG12  ILE  56          HG12      ILE  56  11.108   6.781 -10.526
  366   HG13  ILE  56          HG11      ILE  56   9.813   5.577 -10.530
  367   HG21  ILE  56          HG21      ILE  56  12.167   6.511  -7.773
  368   HG22  ILE  56          HG22      ILE  56  13.157   6.399  -9.230
  369   HG23  ILE  56          HG23      ILE  56  13.215   5.114  -8.022
  370   HD11  ILE  56          HD11      ILE  56   9.105   7.655  -9.490
  371   HD12  ILE  56          HD12      ILE  56  10.406   7.515  -8.308
  372   HD13  ILE  56          HD13      ILE  56   9.106   6.324  -8.331
  373    H    PHE  57           HN       PHE  57  11.204   1.878  -9.520
  374    HA   PHE  57           HA       PHE  57  13.170   1.062  -7.725
  375    HD1  PHE  57           HD2      PHE  57  12.746  -0.877  -6.026
  376    HD2  PHE  57           HD1      PHE  57  11.895  -2.692  -9.774
  377    HE1  PHE  57           HE2      PHE  57  13.593  -3.025  -5.181
  378    HE2  PHE  57           HE1      PHE  57  12.737  -4.843  -8.936
  379    HZ   PHE  57           HZ       PHE  57  13.585  -5.011  -6.628
  380    HB2  PHE  57           HB2      PHE  57  11.003   0.019  -7.750
  381    HB3  PHE  57           HB1      PHE  57  11.228  -0.527  -9.406
  382    H    TYR  58           HN       TYR  58  12.734  -0.081 -11.096
  383    HA   TYR  58           HA       TYR  58  15.223  -1.450 -11.161
  384    HD1  TYR  58           HD1      TYR  58  11.711  -1.705 -11.796
  385    HD2  TYR  58           HD2      TYR  58  14.918  -3.683 -13.759
  386    HE1  TYR  58           HE1      TYR  58  10.564  -3.850 -11.496
  387    HE2  TYR  58           HE2      TYR  58  13.772  -5.838 -13.475
  388    HH   TYR  58           HH       TYR  58  10.501  -6.014 -12.167
  389    HB2  TYR  58           HB2      TYR  58  13.370  -0.510 -13.351
  390    HB3  TYR  58           HB1      TYR  58  14.884  -1.351 -13.702
  391    H    THR  59           HN       THR  59  14.352   1.834 -11.618
  392    HA   THR  59           HA       THR  59  16.627   2.664 -13.098
  393    HB   THR  59           HB       THR  59  14.630   4.150 -11.391
  394    HG1  THR  59           HG1      THR  59  13.648   3.550 -13.233
  395   HG21  THR  59          HG21      THR  59  16.788   5.316 -13.149
  396   HG22  THR  59          HG22      THR  59  16.678   5.460 -11.393
  397   HG23  THR  59          HG23      THR  59  15.460   6.216 -12.422
  398    H    LEU  60           HN       LEU  60  16.026   2.059  -9.706
  399    HA   LEU  60           HA       LEU  60  18.440   3.441  -8.877
  400    HG   LEU  60           HG       LEU  60  15.462   3.897  -7.861
  401    HB2  LEU  60           HB2      LEU  60  16.458   1.769  -7.337
  402    HB3  LEU  60           HB1      LEU  60  17.855   2.552  -6.612
  403   HD11  LEU  60          HD11      LEU  60  15.094   4.724  -5.617
  404   HD12  LEU  60          HD12      LEU  60  16.561   3.920  -5.053
  405   HD13  LEU  60          HD13      LEU  60  15.184   2.962  -5.595
  406   HD21  LEU  60          HD21      LEU  60  17.535   5.093  -8.409
  407   HD22  LEU  60          HD22      LEU  60  17.946   5.143  -6.694
  408   HD23  LEU  60          HD23      LEU  60  16.521   5.998  -7.284
  409    H    SER  61           HN       SER  61  18.015   0.664 -10.419
  410    HA   SER  61           HA       SER  61  19.293  -1.153 -10.821
  411    HG   SER  61           HG       SER  61  21.393  -2.025 -10.769
  412    HB2  SER  61           HB2      SER  61  21.178   0.466 -10.704
  413    HB3  SER  61           HB1      SER  61  21.326   0.132  -8.980
  414    HA   PRO  62           HA       PRO  62  17.993  -3.137  -6.892
  415    HB2  PRO  62           HB2      PRO  62  16.191  -4.821  -7.961
  416    HB3  PRO  62           HB1      PRO  62  15.798  -3.135  -7.599
  417    HG2  PRO  62           HG2      PRO  62  16.438  -4.418 -10.214
  418    HG3  PRO  62           HG1      PRO  62  15.267  -3.144  -9.845
  419    HD2  PRO  62           HD2      PRO  62  17.776  -2.729 -10.937
  420    HD3  PRO  62           HD1      PRO  62  16.812  -1.500 -10.085
  421    H    VAL  63           HN       VAL  63  18.521  -5.152  -6.089
  422    HA   VAL  63           HA       VAL  63  19.822  -7.019  -7.939
  423    HB   VAL  63           HB       VAL  63  21.198  -7.747  -5.974
  424   HG11  VAL  63          HG11      VAL  63  21.543  -4.885  -6.847
  425   HG12  VAL  63          HG12      VAL  63  22.140  -6.308  -7.699
  426   HG13  VAL  63          HG13      VAL  63  22.790  -5.892  -6.113
  427   HG21  VAL  63          HG21      VAL  63  20.151  -5.207  -4.745
  428   HG22  VAL  63          HG22      VAL  63  21.458  -6.201  -4.095
  429   HG23  VAL  63          HG23      VAL  63  19.819  -6.846  -4.185
  430    H    ASN  64           HN       ASN  64  18.955  -8.947  -8.054
  431    HA   ASN  64           HA       ASN  64  17.703 -10.786  -7.647
  432    HB2  ASN  64           HB2      ASN  64  18.161 -10.053  -4.747
  433    HB3  ASN  64           HB1      ASN  64  17.503 -11.590  -5.307
  434   HD21  ASN  64          HD21      ASN  64  20.301  -9.776  -4.686
  435   HD22  ASN  64          HD22      ASN  64  21.460 -10.923  -5.255
  436    H    GLY  65           HN       GLY  65  16.441  -8.051  -7.768
  437    HA2  GLY  65           HA2      GLY  65  14.164  -7.621  -8.119
  438    HA3  GLY  65           HA1      GLY  65  13.774  -9.023  -7.134
  439    H    LYS  66           HN       LYS  66  16.045  -6.708  -5.918
  440    HA   LYS  66           HA       LYS  66  14.088  -4.962  -4.761
  441    HB2  LYS  66           HB2      LYS  66  14.777  -5.318  -2.398
  442    HB3  LYS  66           HB1      LYS  66  13.908  -6.685  -3.077
  443    HG2  LYS  66           HG2      LYS  66  16.907  -6.611  -2.980
  444    HG3  LYS  66           HG1      LYS  66  15.934  -7.177  -1.614
  445    HD2  LYS  66           HD2      LYS  66  15.684  -8.224  -4.402
  446    HD3  LYS  66           HD1      LYS  66  16.706  -8.982  -3.176
  447    HE2  LYS  66           HE2      LYS  66  14.946  -9.918  -2.144
  448    HE3  LYS  66           HE1      LYS  66  13.993  -8.441  -2.270
  449    HZ1  LYS  66           HZ1      LYS  66  13.450  -9.027  -4.549
  450    HZ2  LYS  66           HZ2      LYS  66  12.969 -10.252  -3.489
  451    HZ3  LYS  66           HZ3      LYS  66  14.362 -10.449  -4.433
  452    H    ILE  67           HN       ILE  67  14.983  -3.089  -3.915
  453    HA   ILE  67           HA       ILE  67  17.679  -2.579  -4.879
  454    HB   ILE  67           HB       ILE  67  17.165  -0.200  -3.999
  455   HG12  ILE  67          HG12      ILE  67  14.415  -1.477  -3.850
  456   HG13  ILE  67          HG11      ILE  67  15.329  -0.774  -2.523
  457   HG21  ILE  67          HG21      ILE  67  17.147  -0.774  -6.366
  458   HG22  ILE  67          HG22      ILE  67  15.795   0.299  -5.998
  459   HG23  ILE  67          HG23      ILE  67  15.513  -1.427  -6.227
  460   HD11  ILE  67          HD11      ILE  67  13.590   0.718  -3.217
  461   HD12  ILE  67          HD12      ILE  67  14.177   0.688  -4.879
  462   HD13  ILE  67          HD13      ILE  67  15.162   1.418  -3.609
  463    H    THR  68           HN       THR  68  19.438  -2.499  -3.638
  464    HA   THR  68           HA       THR  68  19.456  -3.230  -0.932
  465    HB   THR  68           HB       THR  68  21.788  -2.035  -1.042
  466    HG1  THR  68           HG1      THR  68  21.893  -0.897  -2.847
  467   HG21  THR  68          HG21      THR  68  21.461  -4.466  -1.103
  468   HG22  THR  68          HG22      THR  68  22.744  -3.967  -2.204
  469   HG23  THR  68          HG23      THR  68  21.150  -4.381  -2.835
  470    H    GLY  69           HN       GLY  69  18.777  -2.112   0.760
  471    HA2  GLY  69           HA2      GLY  69  17.076  -0.057   0.418
  472    HA3  GLY  69           HA1      GLY  69  17.799  -0.436   1.972
  473    H    ALA  70           HN       ALA  70  20.496   0.447   0.966
  474    HA   ALA  70           HA       ALA  70  20.561   3.075   1.757
  475    HB1  ALA  70           HB1      ALA  70  22.684   3.267   0.607
  476    HB2  ALA  70           HB2      ALA  70  22.319   1.828  -0.346
  477    HB3  ALA  70           HB3      ALA  70  22.552   1.696   1.398
  478    H    ASN  71           HN       ASN  71  19.623   1.840  -1.396
  479    HA   ASN  71           HA       ASN  71  19.724   4.425  -2.683
  480    HB2  ASN  71           HB2      ASN  71  18.564   3.168  -4.572
  481    HB3  ASN  71           HB1      ASN  71  20.177   2.619  -4.138
  482   HD21  ASN  71          HD21      ASN  71  19.889   0.617  -4.971
  483   HD22  ASN  71          HD22      ASN  71  18.874  -0.563  -4.242
  484    H    ALA  72           HN       ALA  72  17.220   2.306  -1.375
  485    HA   ALA  72           HA       ALA  72  15.024   3.942  -2.147
  486    HB1  ALA  72           HB1      ALA  72  14.708   1.610  -1.564
  487    HB2  ALA  72           HB2      ALA  72  13.770   2.638  -0.483
  488    HB3  ALA  72           HB3      ALA  72  15.279   1.917   0.077
  489    H    LYS  73           HN       LYS  73  17.157   3.759   0.591
  490    HA   LYS  73           HA       LYS  73  15.892   5.698   2.219
  491    HB2  LYS  73           HB2      LYS  73  18.821   4.961   2.030
  492    HB3  LYS  73           HB1      LYS  73  18.119   5.958   3.295
  493    HG2  LYS  73           HG2      LYS  73  17.570   3.051   2.756
  494    HG3  LYS  73           HG1      LYS  73  18.420   3.746   4.138
  495    HD2  LYS  73           HD2      LYS  73  15.585   4.469   3.501
  496    HD3  LYS  73           HD1      LYS  73  15.978   3.047   4.462
  497    HE2  LYS  73           HE2      LYS  73  16.821   5.864   5.119
  498    HE3  LYS  73           HE1      LYS  73  15.441   5.027   5.843
  499    HZ1  LYS  73           HZ1      LYS  73  17.221   3.259   6.436
  500    HZ2  LYS  73           HZ2      LYS  73  17.091   4.659   7.378
  501    HZ3  LYS  73           HZ3      LYS  73  18.326   4.529   6.226
  502    H    LYS  74           HN       LYS  74  18.247   5.841  -0.360
  503    HA   LYS  74           HA       LYS  74  18.947   8.534  -0.317
  504    HB2  LYS  74           HB2      LYS  74  19.771   6.572  -1.826
  505    HB3  LYS  74           HB1      LYS  74  18.442   7.040  -2.878
  506    HG2  LYS  74           HG2      LYS  74  20.404   8.093  -3.684
  507    HG3  LYS  74           HG1      LYS  74  19.403   9.343  -2.934
  508    HD2  LYS  74           HD2      LYS  74  21.713   9.615  -2.285
  509    HD3  LYS  74           HD1      LYS  74  20.747   9.161  -0.886
  510    HE2  LYS  74           HE2      LYS  74  22.808   7.919  -0.846
  511    HE3  LYS  74           HE1      LYS  74  21.482   6.814  -1.204
  512    HZ1  LYS  74           HZ1      LYS  74  22.096   7.065  -3.601
  513    HZ2  LYS  74           HZ2      LYS  74  23.258   6.289  -2.654
  514    HZ3  LYS  74           HZ3      LYS  74  23.481   7.908  -3.104
  515    H    GLU  75           HN       GLU  75  16.326   6.878  -1.996
  516    HA   GLU  75           HA       GLU  75  15.177   9.129  -3.205
  517    HB2  GLU  75           HB2      GLU  75  13.862   6.533  -2.422
  518    HB3  GLU  75           HB1      GLU  75  13.104   7.761  -3.425
  519    HG2  GLU  75           HG2      GLU  75  15.357   5.911  -4.067
  520    HG3  GLU  75           HG1      GLU  75  13.912   6.300  -4.992
  521    H    MET  76           HN       MET  76  14.227   7.555  -0.155
  522    HA   MET  76           HA       MET  76  12.186   9.467   0.350
  523    HB2  MET  76           HB2      MET  76  12.283   8.484   2.722
  524    HB3  MET  76           HB1      MET  76  11.820   7.420   1.403
  525    HG2  MET  76           HG2      MET  76  14.057   6.502   1.331
  526    HG3  MET  76           HG1      MET  76  14.554   7.595   2.617
  527    HE1  MET  76           HE1      MET  76  11.155   5.495   2.251
  528    HE2  MET  76           HE2      MET  76  11.655   4.028   3.091
  529    HE3  MET  76           HE3      MET  76  12.461   4.504   1.597
  530    H    VAL  77           HN       VAL  77  15.601   9.419   1.018
  531    HA   VAL  77           HA       VAL  77  15.564  11.573   2.907
  532    HB   VAL  77           HB       VAL  77  17.795  10.487   1.169
  533   HG11  VAL  77          HG11      VAL  77  17.933  12.707   3.219
  534   HG12  VAL  77          HG12      VAL  77  18.204  12.869   1.485
  535   HG13  VAL  77          HG13      VAL  77  19.325  11.925   2.466
  536   HG21  VAL  77          HG21      VAL  77  18.710   9.773   3.347
  537   HG22  VAL  77          HG22      VAL  77  17.132   9.056   3.022
  538   HG23  VAL  77          HG23      VAL  77  17.271  10.409   4.145
  539    H    LYS  78           HN       LYS  78  16.174  11.384  -0.598
  540    HA   LYS  78           HA       LYS  78  16.649  14.166  -0.923
  541    HB2  LYS  78           HB2      LYS  78  16.789  13.739  -3.219
  542    HB3  LYS  78           HB1      LYS  78  17.301  12.223  -2.492
  543    HG2  LYS  78           HG2      LYS  78  14.644  11.796  -2.736
  544    HG3  LYS  78           HG1      LYS  78  14.952  12.837  -4.126
  545    HD2  LYS  78           HD2      LYS  78  16.480  10.335  -3.471
  546    HD3  LYS  78           HD1      LYS  78  15.162  10.427  -4.637
  547    HE2  LYS  78           HE2      LYS  78  16.571  12.212  -5.799
  548    HE3  LYS  78           HE1      LYS  78  17.886  11.663  -4.755
  549    HZ1  LYS  78           HZ1      LYS  78  17.357   9.355  -5.632
  550    HZ2  LYS  78           HZ2      LYS  78  18.107  10.428  -6.719
  551    HZ3  LYS  78           HZ3      LYS  78  16.445  10.128  -6.833
  552    H    SER  79           HN       SER  79  13.825  12.363  -0.431
  553    HA   SER  79           HA       SER  79  11.948  14.043  -1.718
  554    HG   SER  79           HG       SER  79   9.971  13.182  -1.585
  555    HB2  SER  79           HB2      SER  79  11.622  11.678  -0.688
  556    HB3  SER  79           HB1      SER  79  11.335  12.555   0.821
  557    H    LYS  80           HN       LYS  80  14.032  14.564   0.863
  558    HA   LYS  80           HA       LYS  80  14.464  16.408   2.097
  559    HB2  LYS  80           HB2      LYS  80  12.053  17.555   0.681
  560    HB3  LYS  80           HB1      LYS  80  13.032  18.460   1.839
  561    HG2  LYS  80           HG2      LYS  80  14.931  18.385   0.444
  562    HG3  LYS  80           HG1      LYS  80  14.200  17.173  -0.611
  563    HD2  LYS  80           HD2      LYS  80  12.929  19.862  -0.256
  564    HD3  LYS  80           HD1      LYS  80  14.267  19.642  -1.384
  565    HE2  LYS  80           HE2      LYS  80  12.204  19.429  -2.585
  566    HE3  LYS  80           HE1      LYS  80  12.971  17.846  -2.495
  567    HZ1  LYS  80           HZ1      LYS  80  10.584  17.743  -2.086
  568    HZ2  LYS  80           HZ2      LYS  80  10.746  18.779  -0.752
  569    HZ3  LYS  80           HZ3      LYS  80  11.458  17.239  -0.721
  570    H    LEU  81           HN       LEU  81  13.945  14.853   3.767
  571    HA   LEU  81           HA       LEU  81  11.640  15.716   5.382
  572    HG   LEU  81           HG       LEU  81  11.319  13.750   2.983
  573    HB2  LEU  81           HB2      LEU  81  12.480  12.838   5.048
  574    HB3  LEU  81           HB1      LEU  81  11.118  13.444   5.968
  575   HD11  LEU  81          HD11      LEU  81   9.929  11.605   4.579
  576   HD12  LEU  81          HD12      LEU  81  11.374  11.374   3.595
  577   HD13  LEU  81          HD13      LEU  81   9.846  11.818   2.831
  578   HD21  LEU  81          HD21      LEU  81   9.803  15.268   4.218
  579   HD22  LEU  81          HD22      LEU  81   8.981  13.856   4.883
  580   HD23  LEU  81          HD23      LEU  81   8.945  14.162   3.146
  581    HA   PRO  82           HA       PRO  82  14.572  15.081   8.782
  582    HB2  PRO  82           HB2      PRO  82  12.866  14.687  10.828
  583    HB3  PRO  82           HB1      PRO  82  13.073  16.285  10.080
  584    HG2  PRO  82           HG2      PRO  82  10.904  14.269   9.677
  585    HG3  PRO  82           HG1      PRO  82  10.781  16.028   9.831
  586    HD2  PRO  82           HD2      PRO  82  10.725  14.670   7.453
  587    HD3  PRO  82           HD1      PRO  82  11.242  16.365   7.620
  588    H    ASN  83           HN       ASN  83  15.053  13.387  10.462
  589    HA   ASN  83           HA       ASN  83  15.089  10.835   9.247
  590    HB2  ASN  83           HB2      ASN  83  15.739  11.700  12.057
  591    HB3  ASN  83           HB1      ASN  83  15.995  10.064  11.463
  592   HD21  ASN  83          HD21      ASN  83  16.770  10.970   8.789
  593   HD22  ASN  83          HD22      ASN  83  18.380  11.583   8.960
  594    H    THR  84           HN       THR  84  12.903  12.306  11.486
  595    HA   THR  84           HA       THR  84  11.772  10.004  12.623
  596    HB   THR  84           HB       THR  84   9.762  11.544  12.958
  597    HG1  THR  84           HG1      THR  84  10.276  13.780  12.553
  598   HG21  THR  84          HG21      THR  84  10.927  12.898  14.633
  599   HG22  THR  84          HG22      THR  84  12.472  12.457  13.906
  600   HG23  THR  84          HG23      THR  84  11.470  11.219  14.665
  601    H    VAL  85           HN       VAL  85  10.713  11.988   9.864
  602    HA   VAL  85           HA       VAL  85   8.592  10.273   9.113
  603    HB   VAL  85           HB       VAL  85  10.109  12.222   7.364
  604   HG11  VAL  85          HG11      VAL  85   8.059  12.279   6.030
  605   HG12  VAL  85          HG12      VAL  85   7.334  11.065   7.084
  606   HG13  VAL  85          HG13      VAL  85   8.737  10.652   6.097
  607   HG21  VAL  85          HG21      VAL  85   8.346  13.825   7.939
  608   HG22  VAL  85          HG22      VAL  85   9.251  13.323   9.365
  609   HG23  VAL  85          HG23      VAL  85   7.648  12.657   9.059
  610    H    LEU  86           HN       LEU  86  11.928  10.621   7.949
  611    HA   LEU  86           HA       LEU  86  12.125   8.649   6.055
  612    HG   LEU  86           HG       LEU  86  15.475  10.133   6.300
  613    HB2  LEU  86           HB2      LEU  86  13.933   9.787   8.079
  614    HB3  LEU  86           HB1      LEU  86  14.402   8.204   7.472
  615   HD11  LEU  86          HD11      LEU  86  15.194   9.208   4.082
  616   HD12  LEU  86          HD12      LEU  86  13.733   8.367   4.601
  617   HD13  LEU  86          HD13      LEU  86  15.301   7.924   5.283
  618   HD21  LEU  86          HD21      LEU  86  12.709  10.573   5.203
  619   HD22  LEU  86          HD22      LEU  86  14.182  11.401   4.688
  620   HD23  LEU  86          HD23      LEU  86  13.549  11.646   6.319
  621    H    GLY  87           HN       GLY  87  12.482   8.255   9.553
  622    HA2  GLY  87           HA2      GLY  87  12.994   5.516   9.583
  623    HA3  GLY  87           HA1      GLY  87  12.365   6.447  10.931
  624    H    LYS  88           HN       LYS  88   9.871   7.229   9.907
  625    HA   LYS  88           HA       LYS  88   8.603   4.674  10.290
  626    HB2  LYS  88           HB2      LYS  88   6.527   5.840  10.632
  627    HB3  LYS  88           HB1      LYS  88   7.798   6.573  11.591
  628    HG2  LYS  88           HG2      LYS  88   7.933   8.436  10.101
  629    HG3  LYS  88           HG1      LYS  88   6.836   7.647   8.961
  630    HD2  LYS  88           HD2      LYS  88   5.018   7.776  10.511
  631    HD3  LYS  88           HD1      LYS  88   6.081   8.329  11.800
  632    HE2  LYS  88           HE2      LYS  88   6.513  10.389  10.448
  633    HE3  LYS  88           HE1      LYS  88   5.275   9.839   9.321
  634    HZ1  LYS  88           HZ1      LYS  88   3.633   9.932  11.049
  635    HZ2  LYS  88           HZ2      LYS  88   4.434  11.424  11.009
  636    HZ3  LYS  88           HZ3      LYS  88   4.806  10.302  12.218
  637    H    ILE  89           HN       ILE  89   9.154   6.787   7.598
  638    HA   ILE  89           HA       ILE  89   7.206   5.608   5.887
  639    HB   ILE  89           HB       ILE  89   9.840   6.958   5.270
  640   HG12  ILE  89          HG12      ILE  89   6.944   7.779   4.929
  641   HG13  ILE  89          HG11      ILE  89   8.109   8.451   6.065
  642   HG21  ILE  89          HG21      ILE  89   9.419   5.296   3.532
  643   HG22  ILE  89          HG22      ILE  89   9.220   6.932   2.905
  644   HG23  ILE  89          HG23      ILE  89   7.801   5.951   3.280
  645   HD11  ILE  89          HD11      ILE  89   9.427   9.310   4.190
  646   HD12  ILE  89          HD12      ILE  89   7.781   9.943   4.203
  647   HD13  ILE  89          HD13      ILE  89   8.222   8.669   3.068
  648    H    TRP  90           HN       TRP  90  10.609   4.919   6.602
  649    HA   TRP  90           HA       TRP  90  10.859   2.670   4.934
  650    HD1  TRP  90           HD1      TRP  90  13.037   0.767   8.161
  651    HE1  TRP  90           HE1      TRP  90  14.452  -1.037   6.961
  652    HE3  TRP  90           HE3      TRP  90  13.226   2.865   3.503
  653    HZ2  TRP  90           HZ2      TRP  90  15.528  -1.478   4.376
  654    HZ3  TRP  90           HZ3      TRP  90  14.476   1.702   1.728
  655    HH2  TRP  90           HH2      TRP  90  15.592  -0.420   2.155
  656    HB2  TRP  90           HB2      TRP  90  12.774   3.819   5.984
  657    HB3  TRP  90           HB1      TRP  90  12.281   3.179   7.539
  658    H    LYS  91           HN       LYS  91  10.140   2.822   8.428
  659    HA   LYS  91           HA       LYS  91   9.947  -0.009   8.622
  660    HB2  LYS  91           HB2      LYS  91   9.353   0.322  10.920
  661    HB3  LYS  91           HB1      LYS  91  10.644   1.438  10.495
  662    HG2  LYS  91           HG2      LYS  91   9.020   3.240  10.288
  663    HG3  LYS  91           HG1      LYS  91   7.733   2.123  10.741
  664    HD2  LYS  91           HD2      LYS  91   8.906   1.723  12.892
  665    HD3  LYS  91           HD1      LYS  91  10.094   2.945  12.424
  666    HE2  LYS  91           HE2      LYS  91   8.311   4.615  12.281
  667    HE3  LYS  91           HE1      LYS  91   7.136   3.387  12.756
  668    HZ1  LYS  91           HZ1      LYS  91   9.423   4.317  14.422
  669    HZ2  LYS  91           HZ2      LYS  91   8.260   3.167  14.880
  670    HZ3  LYS  91           HZ3      LYS  91   7.807   4.780  14.627
  671    H    LEU  92           HN       LEU  92   7.747   2.317   7.514
  672    HA   LEU  92           HA       LEU  92   5.455   0.590   8.035
  673    HG   LEU  92           HG       LEU  92   3.266   1.582   6.745
  674    HB2  LEU  92           HB2      LEU  92   5.508   3.222   7.963
  675    HB3  LEU  92           HB1      LEU  92   5.357   2.967   6.215
  676   HD11  LEU  92          HD11      LEU  92   3.684   1.226   9.112
  677   HD12  LEU  92          HD12      LEU  92   2.158   2.076   8.861
  678   HD13  LEU  92          HD13      LEU  92   3.581   2.964   9.408
  679   HD21  LEU  92          HD21      LEU  92   3.240   4.528   7.418
  680   HD22  LEU  92          HD22      LEU  92   1.848   3.557   6.937
  681   HD23  LEU  92          HD23      LEU  92   3.166   3.837   5.797
  682    H    ALA  93           HN       ALA  93   7.625   1.547   5.414
  683    HA   ALA  93           HA       ALA  93   6.113   0.101   3.425
  684    HB1  ALA  93           HB1      ALA  93   7.335   2.106   2.818
  685    HB2  ALA  93           HB2      ALA  93   7.929   0.714   1.914
  686    HB3  ALA  93           HB3      ALA  93   8.854   1.338   3.282
  687    H    ASP  94           HN       ASP  94   9.191  -0.371   5.136
  688    HA   ASP  94           HA       ASP  94   9.453  -3.031   3.947
  689    HB2  ASP  94           HB2      ASP  94  11.453  -1.521   4.166
  690    HB3  ASP  94           HB1      ASP  94  11.313  -1.664   5.906
  691    H    VAL  95           HN       VAL  95   7.484  -3.688   4.983
  692    HA   VAL  95           HA       VAL  95   7.172  -3.873   7.785
  693    HB   VAL  95           HB       VAL  95   6.018  -5.783   5.749
  694   HG11  VAL  95          HG11      VAL  95   4.133  -5.877   7.325
  695   HG12  VAL  95          HG12      VAL  95   5.014  -4.814   8.423
  696   HG13  VAL  95          HG13      VAL  95   5.645  -6.420   8.055
  697   HG21  VAL  95          HG21      VAL  95   5.674  -3.503   4.968
  698   HG22  VAL  95          HG22      VAL  95   4.989  -3.059   6.532
  699   HG23  VAL  95          HG23      VAL  95   4.153  -4.219   5.500
  700    H    ASP  96           HN       ASP  96   8.919  -5.678   5.471
  701    HA   ASP  96           HA       ASP  96   9.281  -8.057   7.044
  702    HB2  ASP  96           HB2      ASP  96   9.244  -8.148   4.617
  703    HB3  ASP  96           HB1      ASP  96  10.578  -6.987   4.540
  704    H    LYS  97           HN       LYS  97  10.892  -5.021   6.543
  705    HA   LYS  97           HA       LYS  97  12.615  -3.975   7.545
  706    HB2  LYS  97           HB2      LYS  97  12.036  -5.924   9.776
  707    HB3  LYS  97           HB1      LYS  97  12.916  -4.403   9.930
  708    HG2  LYS  97           HG2      LYS  97  10.958  -3.166   9.248
  709    HG3  LYS  97           HG1      LYS  97  10.067  -4.656   9.005
  710    HD2  LYS  97           HD2      LYS  97  10.425  -5.144  11.450
  711    HD3  LYS  97           HD1      LYS  97  11.073  -3.506  11.601
  712    HE2  LYS  97           HE2      LYS  97   8.951  -2.621  10.700
  713    HE3  LYS  97           HE1      LYS  97   8.308  -4.263  10.654
  714    HZ1  LYS  97           HZ1      LYS  97   7.544  -3.270  12.641
  715    HZ2  LYS  97           HZ2      LYS  97   9.080  -2.684  13.040
  716    HZ3  LYS  97           HZ3      LYS  97   8.764  -4.351  13.099
  717    H    ASP  98           HN       ASP  98  13.976  -4.779   5.923
  718    HA   ASP  98           HA       ASP  98  15.778  -6.944   6.769
  719    HB2  ASP  98           HB2      ASP  98  15.890  -7.464   4.256
  720    HB3  ASP  98           HB1      ASP  98  14.400  -7.904   5.101
  721    H    GLY  99           HN       GLY  99  15.490  -3.778   5.350
  722    HA2  GLY  99           HA2      GLY  99  17.365  -2.264   5.375
  723    HA3  GLY  99           HA1      GLY  99  18.435  -3.655   5.259
  724    H    LEU 100           HN       LEU 100  15.731  -3.857   3.258
  725    HA   LEU 100           HA       LEU 100  16.812  -2.352   1.043
  726    HG   LEU 100           HG       LEU 100  16.520  -5.856   2.124
  727    HB2  LEU 100           HB2      LEU 100  16.650  -4.361  -0.477
  728    HB3  LEU 100           HB1      LEU 100  18.003  -4.352   0.632
  729   HD11  LEU 100          HD11      LEU 100  14.432  -5.536   0.891
  730   HD12  LEU 100          HD12      LEU 100  14.909  -7.234   0.928
  731   HD13  LEU 100          HD13      LEU 100  15.157  -6.280  -0.535
  732   HD21  LEU 100          HD21      LEU 100  18.549  -6.598   1.018
  733   HD22  LEU 100          HD22      LEU 100  17.655  -6.866  -0.479
  734   HD23  LEU 100          HD23      LEU 100  17.305  -7.847   0.944
  735    H    LEU 101           HN       LEU 101  15.125  -3.154  -0.965
  736    HA   LEU 101           HA       LEU 101  12.445  -3.387   0.137
  737    HG   LEU 101           HG       LEU 101  13.496  -0.572   1.057
  738    HB2  LEU 101           HB2      LEU 101  13.324  -0.904  -1.347
  739    HB3  LEU 101           HB1      LEU 101  11.644  -1.385  -1.190
  740   HD11  LEU 101          HD11      LEU 101  12.016   1.313   1.301
  741   HD12  LEU 101          HD12      LEU 101  10.990   0.711  -0.002
  742   HD13  LEU 101          HD13      LEU 101  12.628   1.255  -0.352
  743   HD21  LEU 101          HD21      LEU 101  11.965  -2.337   1.785
  744   HD22  LEU 101          HD22      LEU 101  10.604  -1.397   1.172
  745   HD23  LEU 101          HD23      LEU 101  11.564  -0.780   2.511
  746    H    ASP 102           HN       ASP 102  11.467  -4.823  -1.176
  747    HA   ASP 102           HA       ASP 102  12.529  -5.370  -3.787
  748    HB2  ASP 102           HB2      ASP 102  11.010  -7.151  -3.911
  749    HB3  ASP 102           HB1      ASP 102  11.392  -7.042  -2.197
  750    H    ASP 103           HN       ASP 103  10.459  -5.710  -5.472
  751    HA   ASP 103           HA       ASP 103  10.050  -3.097  -6.454
  752    HB2  ASP 103           HB2      ASP 103   9.682  -4.309  -8.291
  753    HB3  ASP 103           HB1      ASP 103   9.611  -5.785  -7.318
  754    H    GLU 104           HN       GLU 104   8.008  -5.195  -4.474
  755    HA   GLU 104           HA       GLU 104   5.777  -3.328  -4.532
  756    HB2  GLU 104           HB2      GLU 104   6.277  -6.031  -3.522
  757    HB3  GLU 104           HB1      GLU 104   5.326  -5.044  -2.421
  758    HG2  GLU 104           HG2      GLU 104   3.516  -5.241  -3.666
  759    HG3  GLU 104           HG1      GLU 104   4.393  -4.740  -5.126
  760    H    GLU 105           HN       GLU 105   8.393  -4.206  -2.302
  761    HA   GLU 105           HA       GLU 105   7.527  -2.631  -0.147
  762    HB2  GLU 105           HB2      GLU 105   9.871  -4.139  -0.851
  763    HB3  GLU 105           HB1      GLU 105  10.334  -2.613  -0.115
  764    HG2  GLU 105           HG2      GLU 105   9.095  -3.068   1.846
  765    HG3  GLU 105           HG1      GLU 105   8.277  -4.430   1.097
  766    H    PHE 106           HN       PHE 106   9.530  -1.827  -2.951
  767    HA   PHE 106           HA       PHE 106   9.948   0.901  -2.244
  768    HD1  PHE 106           HD2      PHE 106   9.338   2.755  -3.971
  769    HD2  PHE 106           HD1      PHE 106  12.584   0.645  -5.730
  770    HE1  PHE 106           HE2      PHE 106  10.236   4.859  -4.881
  771    HE2  PHE 106           HE1      PHE 106  13.462   2.735  -6.632
  772    HZ   PHE 106           HZ       PHE 106  12.300   4.846  -6.205
  773    HB2  PHE 106           HB2      PHE 106  11.223  -0.404  -4.009
  774    HB3  PHE 106           HB1      PHE 106   9.811  -0.268  -5.041
  775    H    ALA 107           HN       ALA 107   7.512  -0.882  -4.046
  776    HA   ALA 107           HA       ALA 107   6.062   1.127  -5.199
  777    HB1  ALA 107           HB1      ALA 107   4.134  -0.363  -5.107
  778    HB2  ALA 107           HB2      ALA 107   4.965  -1.370  -3.915
  779    HB3  ALA 107           HB3      ALA 107   5.602  -1.232  -5.555
  780    H    LEU 108           HN       LEU 108   5.605  -0.121  -1.844
  781    HA   LEU 108           HA       LEU 108   3.724   2.038  -1.425
  782    HG   LEU 108           HG       LEU 108   5.819  -0.040   0.781
  783    HB2  LEU 108           HB2      LEU 108   3.462   1.275   0.842
  784    HB3  LEU 108           HB1      LEU 108   3.102   0.049  -0.358
  785   HD11  LEU 108          HD11      LEU 108   4.440   0.655   2.687
  786   HD12  LEU 108          HD12      LEU 108   4.997  -1.010   2.862
  787   HD13  LEU 108          HD13      LEU 108   3.334  -0.681   2.368
  788   HD21  LEU 108          HD21      LEU 108   5.233  -2.432   0.825
  789   HD22  LEU 108          HD22      LEU 108   4.950  -1.718  -0.764
  790   HD23  LEU 108          HD23      LEU 108   3.590  -2.024   0.319
  791    H    ALA 109           HN       ALA 109   7.016   1.307  -0.442
  792    HA   ALA 109           HA       ALA 109   7.628   3.397   1.225
  793    HB1  ALA 109           HB1      ALA 109   9.850   3.483   0.201
  794    HB2  ALA 109           HB2      ALA 109   9.255   2.551  -1.171
  795    HB3  ALA 109           HB3      ALA 109   9.306   1.821   0.433
  796    H    ASN 110           HN       ASN 110   7.506   3.629  -2.330
  797    HA   ASN 110           HA       ASN 110   7.988   6.454  -2.337
  798    HB2  ASN 110           HB2      ASN 110   8.651   4.807  -4.159
  799    HB3  ASN 110           HB1      ASN 110   6.960   4.812  -4.644
  800   HD21  ASN 110          HD21      ASN 110   8.727   7.593  -3.422
  801   HD22  ASN 110          HD22      ASN 110   8.685   8.497  -4.893
  802    H    HIS 111           HN       HIS 111   5.196   4.354  -2.575
  803    HA   HIS 111           HA       HIS 111   3.336   6.333  -3.378
  804    HD1  HIS 111           HD1      HIS 111   0.805   5.587  -4.435
  805    HD2  HIS 111           HD2      HIS 111   0.556   4.067  -0.568
  806    HE1  HIS 111           HE1      HIS 111  -1.597   5.886  -3.741
  807    HE2  HIS 111           HE2      HIS 111  -1.675   5.171  -1.318
  808    HB2  HIS 111           HB2      HIS 111   2.801   3.974  -3.624
  809    HB3  HIS 111           HB1      HIS 111   2.898   3.737  -1.878
  810    H    LEU 112           HN       LEU 112   4.549   5.254  -0.293
  811    HA   LEU 112           HA       LEU 112   2.796   6.837   1.298
  812    HG   LEU 112           HG       LEU 112   3.456   3.972   1.692
  813    HB2  LEU 112           HB2      LEU 112   5.436   5.490   1.838
  814    HB3  LEU 112           HB1      LEU 112   4.584   6.434   3.064
  815   HD11  LEU 112          HD11      LEU 112   5.369   3.452   3.146
  816   HD12  LEU 112          HD12      LEU 112   3.849   2.836   3.796
  817   HD13  LEU 112          HD13      LEU 112   4.571   4.294   4.476
  818   HD21  LEU 112          HD21      LEU 112   1.732   5.544   2.402
  819   HD22  LEU 112          HD22      LEU 112   2.442   5.611   4.016
  820   HD23  LEU 112          HD23      LEU 112   1.727   4.109   3.427
  821    H    ILE 113           HN       ILE 113   5.928   7.316  -0.196
  822    HA   ILE 113           HA       ILE 113   6.561   9.842   0.836
  823    HB   ILE 113           HB       ILE 113   7.169   8.526  -1.800
  824   HG12  ILE 113          HG12      ILE 113   8.940   9.303   0.519
  825   HG13  ILE 113          HG11      ILE 113   8.219   7.709   0.327
  826   HG21  ILE 113          HG21      ILE 113   8.171  11.200  -0.835
  827   HG22  ILE 113          HG22      ILE 113   7.122  10.921  -2.227
  828   HG23  ILE 113          HG23      ILE 113   8.783  10.325  -2.237
  829   HD11  ILE 113          HD11      ILE 113   9.476   7.396  -1.741
  830   HD12  ILE 113          HD12      ILE 113  10.546   7.756  -0.390
  831   HD13  ILE 113          HD13      ILE 113  10.167   9.007  -1.570
  832    H    LYS 114           HN       LYS 114   4.604   8.916  -1.985
  833    HA   LYS 114           HA       LYS 114   3.887  11.585  -2.647
  834    HB2  LYS 114           HB2      LYS 114   2.799  10.677  -4.391
  835    HB3  LYS 114           HB1      LYS 114   3.581   9.190  -3.896
  836    HG2  LYS 114           HG2      LYS 114   1.469   8.412  -4.077
  837    HG3  LYS 114           HG1      LYS 114   1.373   8.992  -2.414
  838    HD2  LYS 114           HD2      LYS 114   0.349  11.054  -3.143
  839    HD3  LYS 114           HD1      LYS 114   0.546  10.600  -4.838
  840    HE2  LYS 114           HE2      LYS 114  -0.927   8.639  -4.417
  841    HE3  LYS 114           HE1      LYS 114  -1.180   9.232  -2.778
  842    HZ1  LYS 114           HZ1      LYS 114  -2.973   9.840  -4.349
  843    HZ2  LYS 114           HZ2      LYS 114  -1.868  10.771  -5.224
  844    HZ3  LYS 114           HZ3      LYS 114  -2.242  11.184  -3.618
  845    H    VAL 115           HN       VAL 115   2.500   9.207  -0.486
  846    HA   VAL 115           HA       VAL 115   0.072  10.457   0.132
  847    HB   VAL 115           HB       VAL 115   1.843   8.529   1.609
  848   HG11  VAL 115          HG11      VAL 115   0.836   9.924   3.351
  849   HG12  VAL 115          HG12      VAL 115   0.149   8.302   3.352
  850   HG13  VAL 115          HG13      VAL 115  -0.761   9.642   2.657
  851   HG21  VAL 115          HG21      VAL 115   0.496   7.730  -0.272
  852   HG22  VAL 115          HG22      VAL 115  -0.961   8.323   0.524
  853   HG23  VAL 115          HG23      VAL 115  -0.028   7.018   1.256
  854    H    LYS 116           HN       LYS 116   3.235  10.764   1.790
  855    HA   LYS 116           HA       LYS 116   2.326  12.743   3.617
  856    HB2  LYS 116           HB2      LYS 116   4.703  13.172   4.043
  857    HB3  LYS 116           HB1      LYS 116   4.352  11.446   4.046
  858    HG2  LYS 116           HG2      LYS 116   5.298  11.142   1.932
  859    HG3  LYS 116           HG1      LYS 116   5.337  12.875   1.614
  860    HD2  LYS 116           HD2      LYS 116   7.005  13.132   3.403
  861    HD3  LYS 116           HD1      LYS 116   7.006  11.374   3.620
  862    HE2  LYS 116           HE2      LYS 116   8.848  12.029   2.193
  863    HE3  LYS 116           HE1      LYS 116   7.658  11.106   1.274
  864    HZ1  LYS 116           HZ1      LYS 116   6.820  13.131   0.323
  865    HZ2  LYS 116           HZ2      LYS 116   8.498  13.073   0.085
  866    HZ3  LYS 116           HZ3      LYS 116   7.849  14.076   1.285
  867    H    LEU 117           HN       LEU 117   3.446  12.827   0.341
  868    HA   LEU 117           HA       LEU 117   4.168  15.579   0.232
  869    HG   LEU 117           HG       LEU 117   3.433  16.050  -2.727
  870    HB2  LEU 117           HB2      LEU 117   5.020  13.885  -1.332
  871    HB3  LEU 117           HB1      LEU 117   3.389  13.665  -1.968
  872   HD11  LEU 117          HD11      LEU 117   5.133  16.886  -1.194
  873   HD12  LEU 117          HD12      LEU 117   5.593  17.178  -2.872
  874   HD13  LEU 117          HD13      LEU 117   6.345  15.864  -1.966
  875   HD21  LEU 117          HD21      LEU 117   4.863  15.608  -4.657
  876   HD22  LEU 117          HD22      LEU 117   3.880  14.201  -4.251
  877   HD23  LEU 117          HD23      LEU 117   5.589  14.241  -3.811
  878    H    GLU 118           HN       GLU 118   1.189  13.860   0.104
  879    HA   GLU 118           HA       GLU 118  -0.343  15.824  -1.270
  880    HB2  GLU 118           HB2      GLU 118  -1.275  13.693   0.666
  881    HB3  GLU 118           HB1      GLU 118  -2.299  14.597  -0.443
  882    HG2  GLU 118           HG2      GLU 118  -1.007  13.648  -2.330
  883    HG3  GLU 118           HG1      GLU 118  -0.114  12.660  -1.167
  884    H    GLY 119           HN       GLY 119   1.059  15.825   1.792
  885    HA2  GLY 119           HA2      GLY 119   1.025  18.023   2.862
  886    HA3  GLY 119           HA1      GLY 119  -0.697  18.089   2.521
  887    H    HIS 120           HN       HIS 120  -0.076  14.981   3.428
  888    HA   HIS 120           HA       HIS 120  -0.350  15.608   6.282
  889    HD1  HIS 120           HD1      HIS 120  -2.070  11.847   6.941
  890    HD2  HIS 120           HD2      HIS 120  -1.991  12.844   2.897
  891    HE1  HIS 120           HE1      HIS 120  -2.236   9.672   5.706
  892    HE2  HIS 120           HE2      HIS 120  -2.494  10.338   3.286
  893    HB2  HIS 120           HB2      HIS 120  -2.217  14.294   6.583
  894    HB3  HIS 120           HB1      HIS 120  -2.516  14.874   4.952
  895    H    GLU 121           HN       GLU 121   0.884  14.398   7.623
  896    HA   GLU 121           HA       GLU 121   2.925  12.794   6.452
  897    HB2  GLU 121           HB2      GLU 121   3.710  12.460   8.759
  898    HB3  GLU 121           HB1      GLU 121   3.415  14.156   8.401
  899    HG2  GLU 121           HG2      GLU 121   1.585  14.272   9.784
  900    HG3  GLU 121           HG1      GLU 121   1.273  12.538   9.690
  901    H    LEU 122           HN       LEU 122   3.467  10.614   7.287
  902    HA   LEU 122           HA       LEU 122   1.304   8.842   6.837
  903    HG   LEU 122           HG       LEU 122   2.974   8.149   5.101
  904    HB2  LEU 122           HB2      LEU 122   4.065   8.261   7.903
  905    HB3  LEU 122           HB1      LEU 122   2.898   7.047   7.405
  906   HD11  LEU 122          HD11      LEU 122   4.086  10.224   5.751
  907   HD12  LEU 122          HD12      LEU 122   5.032   9.343   4.552
  908   HD13  LEU 122          HD13      LEU 122   5.512   9.312   6.248
  909   HD21  LEU 122          HD21      LEU 122   4.970   6.869   4.497
  910   HD22  LEU 122          HD22      LEU 122   3.927   5.983   5.609
  911   HD23  LEU 122          HD23      LEU 122   5.397   6.750   6.206
  912    HA   PRO 123           HA       PRO 123  -0.115   8.530  10.971
  913    HB2  PRO 123           HB2      PRO 123  -2.044   6.750  10.559
  914    HB3  PRO 123           HB1      PRO 123  -2.090   8.325   9.756
  915    HG2  PRO 123           HG2      PRO 123  -1.347   5.646   8.660
  916    HG3  PRO 123           HG1      PRO 123  -2.190   6.995   7.864
  917    HD2  PRO 123           HD2      PRO 123   0.546   6.359   7.662
  918    HD3  PRO 123           HD1      PRO 123  -0.236   7.851   7.103
  919    H    ALA 124           HN       ALA 124   1.606   6.064   9.482
  920    HA   ALA 124           HA       ALA 124   2.622   4.165  10.158
  921    HB1  ALA 124           HB1      ALA 124   3.551   5.557  11.926
  922    HB2  ALA 124           HB2      ALA 124   3.218   3.933  12.529
  923    HB3  ALA 124           HB3      ALA 124   2.125   5.260  12.921
  924    H    ASP 125           HN       ASP 125  -0.165   4.090   9.605
  925    HA   ASP 125           HA       ASP 125  -0.747   1.689  11.186
  926    HB2  ASP 125           HB2      ASP 125  -2.997   1.907  10.805
  927    HB3  ASP 125           HB1      ASP 125  -2.510   3.561  11.095
  928    H    LEU 126           HN       LEU 126  -0.839  -0.193  10.237
  929    HA   LEU 126           HA       LEU 126  -0.433  -0.301   7.326
  930    HG   LEU 126           HG       LEU 126   0.238  -3.206   7.023
  931    HB2  LEU 126           HB2      LEU 126   1.450  -1.090   8.801
  932    HB3  LEU 126           HB1      LEU 126   0.399  -2.388   9.334
  933   HD11  LEU 126          HD11      LEU 126   1.629  -2.266   5.283
  934   HD12  LEU 126          HD12      LEU 126   2.270  -1.066   6.407
  935   HD13  LEU 126          HD13      LEU 126   0.571  -1.014   5.944
  936   HD21  LEU 126          HD21      LEU 126   1.950  -4.116   8.502
  937   HD22  LEU 126          HD22      LEU 126   3.064  -2.839   8.013
  938   HD23  LEU 126          HD23      LEU 126   2.527  -4.040   6.840
  939    HA   PRO 127           HA       PRO 127  -4.388  -2.419   7.996
  940    HB2  PRO 127           HB2      PRO 127  -5.809  -0.969   6.266
  941    HB3  PRO 127           HB1      PRO 127  -5.304  -0.299   7.823
  942    HG2  PRO 127           HG2      PRO 127  -4.305   0.270   5.105
  943    HG3  PRO 127           HG1      PRO 127  -4.284   1.296   6.549
  944    HD2  PRO 127           HD2      PRO 127  -2.161  -0.331   5.487
  945    HD3  PRO 127           HD1      PRO 127  -2.134   0.710   6.927
  946    HA   PRO 128           HA       PRO 128  -4.729  -5.345   4.682
  947    HB2  PRO 128           HB2      PRO 128  -7.406  -5.013   3.929
  948    HB3  PRO 128           HB1      PRO 128  -6.798  -6.101   5.187
  949    HG2  PRO 128           HG2      PRO 128  -8.005  -3.385   5.449
  950    HG3  PRO 128           HG1      PRO 128  -8.147  -4.791   6.519
  951    HD2  PRO 128           HD2      PRO 128  -6.581  -2.709   7.140
  952    HD3  PRO 128           HD1      PRO 128  -6.115  -4.376   7.541
  953    H    HIS 129           HN       HIS 129  -5.951  -2.104   4.068
  954    HA   HIS 129           HA       HIS 129  -5.879  -2.516   1.210
  955    HD1  HIS 129           HD1      HIS 129  -8.191  -0.548   4.331
  956    HD2  HIS 129           HD2      HIS 129  -5.181   1.807   2.683
  957    HE1  HIS 129           HE1      HIS 129  -7.824   1.323   5.966
  958    HE2  HIS 129           HE2      HIS 129  -5.853   2.610   5.059
  959    HB2  HIS 129           HB2      HIS 129  -6.534  -0.097   1.063
  960    HB3  HIS 129           HB1      HIS 129  -7.673  -1.119   1.912
  961    H    LEU 130           HN       LEU 130  -3.371  -2.504   2.996
  962    HA   LEU 130           HA       LEU 130  -1.782  -1.292   0.868
  963    HG   LEU 130           HG       LEU 130  -1.125   0.866   1.020
  964    HB2  LEU 130           HB2      LEU 130  -1.774  -0.354   3.636
  965    HB3  LEU 130           HB1      LEU 130  -0.187  -0.672   2.989
  966   HD11  LEU 130          HD11      LEU 130  -2.537   1.908   3.467
  967   HD12  LEU 130          HD12      LEU 130  -3.316   1.201   2.050
  968   HD13  LEU 130          HD13      LEU 130  -2.419   2.715   1.902
  969   HD21  LEU 130          HD21      LEU 130   0.925   1.226   2.255
  970   HD22  LEU 130          HD22      LEU 130   0.012   1.848   3.631
  971   HD23  LEU 130          HD23      LEU 130   0.024   2.736   2.106
  972    H    VAL 131           HN       VAL 131  -2.477  -4.035   2.096
  973    HA   VAL 131           HA       VAL 131  -0.074  -4.948   3.337
  974    HB   VAL 131           HB       VAL 131  -2.322  -6.543   2.102
  975   HG11  VAL 131          HG11      VAL 131  -0.293  -7.870   2.146
  976   HG12  VAL 131          HG12      VAL 131  -1.401  -8.431   3.398
  977   HG13  VAL 131          HG13      VAL 131  -0.016  -7.433   3.832
  978   HG21  VAL 131          HG21      VAL 131  -3.049  -6.878   4.394
  979   HG22  VAL 131          HG22      VAL 131  -2.956  -5.152   4.037
  980   HG23  VAL 131          HG23      VAL 131  -1.686  -5.927   4.983
  981    HA   PRO 132           HA       PRO 132   2.191  -5.230  -0.542
  982    HB2  PRO 132           HB2      PRO 132   4.333  -6.257   1.189
  983    HB3  PRO 132           HB1      PRO 132   4.324  -4.839   0.134
  984    HG2  PRO 132           HG2      PRO 132   4.274  -4.616   2.816
  985    HG3  PRO 132           HG1      PRO 132   3.441  -3.467   1.753
  986    HD2  PRO 132           HD2      PRO 132   2.315  -5.737   3.351
  987    HD3  PRO 132           HD1      PRO 132   1.656  -4.105   3.066
  988    HA   PRO 133           HA       PRO 133   1.399  -9.617  -1.036
  989    HB2  PRO 133           HB2      PRO 133   2.309  -9.131  -3.786
  990    HB3  PRO 133           HB1      PRO 133   0.733  -9.695  -3.204
  991    HG2  PRO 133           HG2      PRO 133   1.082  -7.232  -4.243
  992    HG3  PRO 133           HG1      PRO 133  -0.081  -7.550  -2.928
  993    HD2  PRO 133           HD2      PRO 133   2.672  -6.362  -2.794
  994    HD3  PRO 133           HD1      PRO 133   1.183  -5.876  -1.935
  995    H    SER 134           HN       SER 134   4.291  -7.999  -0.969
  996    HA   SER 134           HA       SER 134   5.886 -10.306  -1.780
  997    HG   SER 134           HG       SER 134   7.391  -6.606  -0.989
  998    HB2  SER 134           HB2      SER 134   7.807  -8.757  -1.408
  999    HB3  SER 134           HB1      SER 134   6.649  -8.156  -2.593
 1000    H    LYS 135           HN       LYS 135   4.859  -8.588   1.106
 1001    HA   LYS 135           HA       LYS 135   6.828 -10.008   2.704
 1002    HB2  LYS 135           HB2      LYS 135   5.930  -8.678   4.627
 1003    HB3  LYS 135           HB1      LYS 135   6.643  -7.736   3.336
 1004    HG2  LYS 135           HG2      LYS 135   4.722  -6.581   4.065
 1005    HG3  LYS 135           HG1      LYS 135   4.334  -7.278   2.497
 1006    HD2  LYS 135           HD2      LYS 135   2.425  -7.651   3.789
 1007    HD3  LYS 135           HD1      LYS 135   3.267  -9.196   3.818
 1008    HE2  LYS 135           HE2      LYS 135   3.697  -7.187   6.004
 1009    HE3  LYS 135           HE1      LYS 135   2.282  -8.232   6.024
 1010    HZ1  LYS 135           HZ1      LYS 135   5.126  -9.065   6.107
 1011    HZ2  LYS 135           HZ2      LYS 135   3.845 -10.141   5.856
 1012    HZ3  LYS 135           HZ3      LYS 135   3.950  -9.280   7.308
 1013    H    ARG 136           HN       ARG 136   3.914 -10.812   1.514
 1014    HA   ARG 136           HA       ARG 136   2.813 -12.166   3.770
 1015    HE   ARG 136           HE       ARG 136   1.831 -15.055  -0.351
 1016    HB2  ARG 136           HB2      ARG 136   1.791 -13.609   1.773
 1017    HB3  ARG 136           HB1      ARG 136   1.169 -12.020   2.198
 1018    HG2  ARG 136           HG2      ARG 136   1.879 -11.080   0.290
 1019    HG3  ARG 136           HG1      ARG 136   3.367 -12.027   0.249
 1020    HD2  ARG 136           HD2      ARG 136   0.636 -13.126  -0.420
 1021    HD3  ARG 136           HD1      ARG 136   1.781 -12.513  -1.615
 1022   HH11  ARG 136          HH11      ARG 136   3.898 -12.538  -1.658
 1023   HH12  ARG 136          HH12      ARG 136   5.261 -13.597  -1.871
 1024   HH21  ARG 136          HH21      ARG 136   3.606 -16.460  -0.684
 1025   HH22  ARG 136          HH22      ARG 136   5.080 -15.825  -1.352
 1026    H    ARG 137           HN       ARG 137   4.645 -13.136   4.679
 1027    HA   ARG 137           HA       ARG 137   5.362 -15.687   3.475
 1028    HE   ARG 137           HE       ARG 137   9.664 -14.675   3.362
 1029    HB2  ARG 137           HB2      ARG 137   7.769 -15.284   3.723
 1030    HB3  ARG 137           HB1      ARG 137   7.050 -14.123   2.617
 1031    HG2  ARG 137           HG2      ARG 137   6.958 -12.496   4.526
 1032    HG3  ARG 137           HG1      ARG 137   7.911 -13.648   5.456
 1033    HD2  ARG 137           HD2      ARG 137   8.712 -12.329   2.880
 1034    HD3  ARG 137           HD1      ARG 137   9.359 -11.976   4.475
 1035   HH11  ARG 137          HH11      ARG 137  11.116 -11.649   4.426
 1036   HH12  ARG 137          HH12      ARG 137  12.741 -12.273   4.341
 1037   HH21  ARG 137          HH21      ARG 137  11.774 -15.478   3.278
 1038   HH22  ARG 137          HH22      ARG 137  13.110 -14.454   3.696
 1039    H    HIS 138           HN       HIS 138   5.534 -17.230   4.966
 1040    HA   HIS 138           HA       HIS 138   6.053 -16.462   7.750
 1041    HD1  HIS 138           HD1      HIS 138   4.128 -20.122   8.782
 1042    HD2  HIS 138           HD2      HIS 138   4.119 -16.190  10.141
 1043    HE1  HIS 138           HE1      HIS 138   3.937 -20.268  11.284
 1044    HE2  HIS 138           HE2      HIS 138   3.893 -17.883  12.090
 1045    HB2  HIS 138           HB2      HIS 138   3.584 -16.804   7.349
 1046    HB3  HIS 138           HB1      HIS 138   3.948 -18.471   6.923
 1047    H    GLU 139           HN       GLU 139   8.044 -17.344   7.963
 1048    HA   GLU 139           HA       GLU 139   8.705 -19.833   6.641
 1049    HB2  GLU 139           HB2      GLU 139  10.446 -18.195   8.496
 1050    HB3  GLU 139           HB1      GLU 139  10.971 -19.428   7.360
 1051    HG2  GLU 139           HG2      GLU 139   9.842 -16.717   6.705
 1052    HG3  GLU 139           HG1      GLU 139  11.500 -17.266   6.483
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  11.879  17.253  19.603
    2    H2   GLY   1           HT2      GLY   1  11.540  16.340  20.989
    3    H3   GLY   1           HT3      GLY   1  13.144  16.720  20.592
    4    HA2  GLY   1           HA1      GLY   1  12.314  18.095  22.410
    5    HA3  GLY   1           HA2      GLY   1  12.774  19.035  20.995
    6    HA   PRO   2           HA       PRO   2   8.564  20.487  22.096
    7    HB2  PRO   2           HB2      PRO   2   8.985  23.067  21.386
    8    HB3  PRO   2           HB1      PRO   2   9.462  22.413  22.957
    9    HG2  PRO   2           HG2      PRO   2  11.132  22.918  20.527
   10    HG3  PRO   2           HG1      PRO   2  11.514  23.213  22.233
   11    HD2  PRO   2           HD2      PRO   2  12.423  21.051  20.843
   12    HD3  PRO   2           HD1      PRO   2  12.144  21.038  22.594
   13    H    LEU   3           HN       LEU   3  10.403  20.590  19.156
   14    HA   LEU   3           HA       LEU   3   7.937  21.087  17.621
   15    HG   LEU   3           HG       LEU   3   9.177  20.864  14.825
   16    HB2  LEU   3           HB2      LEU   3   9.883  22.604  17.189
   17    HB3  LEU   3           HB1      LEU   3  10.798  21.209  16.648
   18   HD11  LEU   3          HD11      LEU   3   7.199  21.815  15.839
   19   HD12  LEU   3          HD12      LEU   3   7.548  22.631  14.314
   20   HD13  LEU   3          HD13      LEU   3   7.940  23.415  15.846
   21   HD21  LEU   3          HD21      LEU   3  11.185  22.170  14.421
   22   HD22  LEU   3          HD22      LEU   3  10.351  23.635  14.945
   23   HD23  LEU   3          HD23      LEU   3   9.829  22.796  13.482
   24    H    GLY   4           HN       GLY   4   7.177  19.532  16.240
   25    HA2  GLY   4           HA2      GLY   4   7.228  17.469  15.089
   26    HA3  GLY   4           HA1      GLY   4   8.739  17.078  15.904
   27    H    SER   5           HN       SER   5   5.942  18.343  17.521
   28    HA   SER   5           HA       SER   5   5.971  16.137  19.363
   29    HG   SER   5           HG       SER   5   4.245  19.781  19.669
   30    HB2  SER   5           HB2      SER   5   4.095  17.533  20.432
   31    HB3  SER   5           HB1      SER   5   5.707  18.250  20.376
   32    H    GLU   6           HN       GLU   6   4.644  14.472  19.419
   33    HA   GLU   6           HA       GLU   6   2.537  14.293  17.409
   34    HB2  GLU   6           HB2      GLU   6   2.499  11.878  18.093
   35    HB3  GLU   6           HB1      GLU   6   4.033  12.430  17.434
   36    HG2  GLU   6           HG2      GLU   6   4.753  12.775  19.852
   37    HG3  GLU   6           HG1      GLU   6   3.335  11.817  20.282
   38    H    SER   7           HN       SER   7   0.433  14.324  17.880
   39    HA   SER   7           HA       SER   7  -0.374  14.974  20.566
   40    HG   SER   7           HG       SER   7  -2.665  16.265  20.262
   41    HB2  SER   7           HB2      SER   7  -1.318  16.107  18.552
   42    HB3  SER   7           HB1      SER   7  -2.064  14.582  18.088
   43    H    LEU   8           HN       LEU   8  -0.256  13.232  21.875
   44    HA   LEU   8           HA       LEU   8  -1.265  10.656  21.043
   45    HG   LEU   8           HG       LEU   8   1.583  11.523  22.029
   46    HB2  LEU   8           HB2      LEU   8  -0.209  11.602  23.710
   47    HB3  LEU   8           HB1      LEU   8  -0.641   9.946  23.333
   48   HD11  LEU   8          HD11      LEU   8   2.099  10.905  24.323
   49   HD12  LEU   8          HD12      LEU   8   3.052   9.944  23.191
   50   HD13  LEU   8          HD13      LEU   8   1.650   9.232  23.987
   51   HD21  LEU   8          HD21      LEU   8   0.545   9.923  20.488
   52   HD22  LEU   8          HD22      LEU   8   0.773   8.637  21.672
   53   HD23  LEU   8          HD23      LEU   8   2.174   9.422  20.943
   54    H    MET   9           HN       MET   9  -3.432  10.810  20.749
   55    HA   MET   9           HA       MET   9  -5.127  12.054  22.725
   56    HB2  MET   9           HB2      MET   9  -5.745  10.531  20.194
   57    HB3  MET   9           HB1      MET   9  -6.978  11.226  21.237
   58    HG2  MET   9           HG2      MET   9  -4.795  12.786  19.877
   59    HG3  MET   9           HG1      MET   9  -6.444  12.622  19.280
   60    HE1  MET   9           HE1      MET   9  -8.087  12.726  22.067
   61    HE2  MET   9           HE2      MET   9  -8.568  13.519  20.568
   62    HE3  MET   9           HE3      MET   9  -8.506  14.440  22.071
   63    HA   PRO  10           HA       PRO  10  -5.712   8.425  25.235
   64    HB2  PRO  10           HB2      PRO  10  -8.255   9.745  25.974
   65    HB3  PRO  10           HB1      PRO  10  -6.919   9.227  27.008
   66    HG2  PRO  10           HG2      PRO  10  -7.354  11.815  26.504
   67    HG3  PRO  10           HG1      PRO  10  -5.710  11.163  26.635
   68    HD2  PRO  10           HD2      PRO  10  -7.275  11.869  24.183
   69    HD3  PRO  10           HD1      PRO  10  -5.555  12.138  24.538
   70    H    SER  11           HN       SER  11  -8.103   9.746  23.064
   71    HA   SER  11           HA       SER  11  -9.741   7.372  23.099
   72    HG   SER  11           HG       SER  11  -9.854  10.445  20.644
   73    HB2  SER  11           HB2      SER  11 -10.881   8.695  21.163
   74    HB3  SER  11           HB1      SER  11 -11.024   9.297  22.812
   75    H    GLN  12           HN       GLN  12  -8.357   5.767  22.395
   76    HA   GLN  12           HA       GLN  12  -7.783   5.847  19.511
   77    HB2  GLN  12           HB2      GLN  12  -6.104   4.791  21.770
   78    HB3  GLN  12           HB1      GLN  12  -5.932   4.133  20.151
   79    HG2  GLN  12           HG2      GLN  12  -5.288   6.267  19.281
   80    HG3  GLN  12           HG1      GLN  12  -5.642   7.053  20.821
   81   HE21  GLN  12          HE21      GLN  12  -4.186   6.927  22.473
   82   HE22  GLN  12          HE22      GLN  12  -2.594   6.263  22.294
   83    H    VAL  13           HN       VAL  13  -9.788   4.902  19.078
   84    HA   VAL  13           HA       VAL  13 -10.472   2.410  20.403
   85    HB   VAL  13           HB       VAL  13 -12.241   4.059  20.025
   86   HG11  VAL  13          HG11      VAL  13 -11.463   5.066  17.965
   87   HG12  VAL  13          HG12      VAL  13 -13.122   4.495  17.789
   88   HG13  VAL  13          HG13      VAL  13 -11.792   3.573  17.089
   89   HG21  VAL  13          HG21      VAL  13 -12.839   1.708  20.176
   90   HG22  VAL  13          HG22      VAL  13 -12.645   1.533  18.431
   91   HG23  VAL  13          HG23      VAL  13 -13.922   2.564  19.082
   92    H    VAL  14           HN       VAL  14 -10.212   0.439  19.596
   93    HA   VAL  14           HA       VAL  14  -9.426   0.176  16.774
   94    HB   VAL  14           HB       VAL  14  -8.038  -1.774  17.422
   95   HG11  VAL  14          HG11      VAL  14  -6.949   0.352  17.100
   96   HG12  VAL  14          HG12      VAL  14  -6.194  -0.482  18.462
   97   HG13  VAL  14          HG13      VAL  14  -7.329   0.839  18.749
   98   HG21  VAL  14          HG21      VAL  14  -9.123  -2.404  19.498
   99   HG22  VAL  14          HG22      VAL  14  -8.632  -0.882  20.246
  100   HG23  VAL  14          HG23      VAL  14  -7.415  -2.075  19.795
  101    H    LYS  15           HN       LYS  15 -10.502  -1.299  15.594
  102    HA   LYS  15           HA       LYS  15 -12.411  -3.027  17.017
  103    HB2  LYS  15           HB2      LYS  15 -12.649  -1.722  14.305
  104    HB3  LYS  15           HB1      LYS  15 -13.740  -2.980  14.875
  105    HG2  LYS  15           HG2      LYS  15 -14.383  -1.538  16.760
  106    HG3  LYS  15           HG1      LYS  15 -13.336  -0.269  16.126
  107    HD2  LYS  15           HD2      LYS  15 -14.653  -0.159  14.088
  108    HD3  LYS  15           HD1      LYS  15 -15.661  -1.496  14.637
  109    HE2  LYS  15           HE2      LYS  15 -16.417  -0.129  16.531
  110    HE3  LYS  15           HE1      LYS  15 -15.426   1.209  15.947
  111    HZ1  LYS  15           HZ1      LYS  15 -17.767   1.417  15.304
  112    HZ2  LYS  15           HZ2      LYS  15 -17.668  -0.038  14.437
  113    HZ3  LYS  15           HZ3      LYS  15 -16.752   1.308  13.949
  114    H    GLY  16           HN       GLY  16 -10.898  -4.710  17.207
  115    HA2  GLY  16           HA2      GLY  16  -9.620  -5.794  14.867
  116    HA3  GLY  16           HA1      GLY  16  -9.601  -6.485  16.485
  117    H    GLY  17           HN       GLY  17 -10.896  -6.696  13.364
  118    HA2  GLY  17           HA2      GLY  17 -12.214  -8.335  12.421
  119    HA3  GLY  17           HA1      GLY  17 -12.303  -9.113  13.996
  120    H    ALA  18           HN       ALA  18 -13.181  -5.785  13.658
  121    HA   ALA  18           HA       ALA  18 -16.036  -6.498  13.717
  122    HB1  ALA  18           HB1      ALA  18 -16.429  -4.696  15.300
  123    HB2  ALA  18           HB2      ALA  18 -14.708  -4.314  15.315
  124    HB3  ALA  18           HB3      ALA  18 -15.277  -5.856  15.958
  125    H    PHE  19           HN       PHE  19 -16.794  -5.864  11.808
  126    HA   PHE  19           HA       PHE  19 -15.965  -3.214  10.812
  127    HD1  PHE  19           HD1      PHE  19 -14.124  -3.205   8.462
  128    HD2  PHE  19           HD2      PHE  19 -14.966  -7.073  10.022
  129    HE1  PHE  19           HE1      PHE  19 -11.734  -3.777   8.326
  130    HE2  PHE  19           HE2      PHE  19 -12.580  -7.651   9.889
  131    HZ   PHE  19           HZ       PHE  19 -10.960  -5.998   9.040
  132    HB2  PHE  19           HB2      PHE  19 -16.734  -5.667   9.213
  133    HB3  PHE  19           HB1      PHE  19 -16.402  -4.082   8.526
  134    H    ASP  20           HN       ASP  20 -17.596  -1.901  11.379
  135    HA   ASP  20           HA       ASP  20 -20.344  -2.698  11.246
  136    HB2  ASP  20           HB2      ASP  20 -19.044   0.013  11.603
  137    HB3  ASP  20           HB1      ASP  20 -20.789  -0.235  11.605
  138    H    GLY  21           HN       GLY  21 -20.694  -3.408   9.176
  139    HA2  GLY  21           HA2      GLY  21 -20.202  -1.613   6.945
  140    HA3  GLY  21           HA1      GLY  21 -20.835  -3.250   6.853
  141    H    THR  22           HN       THR  22 -21.731  -0.031   8.038
  142    HA   THR  22           HA       THR  22 -24.536  -0.585   7.799
  143    HB   THR  22           HB       THR  22 -24.766   1.886   8.278
  144    HG1  THR  22           HG1      THR  22 -22.803   2.632   7.485
  145   HG21  THR  22          HG21      THR  22 -24.837   0.254  10.092
  146   HG22  THR  22          HG22      THR  22 -23.985   1.708  10.614
  147   HG23  THR  22          HG23      THR  22 -23.077   0.259  10.186
  148    H    MET  23           HN       MET  23 -25.142  -0.992   5.734
  149    HA   MET  23           HA       MET  23 -24.900   1.205   3.835
  150    HB2  MET  23           HB2      MET  23 -23.028  -0.340   3.358
  151    HB3  MET  23           HB1      MET  23 -24.180  -1.651   3.141
  152    HG2  MET  23           HG2      MET  23 -23.425  -0.759   1.010
  153    HG3  MET  23           HG1      MET  23 -25.156  -0.502   1.236
  154    HE1  MET  23           HE1      MET  23 -24.141   2.676  -0.793
  155    HE2  MET  23           HE2      MET  23 -25.254   1.313  -0.676
  156    HE3  MET  23           HE3      MET  23 -23.543   1.028  -0.996
  157    H    ASN  24           HN       ASN  24 -26.660   1.478   2.594
  158    HA   ASN  24           HA       ASN  24 -28.849  -0.456   2.939
  159    HB2  ASN  24           HB2      ASN  24 -29.279   1.804   3.864
  160    HB3  ASN  24           HB1      ASN  24 -29.014   2.496   2.268
  161   HD21  ASN  24          HD21      ASN  24 -31.133   0.548   4.237
  162   HD22  ASN  24          HD22      ASN  24 -32.517   0.686   3.203
  163    H    GLY  25           HN       GLY  25 -30.342  -0.594   1.042
  164    HA2  GLY  25           HA2      GLY  25 -30.512  -0.207  -1.390
  165    HA3  GLY  25           HA1      GLY  25 -28.775  -0.452  -1.455
  166    HA   PRO  26           HA       PRO  26 -29.863  -4.921  -1.450
  167    HB2  PRO  26           HB2      PRO  26 -28.898  -5.813   1.122
  168    HB3  PRO  26           HB1      PRO  26 -28.168  -6.052  -0.467
  169    HG2  PRO  26           HG2      PRO  26 -27.075  -4.484   1.485
  170    HG3  PRO  26           HG1      PRO  26 -26.801  -4.231  -0.247
  171    HD2  PRO  26           HD2      PRO  26 -28.690  -2.813   1.598
  172    HD3  PRO  26           HD1      PRO  26 -27.651  -2.147   0.319
  173    H    PHE  27           HN       PHE  27 -31.500  -2.915   0.240
  174    HA   PHE  27           HA       PHE  27 -32.974  -4.729   1.968
  175    HD1  PHE  27           HD2      PHE  27 -33.982  -4.018   4.326
  176    HD2  PHE  27           HD1      PHE  27 -35.485  -1.169   1.545
  177    HE1  PHE  27           HE2      PHE  27 -36.136  -4.007   5.508
  178    HE2  PHE  27           HE1      PHE  27 -37.641  -1.148   2.728
  179    HZ   PHE  27           HZ       PHE  27 -37.967  -2.571   4.714
  180    HB2  PHE  27           HB2      PHE  27 -32.489  -2.528   2.870
  181    HB3  PHE  27           HB1      PHE  27 -33.240  -1.750   1.482
  182    H    GLY  28           HN       GLY  28 -34.478  -5.937   1.073
  183    HA2  GLY  28           HA2      GLY  28 -36.708  -4.948  -0.275
  184    HA3  GLY  28           HA1      GLY  28 -35.565  -5.505  -1.493
  185    H    HIS  29           HN       HIS  29 -37.698  -6.890  -1.706
  186    HA   HIS  29           HA       HIS  29 -37.500  -9.204   0.087
  187    HD1  HIS  29           HD1      HIS  29 -39.871  -6.243  -1.781
  188    HD2  HIS  29           HD2      HIS  29 -40.637 -10.020  -3.350
  189    HE1  HIS  29           HE1      HIS  29 -41.041  -5.843  -3.966
  190    HE2  HIS  29           HE2      HIS  29 -41.679  -8.139  -4.792
  191    HB2  HIS  29           HB2      HIS  29 -39.705  -9.887  -0.784
  192    HB3  HIS  29           HB1      HIS  29 -39.746  -8.289  -0.060
  193    H    GLY  30           HN       GLY  30 -36.574 -10.999  -0.583
  194    HA2  GLY  30           HA2      GLY  30 -36.594 -12.139  -3.103
  195    HA3  GLY  30           HA1      GLY  30 -35.232 -11.025  -3.086
  196    H    TYR  31           HN       TYR  31 -34.171 -13.251  -3.445
  197    HA   TYR  31           HA       TYR  31 -33.982 -15.007  -1.192
  198    HD1  TYR  31           HD1      TYR  31 -34.483 -17.339  -2.212
  199    HD2  TYR  31           HD2      TYR  31 -33.354 -14.956  -5.552
  200    HE1  TYR  31           HE1      TYR  31 -36.129 -18.520  -3.611
  201    HE2  TYR  31           HE2      TYR  31 -34.990 -16.133  -6.954
  202    HH   TYR  31           HH       TYR  31 -36.089 -18.445  -6.921
  203    HB2  TYR  31           HB2      TYR  31 -32.155 -14.765  -3.592
  204    HB3  TYR  31           HB1      TYR  31 -32.169 -16.098  -2.446
  205    H    GLY  32           HN       GLY  32 -32.730 -14.824   0.549
  206    HA2  GLY  32           HA2      GLY  32 -31.006 -12.566   0.902
  207    HA3  GLY  32           HA1      GLY  32 -31.256 -13.875   2.050
  208    H    GLU  33           HN       GLU  33 -28.767 -12.652   1.485
  209    HA   GLU  33           HA       GLU  33 -27.256 -14.191  -0.368
  210    HB2  GLU  33           HB2      GLU  33 -26.092 -12.714   1.984
  211    HB3  GLU  33           HB1      GLU  33 -25.355 -13.041   0.425
  212    HG2  GLU  33           HG2      GLU  33 -25.871 -10.885   0.053
  213    HG3  GLU  33           HG1      GLU  33 -27.433 -11.571  -0.389
  214    H    GLY  34           HN       GLY  34 -26.201 -16.052  -0.141
  215    HA2  GLY  34           HA2      GLY  34 -26.470 -17.635   2.229
  216    HA3  GLY  34           HA1      GLY  34 -25.537 -18.052   0.796
  217    H    ALA  35           HN       ALA  35 -24.931 -18.160   3.766
  218    HA   ALA  35           HA       ALA  35 -23.244 -16.191   4.671
  219    HB1  ALA  35           HB1      ALA  35 -22.249 -17.843   6.139
  220    HB2  ALA  35           HB2      ALA  35 -22.890 -19.147   5.140
  221    HB3  ALA  35           HB3      ALA  35 -23.991 -18.089   6.026
  222    H    GLY  36           HN       GLY  36 -21.301 -15.441   4.181
  223    HA2  GLY  36           HA2      GLY  36 -19.648 -16.985   2.296
  224    HA3  GLY  36           HA1      GLY  36 -19.751 -15.228   2.285
  225    H    GLU  37           HN       GLU  37 -17.543 -17.251   2.724
  226    HA   GLU  37           HA       GLU  37 -16.704 -16.689   5.429
  227    HB2  GLU  37           HB2      GLU  37 -16.350 -18.900   4.439
  228    HB3  GLU  37           HB1      GLU  37 -15.339 -18.185   3.194
  229    HG2  GLU  37           HG2      GLU  37 -14.059 -19.303   4.975
  230    HG3  GLU  37           HG1      GLU  37 -13.666 -17.594   4.799
  231    H    GLY  38           HN       GLY  38 -14.685 -15.671   5.959
  232    HA2  GLY  38           HA2      GLY  38 -14.277 -13.291   4.389
  233    HA3  GLY  38           HA1      GLY  38 -13.439 -13.711   5.876
  234    H    ILE  39           HN       ILE  39 -13.694 -14.735   2.524
  235    HA   ILE  39           HA       ILE  39 -11.096 -15.751   2.259
  236    HB   ILE  39           HB       ILE  39 -11.427 -15.220  -0.202
  237   HG12  ILE  39          HG12      ILE  39 -14.002 -14.105   0.918
  238   HG13  ILE  39          HG11      ILE  39 -12.854 -13.318  -0.155
  239   HG21  ILE  39          HG21      ILE  39 -12.015 -17.375   0.808
  240   HG22  ILE  39          HG22      ILE  39 -13.122 -16.944  -0.497
  241   HG23  ILE  39          HG23      ILE  39 -13.623 -16.755   1.183
  242   HD11  ILE  39          HD11      ILE  39 -13.504 -14.861  -1.940
  243   HD12  ILE  39          HD12      ILE  39 -14.869 -13.924  -1.333
  244   HD13  ILE  39          HD13      ILE  39 -14.671 -15.607  -0.847
  245    H    ASP  40           HN       ASP  40  -9.251 -14.716   1.192
  246    HA   ASP  40           HA       ASP  40  -8.818 -12.214   2.509
  247    HB2  ASP  40           HB2      ASP  40  -6.484 -12.421   1.625
  248    HB3  ASP  40           HB1      ASP  40  -7.025 -13.794   2.581
  249    H    ASP  41           HN       ASP  41 -10.443 -11.045   1.352
  250    HA   ASP  41           HA       ASP  41 -10.159 -10.292  -1.364
  251    HB2  ASP  41           HB2      ASP  41 -12.223  -9.912  -0.085
  252    HB3  ASP  41           HB1      ASP  41 -11.382  -8.752   0.937
  253    H    VAL  42           HN       VAL  42  -8.324  -9.493  -2.119
  254    HA   VAL  42           HA       VAL  42  -6.946  -7.421  -0.559
  255    HB   VAL  42           HB       VAL  42  -5.595  -9.401  -0.581
  256   HG11  VAL  42          HG11      VAL  42  -6.547 -10.563  -2.483
  257   HG12  VAL  42          HG12      VAL  42  -4.795 -10.447  -2.653
  258   HG13  VAL  42          HG13      VAL  42  -5.843  -9.377  -3.585
  259   HG21  VAL  42          HG21      VAL  42  -3.554  -8.588  -1.662
  260   HG22  VAL  42          HG22      VAL  42  -4.393  -7.284  -0.822
  261   HG23  VAL  42          HG23      VAL  42  -4.502  -7.416  -2.577
  262    H    GLU  43           HN       GLU  43  -7.339  -5.522  -1.430
  263    HA   GLU  43           HA       GLU  43  -6.484  -5.106  -4.174
  264    HB2  GLU  43           HB2      GLU  43  -8.913  -5.392  -4.388
  265    HB3  GLU  43           HB1      GLU  43  -9.176  -4.135  -3.187
  266    HG2  GLU  43           HG2      GLU  43  -8.117  -2.495  -4.662
  267    HG3  GLU  43           HG1      GLU  43  -7.864  -3.751  -5.873
  268    H    TRP  44           HN       TRP  44  -4.863  -3.775  -3.827
  269    HA   TRP  44           HA       TRP  44  -5.317  -1.425  -2.121
  270    HD1  TRP  44           HD1      TRP  44  -3.740   0.613  -1.678
  271    HE1  TRP  44           HE1      TRP  44  -1.548   1.894  -1.218
  272    HE3  TRP  44           HE3      TRP  44  -0.550  -3.277  -1.669
  273    HZ2  TRP  44           HZ2      TRP  44   1.219   1.255  -0.893
  274    HZ3  TRP  44           HZ3      TRP  44   1.841  -2.914  -1.322
  275    HH2  TRP  44           HH2      TRP  44   2.709  -0.688  -0.920
  276    HB2  TRP  44           HB2      TRP  44  -3.617  -2.756  -1.097
  277    HB3  TRP  44           HB1      TRP  44  -2.794  -3.004  -2.634
  278    H    VAL  45           HN       VAL  45  -4.833   0.493  -2.870
  279    HA   VAL  45           HA       VAL  45  -5.222   1.103  -5.529
  280    HB   VAL  45           HB       VAL  45  -3.812   2.839  -3.504
  281   HG11  VAL  45          HG11      VAL  45  -3.757   3.766  -5.738
  282   HG12  VAL  45          HG12      VAL  45  -4.858   4.694  -4.720
  283   HG13  VAL  45          HG13      VAL  45  -5.501   3.546  -5.894
  284   HG21  VAL  45          HG21      VAL  45  -6.098   3.670  -2.948
  285   HG22  VAL  45          HG22      VAL  45  -5.795   2.009  -2.448
  286   HG23  VAL  45          HG23      VAL  45  -6.758   2.333  -3.889
  287    H    VAL  46           HN       VAL  46  -2.191   0.282  -3.957
  288    HA   VAL  46           HA       VAL  46  -0.499   1.750  -5.675
  289    HB   VAL  46           HB       VAL  46  -0.057   0.101  -3.424
  290   HG11  VAL  46          HG11      VAL  46   1.528  -0.950  -5.750
  291   HG12  VAL  46          HG12      VAL  46   0.289  -1.829  -4.854
  292   HG13  VAL  46          HG13      VAL  46   1.778  -1.330  -4.047
  293   HG21  VAL  46          HG21      VAL  46   1.930   1.510  -5.220
  294   HG22  VAL  46          HG22      VAL  46   2.218   1.012  -3.552
  295   HG23  VAL  46          HG23      VAL  46   1.010   2.247  -3.907
  296    H    GLY  47           HN       GLY  47  -2.347  -0.997  -6.332
  297    HA2  GLY  47           HA2      GLY  47  -0.717  -2.153  -8.360
  298    HA3  GLY  47           HA1      GLY  47  -2.470  -2.327  -8.212
  299    H    LYS  48           HN       LYS  48  -2.053   0.897  -8.202
  300    HA   LYS  48           HA       LYS  48  -2.480   1.058 -11.104
  301    HB2  LYS  48           HB2      LYS  48  -3.785   2.972 -10.720
  302    HB3  LYS  48           HB1      LYS  48  -4.257   1.855  -9.464
  303    HG2  LYS  48           HG2      LYS  48  -2.994   3.076  -7.843
  304    HG3  LYS  48           HG1      LYS  48  -2.283   4.101  -9.093
  305    HD2  LYS  48           HD2      LYS  48  -5.211   3.976  -8.366
  306    HD3  LYS  48           HD1      LYS  48  -4.087   5.251  -7.892
  307    HE2  LYS  48           HE2      LYS  48  -4.896   4.532 -10.711
  308    HE3  LYS  48           HE1      LYS  48  -5.421   5.947  -9.797
  309    HZ1  LYS  48           HZ1      LYS  48  -3.251   6.847  -9.848
  310    HZ2  LYS  48           HZ2      LYS  48  -3.577   6.326 -11.432
  311    HZ3  LYS  48           HZ3      LYS  48  -2.578   5.403 -10.425
  312    H    ASP  49           HN       ASP  49  -0.431   2.194  -8.523
  313    HA   ASP  49           HA       ASP  49   0.911   4.001 -10.412
  314    HB2  ASP  49           HB2      ASP  49   1.727   5.222  -8.345
  315    HB3  ASP  49           HB1      ASP  49   0.010   5.355  -8.691
  316    H    LYS  50           HN       LYS  50   1.216   1.084  -9.119
  317    HA   LYS  50           HA       LYS  50   3.782   0.801  -8.164
  318    HB2  LYS  50           HB2      LYS  50   2.089  -0.972  -8.113
  319    HB3  LYS  50           HB1      LYS  50   2.206  -1.139  -9.859
  320    HG2  LYS  50           HG2      LYS  50   4.621  -1.726  -9.545
  321    HG3  LYS  50           HG1      LYS  50   4.308  -1.769  -7.809
  322    HD2  LYS  50           HD2      LYS  50   2.609  -3.495  -8.174
  323    HD3  LYS  50           HD1      LYS  50   2.943  -3.452  -9.909
  324    HE2  LYS  50           HE2      LYS  50   4.812  -4.288  -7.701
  325    HE3  LYS  50           HE1      LYS  50   4.113  -5.306  -8.957
  326    HZ1  LYS  50           HZ1      LYS  50   5.988  -3.061  -9.469
  327    HZ2  LYS  50           HZ2      LYS  50   5.406  -4.170 -10.610
  328    HZ3  LYS  50           HZ3      LYS  50   6.441  -4.686  -9.369
  329    HA   PRO  51           HA       PRO  51   4.987  -0.114 -12.951
  330    HB2  PRO  51           HB2      PRO  51   3.884   2.091 -14.350
  331    HB3  PRO  51           HB1      PRO  51   3.466   0.382 -14.541
  332    HG2  PRO  51           HG2      PRO  51   2.120   2.500 -12.942
  333    HG3  PRO  51           HG1      PRO  51   1.415   1.118 -13.802
  334    HD2  PRO  51           HD2      PRO  51   1.626   1.097 -11.147
  335    HD3  PRO  51           HD1      PRO  51   1.965  -0.376 -12.091
  336    H    THR  52           HN       THR  52   4.396   3.057 -11.504
  337    HA   THR  52           HA       THR  52   6.685   4.286 -12.717
  338    HB   THR  52           HB       THR  52   4.977   5.227 -10.401
  339    HG1  THR  52           HG1      THR  52   4.780   5.504 -13.224
  340   HG21  THR  52          HG21      THR  52   7.096   6.414 -10.477
  341   HG22  THR  52          HG22      THR  52   5.802   7.472 -11.038
  342   HG23  THR  52          HG23      THR  52   6.890   6.720 -12.203
  343    H    TYR  53           HN       TYR  53   5.962   2.758  -9.630
  344    HA   TYR  53           HA       TYR  53   8.452   3.633  -8.449
  345    HD1  TYR  53           HD2      TYR  53   7.146   5.146  -7.689
  346    HD2  TYR  53           HD1      TYR  53   4.574   2.060  -6.323
  347    HE1  TYR  53           HE2      TYR  53   5.415   6.820  -7.227
  348    HE2  TYR  53           HE1      TYR  53   2.829   3.720  -5.856
  349    HH   TYR  53           HH       TYR  53   2.269   5.849  -5.890
  350    HB2  TYR  53           HB2      TYR  53   6.565   1.512  -7.472
  351    HB3  TYR  53           HB1      TYR  53   7.725   2.424  -6.519
  352    H    ASP  54           HN       ASP  54   7.206   0.933 -10.172
  353    HA   ASP  54           HA       ASP  54   9.362  -0.876  -9.600
  354    HB2  ASP  54           HB2      ASP  54   7.300  -1.848 -10.311
  355    HB3  ASP  54           HB1      ASP  54   7.142  -0.739 -11.662
  356    H    GLU  55           HN       GLU  55   8.638   1.470 -12.172
  357    HA   GLU  55           HA       GLU  55  10.905   0.817 -13.748
  358    HB2  GLU  55           HB2      GLU  55  10.487   2.907 -14.946
  359    HB3  GLU  55           HB1      GLU  55   9.017   1.975 -14.738
  360    HG2  GLU  55           HG2      GLU  55   8.040   3.760 -13.932
  361    HG3  GLU  55           HG1      GLU  55   9.130   3.704 -12.543
  362    H    ILE  56           HN       ILE  56  10.372   3.208 -11.171
  363    HA   ILE  56           HA       ILE  56  13.024   4.253 -11.352
  364    HB   ILE  56           HB       ILE  56  11.190   4.268  -8.940
  365   HG12  ILE  56          HG12      ILE  56  11.586   6.493 -10.933
  366   HG13  ILE  56          HG11      ILE  56  10.309   5.289 -11.124
  367   HG21  ILE  56          HG21      ILE  56  13.548   6.019  -9.645
  368   HG22  ILE  56          HG22      ILE  56  13.530   4.769  -8.402
  369   HG23  ILE  56          HG23      ILE  56  12.517   6.201  -8.226
  370   HD11  ILE  56          HD11      ILE  56  10.637   7.106  -8.750
  371   HD12  ILE  56          HD12      ILE  56   9.323   5.962  -9.035
  372   HD13  ILE  56          HD13      ILE  56   9.519   7.358 -10.094
  373    H    PHE  57           HN       PHE  57  11.527   1.542  -9.790
  374    HA   PHE  57           HA       PHE  57  13.488   0.776  -7.977
  375    HD1  PHE  57           HD2      PHE  57  13.119  -1.082  -6.253
  376    HD2  PHE  57           HD1      PHE  57  12.191  -3.047  -9.909
  377    HE1  PHE  57           HE2      PHE  57  13.982  -3.197  -5.336
  378    HE2  PHE  57           HE1      PHE  57  13.044  -5.164  -8.999
  379    HZ   PHE  57           HZ       PHE  57  13.939  -5.241  -6.706
  380    HB2  PHE  57           HB2      PHE  57  11.327  -0.268  -7.998
  381    HB3  PHE  57           HB1      PHE  57  11.571  -0.867  -9.631
  382    H    TYR  58           HN       TYR  58  13.103  -0.337 -11.360
  383    HA   TYR  58           HA       TYR  58  15.632  -1.672 -11.368
  384    HD1  TYR  58           HD1      TYR  58  11.959  -1.908 -12.252
  385    HD2  TYR  58           HD2      TYR  58  15.396  -4.077 -13.513
  386    HE1  TYR  58           HE1      TYR  58  10.783  -4.017 -11.834
  387    HE2  TYR  58           HE2      TYR  58  14.214  -6.195 -13.100
  388    HH   TYR  58           HH       TYR  58  10.826  -6.305 -12.492
  389    HB2  TYR  58           HB2      TYR  58  13.765  -0.841 -13.595
  390    HB3  TYR  58           HB1      TYR  58  15.272  -1.720 -13.882
  391    H    THR  59           HN       THR  59  14.602   1.555 -11.914
  392    HA   THR  59           HA       THR  59  16.881   2.466 -13.350
  393    HB   THR  59           HB       THR  59  14.694   3.841 -11.792
  394    HG1  THR  59           HG1      THR  59  13.826   3.381 -13.671
  395   HG21  THR  59          HG21      THR  59  15.491   5.964 -12.769
  396   HG22  THR  59          HG22      THR  59  16.963   5.140 -13.288
  397   HG23  THR  59          HG23      THR  59  16.592   5.296 -11.568
  398    H    LEU  60           HN       LEU  60  16.102   2.047  -9.965
  399    HA   LEU  60           HA       LEU  60  18.446   3.465  -9.046
  400    HG   LEU  60           HG       LEU  60  15.403   3.915  -8.229
  401    HB2  LEU  60           HB2      LEU  60  16.360   1.825  -7.612
  402    HB3  LEU  60           HB1      LEU  60  17.697   2.613  -6.793
  403   HD11  LEU  60          HD11      LEU  60  15.061   3.109  -5.910
  404   HD12  LEU  60          HD12      LEU  60  14.908   4.857  -6.078
  405   HD13  LEU  60          HD13      LEU  60  16.375   4.161  -5.387
  406   HD21  LEU  60          HD21      LEU  60  16.457   6.062  -7.706
  407   HD22  LEU  60          HD22      LEU  60  17.454   5.106  -8.801
  408   HD23  LEU  60          HD23      LEU  60  17.876   5.217  -7.094
  409    H    SER  61           HN       SER  61  18.048   0.614 -10.501
  410    HA   SER  61           HA       SER  61  19.340  -1.207 -10.836
  411    HG   SER  61           HG       SER  61  22.226  -1.779  -9.387
  412    HB2  SER  61           HB2      SER  61  21.217   0.429 -10.748
  413    HB3  SER  61           HB1      SER  61  21.354   0.134  -9.016
  414    HA   PRO  62           HA       PRO  62  18.143  -3.206  -6.931
  415    HB2  PRO  62           HB2      PRO  62  16.471  -5.020  -8.005
  416    HB3  PRO  62           HB1      PRO  62  15.969  -3.363  -7.648
  417    HG2  PRO  62           HG2      PRO  62  16.584  -4.638 -10.254
  418    HG3  PRO  62           HG1      PRO  62  15.472  -3.310  -9.879
  419    HD2  PRO  62           HD2      PRO  62  18.065  -3.077 -10.965
  420    HD3  PRO  62           HD1      PRO  62  17.049  -1.764 -10.333
  421    H    VAL  63           HN       VAL  63  18.553  -5.320  -6.129
  422    HA   VAL  63           HA       VAL  63  19.941  -7.168  -7.904
  423    HB   VAL  63           HB       VAL  63  21.744  -5.896  -6.962
  424   HG11  VAL  63          HG11      VAL  63  20.602  -6.574  -4.259
  425   HG12  VAL  63          HG12      VAL  63  20.693  -4.976  -4.998
  426   HG13  VAL  63          HG13      VAL  63  22.172  -5.819  -4.538
  427   HG21  VAL  63          HG21      VAL  63  23.024  -7.674  -5.877
  428   HG22  VAL  63          HG22      VAL  63  22.117  -8.278  -7.263
  429   HG23  VAL  63          HG23      VAL  63  21.535  -8.584  -5.626
  430    H    ASN  64           HN       ASN  64  19.501  -9.224  -7.494
  431    HA   ASN  64           HA       ASN  64  18.505 -11.073  -6.635
  432    HB2  ASN  64           HB2      ASN  64  18.760  -9.627  -3.976
  433    HB3  ASN  64           HB1      ASN  64  18.368 -11.340  -4.182
  434   HD21  ASN  64          HD21      ASN  64  20.617  -9.946  -2.856
  435   HD22  ASN  64          HD22      ASN  64  22.043 -10.632  -3.558
  436    H    GLY  65           HN       GLY  65  17.093  -8.493  -7.328
  437    HA2  GLY  65           HA2      GLY  65  14.815  -8.408  -7.929
  438    HA3  GLY  65           HA1      GLY  65  14.456  -9.543  -6.640
  439    H    LYS  66           HN       LYS  66  16.424  -7.279  -5.222
  440    HA   LYS  66           HA       LYS  66  14.219  -5.400  -4.733
  441    HB2  LYS  66           HB2      LYS  66  16.014  -6.026  -2.452
  442    HB3  LYS  66           HB1      LYS  66  14.347  -5.478  -2.446
  443    HG2  LYS  66           HG2      LYS  66  14.231  -7.638  -1.618
  444    HG3  LYS  66           HG1      LYS  66  13.783  -7.825  -3.317
  445    HD2  LYS  66           HD2      LYS  66  15.794  -8.794  -3.881
  446    HD3  LYS  66           HD1      LYS  66  16.639  -8.068  -2.520
  447    HE2  LYS  66           HE2      LYS  66  16.452 -10.374  -2.052
  448    HE3  LYS  66           HE1      LYS  66  15.270  -9.570  -1.029
  449    HZ1  LYS  66           HZ1      LYS  66  14.591 -10.804  -3.642
  450    HZ2  LYS  66           HZ2      LYS  66  13.518 -10.227  -2.460
  451    HZ3  LYS  66           HZ3      LYS  66  14.446 -11.613  -2.161
  452    H    ILE  67           HN       ILE  67  14.952  -3.311  -3.825
  453    HA   ILE  67           HA       ILE  67  17.661  -2.647  -4.699
  454    HB   ILE  67           HB       ILE  67  16.982  -0.312  -3.727
  455   HG12  ILE  67          HG12      ILE  67  14.295  -1.650  -4.086
  456   HG13  ILE  67          HG11      ILE  67  14.957  -0.974  -2.600
  457   HG21  ILE  67          HG21      ILE  67  17.387  -0.773  -6.079
  458   HG22  ILE  67          HG22      ILE  67  15.988   0.284  -5.893
  459   HG23  ILE  67          HG23      ILE  67  15.758  -1.427  -6.261
  460   HD11  ILE  67          HD11      ILE  67  13.294   0.492  -3.559
  461   HD12  ILE  67          HD12      ILE  67  14.195   0.563  -5.072
  462   HD13  ILE  67          HD13      ILE  67  14.885   1.253  -3.601
  463    H    THR  68           HN       THR  68  19.343  -2.393  -3.386
  464    HA   THR  68           HA       THR  68  19.272  -3.030  -0.667
  465    HB   THR  68           HB       THR  68  21.453  -1.513  -0.705
  466    HG1  THR  68           HG1      THR  68  22.232  -1.176  -2.744
  467   HG21  THR  68          HG21      THR  68  22.720  -3.443  -1.572
  468   HG22  THR  68          HG22      THR  68  21.218  -4.144  -2.179
  469   HG23  THR  68          HG23      THR  68  21.460  -3.941  -0.443
  470    H    GLY  69           HN       GLY  69  18.744  -1.876   1.079
  471    HA2  GLY  69           HA2      GLY  69  16.811   0.005   0.757
  472    HA3  GLY  69           HA1      GLY  69  17.657  -0.272   2.266
  473    H    ALA  70           HN       ALA  70  20.233   0.653   1.185
  474    HA   ALA  70           HA       ALA  70  20.233   3.315   1.885
  475    HB1  ALA  70           HB1      ALA  70  22.385   3.496   0.781
  476    HB2  ALA  70           HB2      ALA  70  22.069   2.011  -0.120
  477    HB3  ALA  70           HB3      ALA  70  22.252   1.957   1.633
  478    H    ASN  71           HN       ASN  71  19.432   1.942  -1.252
  479    HA   ASN  71           HA       ASN  71  19.613   4.451  -2.660
  480    HB2  ASN  71           HB2      ASN  71  18.069   2.120  -3.734
  481    HB3  ASN  71           HB1      ASN  71  19.094   3.268  -4.589
  482   HD21  ASN  71          HD21      ASN  71  18.977   0.307  -4.478
  483   HD22  ASN  71          HD22      ASN  71  20.571  -0.205  -4.063
  484    H    ALA  72           HN       ALA  72  17.095   2.452  -1.251
  485    HA   ALA  72           HA       ALA  72  14.920   4.035  -2.227
  486    HB1  ALA  72           HB1      ALA  72  13.583   2.741  -0.614
  487    HB2  ALA  72           HB2      ALA  72  15.070   2.030   0.018
  488    HB3  ALA  72           HB3      ALA  72  14.577   1.713  -1.646
  489    H    LYS  73           HN       LYS  73  16.930   3.918   0.613
  490    HA   LYS  73           HA       LYS  73  15.569   5.868   2.162
  491    HB2  LYS  73           HB2      LYS  73  18.508   5.123   2.124
  492    HB3  LYS  73           HB1      LYS  73  17.754   6.149   3.336
  493    HG2  LYS  73           HG2      LYS  73  17.168   3.243   2.821
  494    HG3  LYS  73           HG1      LYS  73  18.019   3.923   4.209
  495    HD2  LYS  73           HD2      LYS  73  15.199   4.689   3.515
  496    HD3  LYS  73           HD1      LYS  73  15.577   3.300   4.536
  497    HE2  LYS  73           HE2      LYS  73  16.575   6.088   5.109
  498    HE3  LYS  73           HE1      LYS  73  15.047   5.465   5.745
  499    HZ1  LYS  73           HZ1      LYS  73  17.004   5.280   7.261
  500    HZ2  LYS  73           HZ2      LYS  73  17.661   4.130   6.198
  501    HZ3  LYS  73           HZ3      LYS  73  16.192   3.823   6.980
  502    H    LYS  74           HN       LYS  74  18.037   5.960  -0.307
  503    HA   LYS  74           HA       LYS  74  18.719   8.653  -0.311
  504    HB2  LYS  74           HB2      LYS  74  19.639   6.669  -1.705
  505    HB3  LYS  74           HB1      LYS  74  18.354   7.063  -2.840
  506    HG2  LYS  74           HG2      LYS  74  20.328   8.131  -3.587
  507    HG3  LYS  74           HG1      LYS  74  19.262   9.381  -2.936
  508    HD2  LYS  74           HD2      LYS  74  21.505   9.759  -2.168
  509    HD3  LYS  74           HD1      LYS  74  20.499   9.287  -0.808
  510    HE2  LYS  74           HE2      LYS  74  22.674   8.160  -0.728
  511    HE3  LYS  74           HE1      LYS  74  21.356   7.006  -0.947
  512    HZ1  LYS  74           HZ1      LYS  74  21.882   6.803  -3.249
  513    HZ2  LYS  74           HZ2      LYS  74  23.318   6.593  -2.382
  514    HZ3  LYS  74           HZ3      LYS  74  23.015   8.064  -3.177
  515    H    GLU  75           HN       GLU  75  16.125   6.963  -1.983
  516    HA   GLU  75           HA       GLU  75  15.010   9.201  -3.276
  517    HB2  GLU  75           HB2      GLU  75  13.605   6.669  -2.412
  518    HB3  GLU  75           HB1      GLU  75  12.975   7.835  -3.562
  519    HG2  GLU  75           HG2      GLU  75  15.230   5.895  -3.892
  520    HG3  GLU  75           HG1      GLU  75  13.806   6.141  -4.888
  521    H    MET  76           HN       MET  76  13.964   7.643  -0.244
  522    HA   MET  76           HA       MET  76  11.976   9.597   0.259
  523    HB2  MET  76           HB2      MET  76  12.077   8.661   2.636
  524    HB3  MET  76           HB1      MET  76  11.655   7.543   1.347
  525    HG2  MET  76           HG2      MET  76  13.926   6.696   1.319
  526    HG3  MET  76           HG1      MET  76  14.376   7.832   2.585
  527    HE1  MET  76           HE1      MET  76  11.085   5.524   2.208
  528    HE2  MET  76           HE2      MET  76  11.703   4.107   3.055
  529    HE3  MET  76           HE3      MET  76  12.485   4.660   1.572
  530    H    VAL  77           HN       VAL  77  15.387   9.545   0.787
  531    HA   VAL  77           HA       VAL  77  15.548  11.730   2.588
  532    HB   VAL  77           HB       VAL  77  17.492  10.487   0.663
  533   HG11  VAL  77          HG11      VAL  77  17.986  13.003   2.255
  534   HG12  VAL  77          HG12      VAL  77  17.929  12.875   0.497
  535   HG13  VAL  77          HG13      VAL  77  19.217  12.073   1.398
  536   HG21  VAL  77          HG21      VAL  77  17.498  10.912   3.653
  537   HG22  VAL  77          HG22      VAL  77  18.762  10.094   2.735
  538   HG23  VAL  77          HG23      VAL  77  17.140   9.403   2.812
  539    H    LYS  78           HN       LYS  78  15.553  11.572  -1.013
  540    HA   LYS  78           HA       LYS  78  16.040  14.362  -1.292
  541    HB2  LYS  78           HB2      LYS  78  15.681  14.072  -3.601
  542    HB3  LYS  78           HB1      LYS  78  16.538  12.644  -3.027
  543    HG2  LYS  78           HG2      LYS  78  14.491  11.388  -2.993
  544    HG3  LYS  78           HG1      LYS  78  13.580  12.825  -3.463
  545    HD2  LYS  78           HD2      LYS  78  13.841  11.868  -5.464
  546    HD3  LYS  78           HD1      LYS  78  15.297  12.849  -5.424
  547    HE2  LYS  78           HE2      LYS  78  15.061   9.922  -4.797
  548    HE3  LYS  78           HE1      LYS  78  15.789  10.647  -6.211
  549    HZ1  LYS  78           HZ1      LYS  78  17.364   9.858  -4.500
  550    HZ2  LYS  78           HZ2      LYS  78  16.815  11.098  -3.490
  551    HZ3  LYS  78           HZ3      LYS  78  17.566  11.473  -4.964
  552    H    SER  79           HN       SER  79  13.314  12.469  -0.584
  553    HA   SER  79           HA       SER  79  11.232  14.121  -1.502
  554    HG   SER  79           HG       SER  79   9.490  13.945   0.350
  555    HB2  SER  79           HB2      SER  79  10.849  11.822  -0.780
  556    HB3  SER  79           HB1      SER  79  11.311  12.241   0.874
  557    H    LYS  80           HN       LYS  80  13.577  14.770   0.810
  558    HA   LYS  80           HA       LYS  80  13.942  16.583   2.130
  559    HB2  LYS  80           HB2      LYS  80  11.330  17.607   1.002
  560    HB3  LYS  80           HB1      LYS  80  12.518  18.564   1.889
  561    HG2  LYS  80           HG2      LYS  80  14.047  18.503   0.139
  562    HG3  LYS  80           HG1      LYS  80  13.264  17.123  -0.629
  563    HD2  LYS  80           HD2      LYS  80  11.310  18.566  -1.114
  564    HD3  LYS  80           HD1      LYS  80  12.203  19.937  -0.453
  565    HE2  LYS  80           HE2      LYS  80  13.878  19.756  -2.147
  566    HE3  LYS  80           HE1      LYS  80  13.199  18.235  -2.728
  567    HZ1  LYS  80           HZ1      LYS  80  12.576  20.074  -4.151
  568    HZ2  LYS  80           HZ2      LYS  80  11.861  20.884  -2.843
  569    HZ3  LYS  80           HZ3      LYS  80  11.209  19.418  -3.397
  570    H    LEU  81           HN       LEU  81  13.477  14.819   3.709
  571    HA   LEU  81           HA       LEU  81  11.186  15.554   5.410
  572    HG   LEU  81           HG       LEU  81  11.205  13.463   2.955
  573    HB2  LEU  81           HB2      LEU  81  12.270  12.758   5.117
  574    HB3  LEU  81           HB1      LEU  81  10.810  13.258   5.940
  575   HD11  LEU  81          HD11      LEU  81   9.753  11.347   4.533
  576   HD12  LEU  81          HD12      LEU  81  11.286  11.136   3.688
  577   HD13  LEU  81          HD13      LEU  81   9.816  11.478   2.775
  578   HD21  LEU  81          HD21      LEU  81   8.742  13.692   4.683
  579   HD22  LEU  81          HD22      LEU  81   8.766  13.719   2.921
  580   HD23  LEU  81          HD23      LEU  81   9.549  15.010   3.833
  581    HA   PRO  82           HA       PRO  82  14.199  15.359   8.745
  582    HB2  PRO  82           HB2      PRO  82  12.530  14.771  10.803
  583    HB3  PRO  82           HB1      PRO  82  12.658  16.395  10.108
  584    HG2  PRO  82           HG2      PRO  82  10.583  14.295   9.658
  585    HG3  PRO  82           HG1      PRO  82  10.396  16.047   9.808
  586    HD2  PRO  82           HD2      PRO  82  10.383  14.707   7.438
  587    HD3  PRO  82           HD1      PRO  82  10.869  16.410   7.610
  588    H    ASN  83           HN       ASN  83  14.978  13.761  10.309
  589    HA   ASN  83           HA       ASN  83  15.238  11.245   9.066
  590    HB2  ASN  83           HB2      ASN  83  15.973  12.060  11.882
  591    HB3  ASN  83           HB1      ASN  83  16.496  10.580  11.087
  592   HD21  ASN  83          HD21      ASN  83  16.882  11.836   8.489
  593   HD22  ASN  83          HD22      ASN  83  18.316  12.783   8.628
  594    H    THR  84           HN       THR  84  13.054  12.390  11.510
  595    HA   THR  84           HA       THR  84  12.235   9.884  12.536
  596    HB   THR  84           HB       THR  84  10.189  11.191  13.261
  597    HG1  THR  84           HG1      THR  84  10.126  13.360  12.817
  598   HG21  THR  84          HG21      THR  84  11.432  12.567  14.874
  599   HG22  THR  84          HG22      THR  84  12.902  12.334  13.927
  600   HG23  THR  84          HG23      THR  84  12.131  10.957  14.711
  601    H    VAL  85           HN       VAL  85  10.925  12.000  10.005
  602    HA   VAL  85           HA       VAL  85   8.816  10.260   9.230
  603    HB   VAL  85           HB       VAL  85  10.178  12.458   7.657
  604   HG11  VAL  85          HG11      VAL  85   7.594  10.990   7.139
  605   HG12  VAL  85          HG12      VAL  85   9.057  10.914   6.157
  606   HG13  VAL  85          HG13      VAL  85   8.145  12.420   6.268
  607   HG21  VAL  85          HG21      VAL  85   7.605  12.440   9.240
  608   HG22  VAL  85          HG22      VAL  85   8.226  13.792   8.290
  609   HG23  VAL  85          HG23      VAL  85   9.105  13.235   9.714
  610    H    LEU  86           HN       LEU  86  12.098  10.800   7.972
  611    HA   LEU  86           HA       LEU  86  12.281   8.932   5.966
  612    HG   LEU  86           HG       LEU  86  15.666  10.275   6.102
  613    HB2  LEU  86           HB2      LEU  86  14.070  10.178   7.864
  614    HB3  LEU  86           HB1      LEU  86  14.583   8.533   7.501
  615   HD11  LEU  86          HD11      LEU  86  13.941   8.321   4.602
  616   HD12  LEU  86          HD12      LEU  86  15.500   7.968   5.350
  617   HD13  LEU  86          HD13      LEU  86  15.407   9.096   3.999
  618   HD21  LEU  86          HD21      LEU  86  13.806  11.821   5.874
  619   HD22  LEU  86          HD22      LEU  86  12.908  10.618   4.947
  620   HD23  LEU  86          HD23      LEU  86  14.395  11.306   4.292
  621    H    GLY  87           HN       GLY  87  12.861   8.367   9.413
  622    HA2  GLY  87           HA2      GLY  87  13.362   5.642   9.313
  623    HA3  GLY  87           HA1      GLY  87  12.752   6.502  10.716
  624    H    LYS  88           HN       LYS  88  10.223   7.236  10.028
  625    HA   LYS  88           HA       LYS  88   9.068   4.614  10.219
  626    HB2  LYS  88           HB2      LYS  88   6.949   5.711  10.758
  627    HB3  LYS  88           HB1      LYS  88   8.264   6.206  11.805
  628    HG2  LYS  88           HG2      LYS  88   8.333   8.346  10.901
  629    HG3  LYS  88           HG1      LYS  88   7.476   7.848   9.435
  630    HD2  LYS  88           HD2      LYS  88   5.418   7.813  10.485
  631    HD3  LYS  88           HD1      LYS  88   6.118   7.562  12.080
  632    HE2  LYS  88           HE2      LYS  88   5.088   9.793  11.757
  633    HE3  LYS  88           HE1      LYS  88   6.789   9.856  12.218
  634    HZ1  LYS  88           HZ1      LYS  88   5.741  10.163   9.461
  635    HZ2  LYS  88           HZ2      LYS  88   7.359  10.295   9.930
  636    HZ3  LYS  88           HZ3      LYS  88   6.225  11.439  10.465
  637    H    ILE  89           HN       ILE  89   9.372   6.925   7.656
  638    HA   ILE  89           HA       ILE  89   7.305   5.782   6.052
  639    HB   ILE  89           HB       ILE  89   9.788   7.319   5.314
  640   HG12  ILE  89          HG12      ILE  89   6.825   7.878   5.256
  641   HG13  ILE  89          HG11      ILE  89   8.067   8.714   6.178
  642   HG21  ILE  89          HG21      ILE  89   9.456   5.686   3.538
  643   HG22  ILE  89          HG22      ILE  89   9.026   7.301   2.972
  644   HG23  ILE  89          HG23      ILE  89   7.759   6.150   3.402
  645   HD11  ILE  89          HD11      ILE  89   7.334  10.071   4.330
  646   HD12  ILE  89          HD12      ILE  89   7.723   8.777   3.197
  647   HD13  ILE  89          HD13      ILE  89   9.011   9.584   4.092
  648    H    TRP  90           HN       TRP  90  10.808   5.254   6.308
  649    HA   TRP  90           HA       TRP  90  11.065   3.096   4.592
  650    HD1  TRP  90           HD1      TRP  90  13.088   1.250   8.107
  651    HE1  TRP  90           HE1      TRP  90  14.374  -0.758   7.092
  652    HE3  TRP  90           HE3      TRP  90  13.351   2.808   3.248
  653    HZ2  TRP  90           HZ2      TRP  90  15.358  -1.568   4.565
  654    HZ3  TRP  90           HZ3      TRP  90  14.465   1.360   1.600
  655    HH2  TRP  90           HH2      TRP  90  15.444  -0.777   2.245
  656    HB2  TRP  90           HB2      TRP  90  12.997   4.071   5.651
  657    HB3  TRP  90           HB1      TRP  90  12.422   3.593   7.244
  658    H    LYS  91           HN       LYS  91  10.363   3.001   8.059
  659    HA   LYS  91           HA       LYS  91  10.251   0.209   8.285
  660    HB2  LYS  91           HB2      LYS  91   9.170   2.405   9.968
  661    HB3  LYS  91           HB1      LYS  91   9.116   0.722  10.461
  662    HG2  LYS  91           HG2      LYS  91  11.525   0.638  10.336
  663    HG3  LYS  91           HG1      LYS  91  11.572   2.325   9.829
  664    HD2  LYS  91           HD2      LYS  91  10.454   2.967  11.928
  665    HD3  LYS  91           HD1      LYS  91  10.513   1.287  12.457
  666    HE2  LYS  91           HE2      LYS  91  12.931   1.330  12.428
  667    HE3  LYS  91           HE1      LYS  91  12.925   2.962  11.763
  668    HZ1  LYS  91           HZ1      LYS  91  13.349   2.990  14.132
  669    HZ2  LYS  91           HZ2      LYS  91  11.888   2.182  14.440
  670    HZ3  LYS  91           HZ3      LYS  91  11.869   3.749  13.794
  671    H    LEU  92           HN       LEU  92   7.820   2.561   7.466
  672    HA   LEU  92           HA       LEU  92   5.656   0.676   7.848
  673    HG   LEU  92           HG       LEU  92   3.340   1.700   7.221
  674    HB2  LEU  92           HB2      LEU  92   5.730   3.370   7.992
  675    HB3  LEU  92           HB1      LEU  92   5.204   3.180   6.314
  676   HD11  LEU  92          HD11      LEU  92   4.215   2.971   9.810
  677   HD12  LEU  92          HD12      LEU  92   4.342   1.260   9.401
  678   HD13  LEU  92          HD13      LEU  92   2.753   2.011   9.568
  679   HD21  LEU  92          HD21      LEU  92   1.960   3.625   7.859
  680   HD22  LEU  92          HD22      LEU  92   2.952   3.975   6.443
  681   HD23  LEU  92          HD23      LEU  92   3.415   4.609   8.023
  682    H    ALA  93           HN       ALA  93   7.937   1.401   5.461
  683    HA   ALA  93           HA       ALA  93   6.196   0.376   3.321
  684    HB1  ALA  93           HB1      ALA  93   7.930   1.135   1.780
  685    HB2  ALA  93           HB2      ALA  93   8.909   1.672   3.148
  686    HB3  ALA  93           HB3      ALA  93   7.356   2.443   2.814
  687    H    ASP  94           HN       ASP  94   9.327  -0.213   4.865
  688    HA   ASP  94           HA       ASP  94   9.736  -2.686   3.431
  689    HB2  ASP  94           HB2      ASP  94  11.613  -1.199   4.251
  690    HB3  ASP  94           HB1      ASP  94  11.202  -1.690   5.892
  691    H    VAL  95           HN       VAL  95   8.224  -4.158   3.873
  692    HA   VAL  95           HA       VAL  95   6.972  -4.331   6.423
  693    HB   VAL  95           HB       VAL  95   6.808  -6.287   4.133
  694   HG11  VAL  95          HG11      VAL  95   4.681  -6.958   5.135
  695   HG12  VAL  95          HG12      VAL  95   4.950  -5.832   6.463
  696   HG13  VAL  95          HG13      VAL  95   6.022  -7.217   6.253
  697   HG21  VAL  95          HG21      VAL  95   4.745  -5.103   3.522
  698   HG22  VAL  95          HG22      VAL  95   6.168  -4.068   3.392
  699   HG23  VAL  95          HG23      VAL  95   5.078  -3.903   4.769
  700    H    ASP  96           HN       ASP  96   9.596  -5.946   4.823
  701    HA   ASP  96           HA       ASP  96   9.811  -8.041   6.802
  702    HB2  ASP  96           HB2      ASP  96  12.216  -7.199   5.327
  703    HB3  ASP  96           HB1      ASP  96  11.582  -8.827   5.578
  704    H    LYS  97           HN       LYS  97  10.870  -4.780   6.384
  705    HA   LYS  97           HA       LYS  97  12.273  -3.376   7.492
  706    HB2  LYS  97           HB2      LYS  97  11.697  -5.246   9.805
  707    HB3  LYS  97           HB1      LYS  97  12.394  -3.632   9.941
  708    HG2  LYS  97           HG2      LYS  97  10.376  -2.682   8.965
  709    HG3  LYS  97           HG1      LYS  97   9.675  -4.286   8.835
  710    HD2  LYS  97           HD2      LYS  97   9.750  -4.532  11.265
  711    HD3  LYS  97           HD1      LYS  97  10.476  -2.929  11.415
  712    HE2  LYS  97           HE2      LYS  97   8.499  -1.885  10.554
  713    HE3  LYS  97           HE1      LYS  97   7.798  -3.445  10.134
  714    HZ1  LYS  97           HZ1      LYS  97   8.401  -2.561  12.907
  715    HZ2  LYS  97           HZ2      LYS  97   7.626  -3.996  12.449
  716    HZ3  LYS  97           HZ3      LYS  97   6.869  -2.505  12.184
  717    H    ASP  98           HN       ASP  98  13.532  -4.996   5.895
  718    HA   ASP  98           HA       ASP  98  15.547  -6.513   7.404
  719    HB2  ASP  98           HB2      ASP  98  15.701  -7.999   5.492
  720    HB3  ASP  98           HB1      ASP  98  14.023  -7.869   6.029
  721    H    GLY  99           HN       GLY  99  15.250  -3.688   5.731
  722    HA2  GLY  99           HA2      GLY  99  17.103  -2.221   5.479
  723    HA3  GLY  99           HA1      GLY  99  18.166  -3.619   5.413
  724    H    LEU 100           HN       LEU 100  15.484  -4.093   3.471
  725    HA   LEU 100           HA       LEU 100  16.424  -2.581   1.204
  726    HG   LEU 100           HG       LEU 100  16.347  -6.131   2.250
  727    HB2  LEU 100           HB2      LEU 100  16.600  -4.544  -0.277
  728    HB3  LEU 100           HB1      LEU 100  17.852  -4.471   0.946
  729   HD11  LEU 100          HD11      LEU 100  15.022  -7.594   0.794
  730   HD12  LEU 100          HD12      LEU 100  15.280  -6.471  -0.541
  731   HD13  LEU 100          HD13      LEU 100  14.369  -5.958   0.881
  732   HD21  LEU 100          HD21      LEU 100  18.528  -6.656   1.345
  733   HD22  LEU 100          HD22      LEU 100  17.822  -6.934  -0.246
  734   HD23  LEU 100          HD23      LEU 100  17.414  -8.000   1.099
  735    H    LEU 101           HN       LEU 101  14.980  -2.651  -0.568
  736    HA   LEU 101           HA       LEU 101  12.247  -3.410   0.217
  737    HG   LEU 101           HG       LEU 101  13.260  -0.615   1.167
  738    HB2  LEU 101           HB2      LEU 101  13.235  -0.959  -1.242
  739    HB3  LEU 101           HB1      LEU 101  11.538  -1.424  -1.186
  740   HD11  LEU 101          HD11      LEU 101  11.796   1.306   1.260
  741   HD12  LEU 101          HD12      LEU 101  10.892   0.716  -0.136
  742   HD13  LEU 101          HD13      LEU 101  12.573   1.214  -0.320
  743   HD21  LEU 101          HD21      LEU 101  10.349  -1.359   1.073
  744   HD22  LEU 101          HD22      LEU 101  11.245  -0.784   2.479
  745   HD23  LEU 101          HD23      LEU 101  11.640  -2.344   1.760
  746    H    ASP 102           HN       ASP 102  11.522  -4.974  -1.131
  747    HA   ASP 102           HA       ASP 102  12.721  -5.426  -3.683
  748    HB2  ASP 102           HB2      ASP 102  10.872  -7.078  -4.010
  749    HB3  ASP 102           HB1      ASP 102  11.779  -7.316  -2.520
  750    H    ASP 103           HN       ASP 103  10.851  -5.718  -5.575
  751    HA   ASP 103           HA       ASP 103  10.403  -3.114  -6.517
  752    HB2  ASP 103           HB2      ASP 103  10.398  -4.595  -8.250
  753    HB3  ASP 103           HB1      ASP 103   9.616  -5.863  -7.309
  754    H    GLU 104           HN       GLU 104   8.380  -5.231  -4.617
  755    HA   GLU 104           HA       GLU 104   6.021  -3.597  -4.974
  756    HB2  GLU 104           HB2      GLU 104   6.173  -6.167  -4.722
  757    HB3  GLU 104           HB1      GLU 104   6.355  -5.843  -3.006
  758    HG2  GLU 104           HG2      GLU 104   4.208  -4.826  -2.895
  759    HG3  GLU 104           HG1      GLU 104   4.035  -4.894  -4.664
  760    H    GLU 105           HN       GLU 105   8.530  -4.190  -2.628
  761    HA   GLU 105           HA       GLU 105   7.381  -2.625  -0.551
  762    HB2  GLU 105           HB2      GLU 105   9.738  -4.224  -0.921
  763    HB3  GLU 105           HB1      GLU 105  10.169  -2.678  -0.196
  764    HG2  GLU 105           HG2      GLU 105   8.631  -2.994   1.592
  765    HG3  GLU 105           HG1      GLU 105   7.935  -4.409   0.819
  766    H    PHE 106           HN       PHE 106   9.503  -1.893  -3.262
  767    HA   PHE 106           HA       PHE 106   9.988   0.815  -2.519
  768    HD1  PHE 106           HD2      PHE 106   9.185   2.608  -4.366
  769    HD2  PHE 106           HD1      PHE 106  12.622   0.714  -5.996
  770    HE1  PHE 106           HE2      PHE 106   9.931   4.753  -5.297
  771    HE2  PHE 106           HE1      PHE 106  13.355   2.845  -6.934
  772    HZ   PHE 106           HZ       PHE 106  12.032   4.879  -6.557
  773    HB2  PHE 106           HB2      PHE 106  11.305  -0.386  -4.267
  774    HB3  PHE 106           HB1      PHE 106   9.893  -0.389  -5.310
  775    H    ALA 107           HN       ALA 107   7.559  -0.825  -4.503
  776    HA   ALA 107           HA       ALA 107   5.996   1.256  -5.353
  777    HB1  ALA 107           HB1      ALA 107   4.099  -0.294  -5.253
  778    HB2  ALA 107           HB2      ALA 107   5.052  -1.385  -4.244
  779    HB3  ALA 107           HB3      ALA 107   5.542  -1.068  -5.909
  780    H    LEU 108           HN       LEU 108   5.881  -0.332  -2.169
  781    HA   LEU 108           HA       LEU 108   3.857   1.378  -1.142
  782    HG   LEU 108           HG       LEU 108   2.814  -0.074   0.644
  783    HB2  LEU 108           HB2      LEU 108   4.849  -0.949  -0.301
  784    HB3  LEU 108           HB1      LEU 108   5.817   0.125   0.703
  785   HD11  LEU 108          HD11      LEU 108   3.867  -1.892   1.785
  786   HD12  LEU 108          HD12      LEU 108   3.084  -0.817   2.945
  787   HD13  LEU 108          HD13      LEU 108   4.835  -0.767   2.734
  788   HD21  LEU 108          HD21      LEU 108   4.552   1.747   2.284
  789   HD22  LEU 108          HD22      LEU 108   2.817   1.507   2.504
  790   HD23  LEU 108          HD23      LEU 108   3.428   2.229   1.016
  791    H    ALA 109           HN       ALA 109   7.399   1.343  -0.833
  792    HA   ALA 109           HA       ALA 109   7.773   3.386   0.966
  793    HB1  ALA 109           HB1      ALA 109   9.968   3.728  -0.053
  794    HB2  ALA 109           HB2      ALA 109   9.453   2.826  -1.476
  795    HB3  ALA 109           HB3      ALA 109   9.589   2.012   0.081
  796    H    ASN 110           HN       ASN 110   7.552   3.731  -2.570
  797    HA   ASN 110           HA       ASN 110   7.765   6.570  -2.492
  798    HB2  ASN 110           HB2      ASN 110   8.330   4.899  -4.424
  799    HB3  ASN 110           HB1      ASN 110   6.630   5.093  -4.837
  800   HD21  ASN 110          HD21      ASN 110   6.503   7.882  -3.982
  801   HD22  ASN 110          HD22      ASN 110   7.372   8.794  -5.173
  802    H    HIS 111           HN       HIS 111   5.172   4.226  -2.257
  803    HA   HIS 111           HA       HIS 111   3.057   6.008  -3.007
  804    HD1  HIS 111           HD1      HIS 111   0.867   4.578  -4.316
  805    HD2  HIS 111           HD2      HIS 111   0.310   4.112  -0.217
  806    HE1  HIS 111           HE1      HIS 111  -1.595   4.838  -3.929
  807    HE2  HIS 111           HE2      HIS 111  -1.863   4.842  -1.419
  808    HB2  HIS 111           HB2      HIS 111   2.914   3.460  -2.948
  809    HB3  HIS 111           HB1      HIS 111   2.808   3.596  -1.192
  810    H    LEU 112           HN       LEU 112   4.594   5.086   0.044
  811    HA   LEU 112           HA       LEU 112   2.874   6.613   1.716
  812    HG   LEU 112           HG       LEU 112   3.874   3.827   2.203
  813    HB2  LEU 112           HB2      LEU 112   5.643   5.501   2.081
  814    HB3  LEU 112           HB1      LEU 112   4.843   6.454   3.332
  815   HD11  LEU 112          HD11      LEU 112   5.098   4.585   4.842
  816   HD12  LEU 112          HD12      LEU 112   5.782   3.521   3.613
  817   HD13  LEU 112          HD13      LEU 112   4.337   3.033   4.500
  818   HD21  LEU 112          HD21      LEU 112   2.720   5.578   4.374
  819   HD22  LEU 112          HD22      LEU 112   2.176   3.949   3.972
  820   HD23  LEU 112          HD23      LEU 112   2.001   5.252   2.797
  821    H    ILE 113           HN       ILE 113   5.907   7.274   0.065
  822    HA   ILE 113           HA       ILE 113   6.441   9.804   1.098
  823    HB   ILE 113           HB       ILE 113   6.962   8.683  -1.656
  824   HG12  ILE 113          HG12      ILE 113   8.806   9.139   0.700
  825   HG13  ILE 113          HG11      ILE 113   8.046   7.600   0.317
  826   HG21  ILE 113          HG21      ILE 113   8.557  10.506  -1.974
  827   HG22  ILE 113          HG22      ILE 113   8.061  11.213  -0.436
  828   HG23  ILE 113          HG23      ILE 113   6.916  11.125  -1.776
  829   HD11  ILE 113          HD11      ILE 113  10.361   7.696  -0.442
  830   HD12  ILE 113          HD12      ILE 113   9.972   9.086  -1.456
  831   HD13  ILE 113          HD13      ILE 113   9.242   7.517  -1.793
  832    H    LYS 114           HN       LYS 114   4.463   8.919  -1.752
  833    HA   LYS 114           HA       LYS 114   3.649  11.624  -2.180
  834    HB2  LYS 114           HB2      LYS 114   2.156  10.823  -3.843
  835    HB3  LYS 114           HB1      LYS 114   3.595   9.819  -3.940
  836    HG2  LYS 114           HG2      LYS 114   2.461   8.038  -2.753
  837    HG3  LYS 114           HG1      LYS 114   1.026   9.050  -2.565
  838    HD2  LYS 114           HD2      LYS 114   2.207   8.077  -5.168
  839    HD3  LYS 114           HD1      LYS 114   0.735   7.482  -4.401
  840    HE2  LYS 114           HE2      LYS 114  -0.314   9.648  -4.676
  841    HE3  LYS 114           HE1      LYS 114   1.173  10.308  -5.354
  842    HZ1  LYS 114           HZ1      LYS 114  -0.235   9.805  -7.154
  843    HZ2  LYS 114           HZ2      LYS 114  -0.608   8.268  -6.551
  844    HZ3  LYS 114           HZ3      LYS 114   0.948   8.588  -7.144
  845    H    VAL 115           HN       VAL 115   2.440   9.024  -0.199
  846    HA   VAL 115           HA       VAL 115  -0.100  10.077   0.429
  847    HB   VAL 115           HB       VAL 115   1.759   8.194   1.850
  848   HG11  VAL 115          HG11      VAL 115  -0.892   9.148   2.922
  849   HG12  VAL 115          HG12      VAL 115   0.690   9.487   3.626
  850   HG13  VAL 115          HG13      VAL 115   0.081   7.832   3.583
  851   HG21  VAL 115          HG21      VAL 115   0.470   7.371  -0.052
  852   HG22  VAL 115          HG22      VAL 115  -1.023   7.894   0.727
  853   HG23  VAL 115          HG23      VAL 115  -0.056   6.608   1.446
  854    H    LYS 116           HN       LYS 116   3.087  10.596   2.025
  855    HA   LYS 116           HA       LYS 116   1.833  12.523   3.770
  856    HB2  LYS 116           HB2      LYS 116   3.988  12.838   4.757
  857    HB3  LYS 116           HB1      LYS 116   3.638  11.121   4.600
  858    HG2  LYS 116           HG2      LYS 116   5.261  10.793   3.058
  859    HG3  LYS 116           HG1      LYS 116   5.156  12.445   2.430
  860    HD2  LYS 116           HD2      LYS 116   6.295  11.614   5.087
  861    HD3  LYS 116           HD1      LYS 116   7.214  12.109   3.671
  862    HE2  LYS 116           HE2      LYS 116   5.265  13.791   5.230
  863    HE3  LYS 116           HE1      LYS 116   7.014  13.946   5.225
  864    HZ1  LYS 116           HZ1      LYS 116   5.199  14.450   2.930
  865    HZ2  LYS 116           HZ2      LYS 116   6.887  14.490   2.841
  866    HZ3  LYS 116           HZ3      LYS 116   6.069  15.613   3.810
  867    H    LEU 117           HN       LEU 117   2.863  12.576   0.627
  868    HA   LEU 117           HA       LEU 117   3.581  15.376   0.580
  869    HG   LEU 117           HG       LEU 117   2.693  15.935  -2.291
  870    HB2  LEU 117           HB2      LEU 117   4.454  13.787  -1.100
  871    HB3  LEU 117           HB1      LEU 117   2.807  13.511  -1.675
  872   HD11  LEU 117          HD11      LEU 117   5.651  15.867  -1.722
  873   HD12  LEU 117          HD12      LEU 117   4.445  16.731  -0.770
  874   HD13  LEU 117          HD13      LEU 117   4.755  17.206  -2.440
  875   HD21  LEU 117          HD21      LEU 117   4.901  14.340  -3.577
  876   HD22  LEU 117          HD22      LEU 117   4.028  15.690  -4.306
  877   HD23  LEU 117          HD23      LEU 117   3.180  14.190  -3.929
  878    H    GLU 118           HN       GLU 118   0.725  13.425   0.454
  879    HA   GLU 118           HA       GLU 118  -1.046  15.266  -0.747
  880    HB2  GLU 118           HB2      GLU 118  -1.572  13.038   1.230
  881    HB3  GLU 118           HB1      GLU 118  -2.830  13.928   0.383
  882    HG2  GLU 118           HG2      GLU 118  -1.939  13.133  -1.758
  883    HG3  GLU 118           HG1      GLU 118  -0.703  12.214  -0.888
  884    H    GLY 119           HN       GLY 119   0.473  15.295   2.300
  885    HA2  GLY 119           HA2      GLY 119   0.456  17.478   3.375
  886    HA3  GLY 119           HA1      GLY 119  -1.272  17.547   3.060
  887    H    HIS 120           HN       HIS 120  -0.389  14.452   3.976
  888    HA   HIS 120           HA       HIS 120  -0.750  15.071   6.816
  889    HD1  HIS 120           HD1      HIS 120  -2.246  11.181   7.461
  890    HD2  HIS 120           HD2      HIS 120  -2.132  12.245   3.436
  891    HE1  HIS 120           HE1      HIS 120  -2.287   9.019   6.192
  892    HE2  HIS 120           HE2      HIS 120  -2.441   9.699   3.751
  893    HB2  HIS 120           HB2      HIS 120  -2.504  13.614   7.134
  894    HB3  HIS 120           HB1      HIS 120  -2.873  14.190   5.516
  895    H    GLU 121           HN       GLU 121   0.414  13.848   8.185
  896    HA   GLU 121           HA       GLU 121   2.604  12.350   7.098
  897    HB2  GLU 121           HB2      GLU 121   3.388  12.165   9.371
  898    HB3  GLU 121           HB1      GLU 121   2.831  13.809   9.091
  899    HG2  GLU 121           HG2      GLU 121   0.830  13.427  10.303
  900    HG3  GLU 121           HG1      GLU 121   1.147  11.694  10.401
  901    H    LEU 122           HN       LEU 122   3.188  10.187   7.993
  902    HA   LEU 122           HA       LEU 122   1.087   8.330   7.509
  903    HG   LEU 122           HG       LEU 122   4.306   8.900   6.724
  904    HB2  LEU 122           HB2      LEU 122   3.763   7.724   8.757
  905    HB3  LEU 122           HB1      LEU 122   2.711   6.615   7.879
  906   HD11  LEU 122          HD11      LEU 122   4.456   5.919   6.348
  907   HD12  LEU 122          HD12      LEU 122   5.612   6.922   7.226
  908   HD13  LEU 122          HD13      LEU 122   5.421   7.112   5.482
  909   HD21  LEU 122          HD21      LEU 122   3.426   8.244   4.563
  910   HD22  LEU 122          HD22      LEU 122   2.122   8.744   5.640
  911   HD23  LEU 122          HD23      LEU 122   2.401   7.031   5.330
  912    HA   PRO 123           HA       PRO 123  -0.225   7.981  11.723
  913    HB2  PRO 123           HB2      PRO 123  -2.147   6.141  11.368
  914    HB3  PRO 123           HB1      PRO 123  -2.292   7.775  10.711
  915    HG2  PRO 123           HG2      PRO 123  -1.752   5.230   9.321
  916    HG3  PRO 123           HG1      PRO 123  -2.471   6.720   8.698
  917    HD2  PRO 123           HD2      PRO 123   0.233   5.820   8.415
  918    HD3  PRO 123           HD1      PRO 123  -0.474   7.336   7.826
  919    H    ALA 124           HN       ALA 124   1.867   5.959  10.473
  920    HA   ALA 124           HA       ALA 124   3.070   4.165  11.154
  921    HB1  ALA 124           HB1      ALA 124   3.265   5.470  13.217
  922    HB2  ALA 124           HB2      ALA 124   3.247   3.734  13.532
  923    HB3  ALA 124           HB3      ALA 124   1.804   4.701  13.836
  924    H    ASP 125           HN       ASP 125   0.212   3.899  10.270
  925    HA   ASP 125           HA       ASP 125  -0.342   1.215  11.344
  926    HB2  ASP 125           HB2      ASP 125  -2.138   3.013  11.588
  927    HB3  ASP 125           HB1      ASP 125  -2.275   2.985   9.833
  928    H    LEU 126           HN       LEU 126  -0.454  -0.482   9.911
  929    HA   LEU 126           HA       LEU 126  -0.066   0.165   7.065
  930    HG   LEU 126           HG       LEU 126   2.340  -0.533   6.342
  931    HB2  LEU 126           HB2      LEU 126   1.765  -1.113   8.594
  932    HB3  LEU 126           HB1      LEU 126   0.815  -2.486   8.059
  933   HD11  LEU 126          HD11      LEU 126   3.562  -2.511   5.633
  934   HD12  LEU 126          HD12      LEU 126   2.573  -3.516   6.692
  935   HD13  LEU 126          HD13      LEU 126   3.656  -2.309   7.384
  936   HD21  LEU 126          HD21      LEU 126   0.183  -1.028   5.292
  937   HD22  LEU 126          HD22      LEU 126   0.522  -2.754   5.427
  938   HD23  LEU 126          HD23      LEU 126   1.531  -1.736   4.398
  939    HA   PRO 127           HA       PRO 127  -4.104  -1.854   7.522
  940    HB2  PRO 127           HB2      PRO 127  -4.746  -0.516   5.001
  941    HB3  PRO 127           HB1      PRO 127  -5.475  -0.311   6.594
  942    HG2  PRO 127           HG2      PRO 127  -3.965   1.587   5.441
  943    HG3  PRO 127           HG1      PRO 127  -4.003   1.341   7.197
  944    HD2  PRO 127           HD2      PRO 127  -1.971   0.418   5.198
  945    HD3  PRO 127           HD1      PRO 127  -1.710   1.154   6.794
  946    HA   PRO 128           HA       PRO 128  -3.578  -5.300   4.817
  947    HB2  PRO 128           HB2      PRO 128  -6.464  -5.701   4.723
  948    HB3  PRO 128           HB1      PRO 128  -5.221  -6.694   5.499
  949    HG2  PRO 128           HG2      PRO 128  -7.030  -5.183   6.860
  950    HG3  PRO 128           HG1      PRO 128  -5.439  -5.618   7.499
  951    HD2  PRO 128           HD2      PRO 128  -6.417  -3.046   6.377
  952    HD3  PRO 128           HD1      PRO 128  -5.221  -3.345   7.653
  953    H    HIS 129           HN       HIS 129  -5.296  -2.561   3.930
  954    HA   HIS 129           HA       HIS 129  -5.538  -3.495   1.160
  955    HD1  HIS 129           HD1      HIS 129  -8.096  -1.499   4.222
  956    HD2  HIS 129           HD2      HIS 129  -5.999   0.966   1.619
  957    HE1  HIS 129           HE1      HIS 129  -7.997   0.747   5.345
  958    HE2  HIS 129           HE2      HIS 129  -7.041   2.275   3.588
  959    HB2  HIS 129           HB2      HIS 129  -6.983  -1.552   0.726
  960    HB3  HIS 129           HB1      HIS 129  -7.645  -2.573   1.984
  961    H    LEU 130           HN       LEU 130  -3.309  -2.288   2.997
  962    HA   LEU 130           HA       LEU 130  -2.050  -0.976   0.663
  963    HG   LEU 130           HG       LEU 130  -1.477   1.269   0.776
  964    HB2  LEU 130           HB2      LEU 130  -2.351   0.021   3.335
  965    HB3  LEU 130           HB1      LEU 130  -0.672  -0.027   2.874
  966   HD11  LEU 130          HD11      LEU 130  -3.743   1.828   2.673
  967   HD12  LEU 130          HD12      LEU 130  -3.854   1.014   1.113
  968   HD13  LEU 130          HD13      LEU 130  -3.404   2.719   1.189
  969   HD21  LEU 130          HD21      LEU 130  -1.188   3.395   1.949
  970   HD22  LEU 130          HD22      LEU 130  -0.009   2.192   2.472
  971   HD23  LEU 130          HD23      LEU 130  -1.399   2.564   3.493
  972    H    VAL 131           HN       VAL 131  -2.037  -3.483   2.848
  973    HA   VAL 131           HA       VAL 131   0.722  -3.954   3.126
  974    HB   VAL 131           HB       VAL 131  -1.674  -5.791   3.205
  975   HG11  VAL 131          HG11      VAL 131   0.220  -7.055   2.325
  976   HG12  VAL 131          HG12      VAL 131  -0.200  -7.563   3.960
  977   HG13  VAL 131          HG13      VAL 131   1.203  -6.527   3.693
  978   HG21  VAL 131          HG21      VAL 131  -1.367  -4.301   5.110
  979   HG22  VAL 131          HG22      VAL 131   0.285  -4.897   5.307
  980   HG23  VAL 131          HG23      VAL 131  -1.080  -5.982   5.561
  981    HA   PRO 132           HA       PRO 132   1.634  -4.830  -1.176
  982    HB2  PRO 132           HB2      PRO 132   3.988  -6.091   0.144
  983    HB3  PRO 132           HB1      PRO 132   3.933  -4.952  -1.202
  984    HG2  PRO 132           HG2      PRO 132   4.668  -4.155   1.232
  985    HG3  PRO 132           HG1      PRO 132   3.688  -3.117   0.179
  986    HD2  PRO 132           HD2      PRO 132   2.860  -4.730   2.557
  987    HD3  PRO 132           HD1      PRO 132   2.273  -3.142   2.001
  988    HA   PRO 133           HA       PRO 133  -0.530  -8.677  -0.932
  989    HB2  PRO 133           HB2      PRO 133   0.295  -9.490  -3.532
  990    HB3  PRO 133           HB1      PRO 133  -1.237  -8.739  -3.068
  991    HG2  PRO 133           HG2      PRO 133   1.155  -7.540  -4.303
  992    HG3  PRO 133           HG1      PRO 133  -0.536  -6.979  -4.325
  993    HD2  PRO 133           HD2      PRO 133   1.443  -5.773  -2.887
  994    HD3  PRO 133           HD1      PRO 133  -0.265  -5.739  -2.405
  995    H    SER 134           HN       SER 134   2.847  -8.601  -2.005
  996    HA   SER 134           HA       SER 134   3.139 -11.465  -1.754
  997    HG   SER 134           HG       SER 134   4.037  -9.055  -3.820
  998    HB2  SER 134           HB2      SER 134   5.307  -9.380  -2.086
  999    HB3  SER 134           HB1      SER 134   5.415 -11.103  -2.451
 1000    H    LYS 135           HN       LYS 135   2.941  -9.059   0.528
 1001    HA   LYS 135           HA       LYS 135   4.843 -10.396   2.329
 1002    HB2  LYS 135           HB2      LYS 135   3.385  -7.984   3.249
 1003    HB3  LYS 135           HB1      LYS 135   5.040  -8.472   3.545
 1004    HG2  LYS 135           HG2      LYS 135   3.983  -7.241   1.010
 1005    HG3  LYS 135           HG1      LYS 135   4.921  -6.418   2.250
 1006    HD2  LYS 135           HD2      LYS 135   5.909  -8.747   0.612
 1007    HD3  LYS 135           HD1      LYS 135   6.243  -7.057   0.254
 1008    HE2  LYS 135           HE2      LYS 135   7.303  -6.835   2.483
 1009    HE3  LYS 135           HE1      LYS 135   7.064  -8.564   2.730
 1010    HZ1  LYS 135           HZ1      LYS 135   8.706  -7.340   0.566
 1011    HZ2  LYS 135           HZ2      LYS 135   8.466  -8.999   0.816
 1012    HZ3  LYS 135           HZ3      LYS 135   9.298  -8.086   1.973
 1013    H    ARG 136           HN       ARG 136   1.774 -10.772   1.425
 1014    HA   ARG 136           HA       ARG 136   0.521 -11.132   3.965
 1015    HE   ARG 136           HE       ARG 136  -2.784 -10.905   4.239
 1016    HB2  ARG 136           HB2      ARG 136  -0.217 -12.113   1.209
 1017    HB3  ARG 136           HB1      ARG 136  -1.191 -12.428   2.635
 1018    HG2  ARG 136           HG2      ARG 136  -0.637  -9.796   1.300
 1019    HG3  ARG 136           HG1      ARG 136  -2.190 -10.597   1.561
 1020    HD2  ARG 136           HD2      ARG 136  -0.421  -9.246   3.584
 1021    HD3  ARG 136           HD1      ARG 136  -2.067  -8.825   3.124
 1022   HH11  ARG 136          HH11      ARG 136   0.399  -9.651   4.992
 1023   HH12  ARG 136          HH12      ARG 136   0.437 -10.307   6.598
 1024   HH21  ARG 136          HH21      ARG 136  -2.768 -11.771   6.362
 1025   HH22  ARG 136          HH22      ARG 136  -1.380 -11.523   7.384
 1026    H    ARG 137           HN       ARG 137   1.600 -12.488   5.288
 1027    HA   ARG 137           HA       ARG 137   1.237 -15.293   4.647
 1028    HE   ARG 137           HE       ARG 137   5.174 -14.710   3.325
 1029    HB2  ARG 137           HB2      ARG 137   3.484 -15.900   5.581
 1030    HB3  ARG 137           HB1      ARG 137   3.528 -15.104   4.017
 1031    HG2  ARG 137           HG2      ARG 137   3.793 -13.338   6.362
 1032    HG3  ARG 137           HG1      ARG 137   5.125 -14.451   6.070
 1033    HD2  ARG 137           HD2      ARG 137   3.990 -12.473   4.115
 1034    HD3  ARG 137           HD1      ARG 137   5.530 -12.337   4.960
 1035   HH11  ARG 137          HH11      ARG 137   6.478 -11.473   3.543
 1036   HH12  ARG 137          HH12      ARG 137   7.521 -11.658   2.168
 1037   HH21  ARG 137          HH21      ARG 137   6.553 -14.970   1.544
 1038   HH22  ARG 137          HH22      ARG 137   7.582 -13.665   1.043
 1039    H    HIS 138           HN       HIS 138   0.179 -16.196   6.247
 1040    HA   HIS 138           HA       HIS 138   0.250 -14.936   8.895
 1041    HD1  HIS 138           HD1      HIS 138  -1.308 -18.172  10.323
 1042    HD2  HIS 138           HD2      HIS 138  -3.109 -14.426  10.127
 1043    HE1  HIS 138           HE1      HIS 138  -2.490 -17.875  12.524
 1044    HE2  HIS 138           HE2      HIS 138  -3.500 -15.561  12.421
 1045    HB2  HIS 138           HB2      HIS 138  -1.963 -15.358   7.842
 1046    HB3  HIS 138           HB1      HIS 138  -1.610 -17.082   7.839
 1047    H    GLU 139           HN       GLU 139   1.832 -15.715  10.150
 1048    HA   GLU 139           HA       GLU 139   2.496 -18.552  10.087
 1049    HB2  GLU 139           HB2      GLU 139   3.658 -16.330  11.787
 1050    HB3  GLU 139           HB1      GLU 139   4.308 -17.955  11.614
 1051    HG2  GLU 139           HG2      GLU 139   4.777 -17.527   9.261
 1052    HG3  GLU 139           HG1      GLU 139   4.104 -15.906   9.417
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1 -10.307 -14.319 -33.650
    2    H2   GLY   1           HT2      GLY   1 -11.722 -14.123 -32.732
    3    H3   GLY   1           HT3      GLY   1 -10.209 -13.803 -32.041
    4    HA2  GLY   1           HA1      GLY   1  -9.870 -11.968 -33.585
    5    HA3  GLY   1           HA2      GLY   1 -11.465 -12.281 -34.253
    6    HA   PRO   2           HA       PRO   2 -11.766  -9.090 -30.838
    7    HB2  PRO   2           HB2      PRO   2 -13.541  -7.773 -32.793
    8    HB3  PRO   2           HB1      PRO   2 -12.183  -7.107 -31.884
    9    HG2  PRO   2           HG2      PRO   2 -12.014  -7.563 -34.518
   10    HG3  PRO   2           HG1      PRO   2 -10.626  -7.807 -33.443
   11    HD2  PRO   2           HD2      PRO   2 -12.481  -9.838 -34.624
   12    HD3  PRO   2           HD1      PRO   2 -10.717  -9.906 -34.422
   13    H    LEU   3           HN       LEU   3 -14.046 -10.772 -32.858
   14    HA   LEU   3           HA       LEU   3 -16.290 -10.277 -31.114
   15    HG   LEU   3           HG       LEU   3 -17.695 -10.700 -34.535
   16    HB2  LEU   3           HB2      LEU   3 -15.961 -12.176 -33.446
   17    HB3  LEU   3           HB1      LEU   3 -17.456 -11.941 -32.568
   18   HD11  LEU   3          HD11      LEU   3 -16.817  -8.786 -32.389
   19   HD12  LEU   3          HD12      LEU   3 -18.421  -9.494 -32.578
   20   HD13  LEU   3          HD13      LEU   3 -17.804  -8.377 -33.793
   21   HD21  LEU   3          HD21      LEU   3 -14.958  -9.530 -34.058
   22   HD22  LEU   3          HD22      LEU   3 -16.048  -9.105 -35.380
   23   HD23  LEU   3          HD23      LEU   3 -15.382 -10.733 -35.274
   24    H    GLY   4           HN       GLY   4 -17.028 -11.574 -29.518
   25    HA2  GLY   4           HA2      GLY   4 -17.067 -13.352 -28.031
   26    HA3  GLY   4           HA1      GLY   4 -16.065 -14.259 -29.158
   27    H    SER   5           HN       SER   5 -15.166 -11.095 -27.991
   28    HA   SER   5           HA       SER   5 -12.676 -12.118 -27.007
   29    HG   SER   5           HG       SER   5 -14.271  -9.043 -28.297
   30    HB2  SER   5           HB2      SER   5 -12.478  -9.602 -26.283
   31    HB3  SER   5           HB1      SER   5 -12.432 -10.024 -27.997
   32    H    GLU   6           HN       GLU   6 -11.872 -11.554 -24.828
   33    HA   GLU   6           HA       GLU   6 -13.383 -12.743 -22.833
   34    HB2  GLU   6           HB2      GLU   6 -11.141 -10.763 -22.427
   35    HB3  GLU   6           HB1      GLU   6 -11.687 -11.982 -21.284
   36    HG2  GLU   6           HG2      GLU   6 -11.022 -13.734 -22.887
   37    HG3  GLU   6           HG1      GLU   6 -10.380 -12.482 -23.944
   38    H    SER   7           HN       SER   7 -15.100 -12.086 -21.788
   39    HA   SER   7           HA       SER   7 -15.603  -9.192 -21.598
   40    HG   SER   7           HG       SER   7 -16.436 -10.747 -23.667
   41    HB2  SER   7           HB2      SER   7 -17.593 -11.476 -21.664
   42    HB3  SER   7           HB1      SER   7 -17.999  -9.764 -21.526
   43    H    LEU   8           HN       LEU   8 -15.398  -8.388 -19.640
   44    HA   LEU   8           HA       LEU   8 -15.708 -10.142 -17.311
   45    HG   LEU   8           HG       LEU   8 -15.278  -7.884 -15.204
   46    HB2  LEU   8           HB2      LEU   8 -13.595  -8.859 -17.513
   47    HB3  LEU   8           HB1      LEU   8 -14.516  -7.369 -17.489
   48   HD11  LEU   8          HD11      LEU   8 -15.170 -10.318 -15.311
   49   HD12  LEU   8          HD12      LEU   8 -14.229  -9.698 -13.952
   50   HD13  LEU   8          HD13      LEU   8 -13.409 -10.241 -15.417
   51   HD21  LEU   8          HD21      LEU   8 -13.105  -7.533 -14.098
   52   HD22  LEU   8          HD22      LEU   8 -13.322  -6.493 -15.504
   53   HD23  LEU   8          HD23      LEU   8 -12.291  -7.922 -15.613
   54    H    MET   9           HN       MET   9 -17.131  -9.639 -15.653
   55    HA   MET   9           HA       MET   9 -19.488  -8.224 -16.406
   56    HB2  MET   9           HB2      MET   9 -18.623  -9.491 -13.802
   57    HB3  MET   9           HB1      MET   9 -20.195  -8.736 -14.026
   58    HG2  MET   9           HG2      MET   9 -20.788 -10.326 -15.712
   59    HG3  MET   9           HG1      MET   9 -19.163 -11.009 -15.706
   60    HE1  MET   9           HE1      MET   9 -18.980 -12.815 -12.277
   61    HE2  MET   9           HE2      MET   9 -18.431 -11.177 -12.632
   62    HE3  MET   9           HE3      MET   9 -18.169 -12.470 -13.804
   63    HA   PRO  10           HA       PRO  10 -18.760  -4.107 -15.097
   64    HB2  PRO  10           HB2      PRO  10 -21.350  -4.204 -13.646
   65    HB3  PRO  10           HB1      PRO  10 -20.810  -3.095 -14.911
   66    HG2  PRO  10           HG2      PRO  10 -22.578  -5.007 -15.451
   67    HG3  PRO  10           HG1      PRO  10 -21.305  -4.597 -16.616
   68    HD2  PRO  10           HD2      PRO  10 -21.474  -6.915 -14.736
   69    HD3  PRO  10           HD1      PRO  10 -20.891  -6.866 -16.411
   70    H    SER  11           HN       SER  11 -18.491  -2.698 -13.260
   71    HA   SER  11           HA       SER  11 -17.766  -4.221 -10.858
   72    HG   SER  11           HG       SER  11 -16.631  -1.542  -9.584
   73    HB2  SER  11           HB2      SER  11 -15.971  -2.920 -11.951
   74    HB3  SER  11           HB1      SER  11 -16.921  -1.447 -11.755
   75    H    GLN  12           HN       GLN  12 -19.492  -4.277  -9.527
   76    HA   GLN  12           HA       GLN  12 -21.362  -2.128  -9.312
   77    HB2  GLN  12           HB2      GLN  12 -20.986  -4.668  -7.736
   78    HB3  GLN  12           HB1      GLN  12 -22.225  -3.488  -7.341
   79    HG2  GLN  12           HG2      GLN  12 -23.098  -3.749  -9.670
   80    HG3  GLN  12           HG1      GLN  12 -21.971  -5.091  -9.871
   81   HE21  GLN  12          HE21      GLN  12 -24.796  -3.950  -8.204
   82   HE22  GLN  12          HE22      GLN  12 -25.346  -5.494  -7.650
   83    H    VAL  13           HN       VAL  13 -21.964  -1.317  -7.057
   84    HA   VAL  13           HA       VAL  13 -19.652   0.061  -6.030
   85    HB   VAL  13           HB       VAL  13 -22.486   0.151  -4.982
   86   HG11  VAL  13          HG11      VAL  13 -20.210   2.111  -4.735
   87   HG12  VAL  13          HG12      VAL  13 -20.812   1.060  -3.457
   88   HG13  VAL  13          HG13      VAL  13 -21.840   2.339  -4.101
   89   HG21  VAL  13          HG21      VAL  13 -22.837   2.087  -6.405
   90   HG22  VAL  13          HG22      VAL  13 -22.408   0.684  -7.387
   91   HG23  VAL  13          HG23      VAL  13 -21.206   1.931  -7.053
   92    H    VAL  14           HN       VAL  14 -18.370  -0.767  -4.525
   93    HA   VAL  14           HA       VAL  14 -19.536  -2.576  -2.517
   94    HB   VAL  14           HB       VAL  14 -18.148  -3.873  -4.041
   95   HG11  VAL  14          HG11      VAL  14 -16.722  -2.084  -4.876
   96   HG12  VAL  14          HG12      VAL  14 -15.756  -3.440  -4.296
   97   HG13  VAL  14          HG13      VAL  14 -15.913  -1.986  -3.311
   98   HG21  VAL  14          HG21      VAL  14 -16.769  -3.454  -1.388
   99   HG22  VAL  14          HG22      VAL  14 -16.600  -4.863  -2.435
  100   HG23  VAL  14          HG23      VAL  14 -18.154  -4.508  -1.682
  101    H    LYS  15           HN       LYS  15 -18.984  -2.251  -0.406
  102    HA   LYS  15           HA       LYS  15 -16.692  -0.590   0.246
  103    HB2  LYS  15           HB2      LYS  15 -18.746   0.923   0.024
  104    HB3  LYS  15           HB1      LYS  15 -19.373   0.112   1.452
  105    HG2  LYS  15           HG2      LYS  15 -18.324   2.174   2.101
  106    HG3  LYS  15           HG1      LYS  15 -17.356   0.822   2.694
  107    HD2  LYS  15           HD2      LYS  15 -15.833   1.077   0.811
  108    HD3  LYS  15           HD1      LYS  15 -16.806   2.407   0.186
  109    HE2  LYS  15           HE2      LYS  15 -16.346   3.667   2.258
  110    HE3  LYS  15           HE1      LYS  15 -15.307   2.351   2.803
  111    HZ1  LYS  15           HZ1      LYS  15 -14.042   4.155   1.781
  112    HZ2  LYS  15           HZ2      LYS  15 -14.891   3.943   0.330
  113    HZ3  LYS  15           HZ3      LYS  15 -13.877   2.711   0.905
  114    H    GLY  16           HN       GLY  16 -15.707  -2.247   1.285
  115    HA2  GLY  16           HA2      GLY  16 -17.228  -3.657   3.384
  116    HA3  GLY  16           HA1      GLY  16 -15.837  -4.311   2.535
  117    H    GLY  17           HN       GLY  17 -16.395  -3.919   5.439
  118    HA2  GLY  17           HA2      GLY  17 -14.780  -3.745   7.136
  119    HA3  GLY  17           HA1      GLY  17 -13.757  -2.831   6.041
  120    H    ALA  18           HN       ALA  18 -16.864  -1.617   5.951
  121    HA   ALA  18           HA       ALA  18 -16.014   0.765   7.342
  122    HB1  ALA  18           HB1      ALA  18 -18.088   1.744   6.549
  123    HB2  ALA  18           HB2      ALA  18 -18.647   0.161   5.999
  124    HB3  ALA  18           HB3      ALA  18 -17.252   0.921   5.233
  125    H    PHE  19           HN       PHE  19 -15.879   0.147   9.492
  126    HA   PHE  19           HA       PHE  19 -18.487  -0.271  10.796
  127    HD1  PHE  19           HD2      PHE  19 -19.056  -2.804  12.194
  128    HD2  PHE  19           HD1      PHE  19 -15.495  -2.823   9.856
  129    HE1  PHE  19           HE2      PHE  19 -19.692  -4.989  11.249
  130    HE2  PHE  19           HE1      PHE  19 -16.128  -5.002   8.906
  131    HZ   PHE  19           HZ       PHE  19 -18.268  -6.086   9.632
  132    HB2  PHE  19           HB2      PHE  19 -15.759  -1.272  11.638
  133    HB3  PHE  19           HB1      PHE  19 -17.169  -1.302  12.691
  134    H    ASP  20           HN       ASP  20 -19.142   1.410  11.959
  135    HA   ASP  20           HA       ASP  20 -17.101   3.149  13.163
  136    HB2  ASP  20           HB2      ASP  20 -18.661   4.994  13.073
  137    HB3  ASP  20           HB1      ASP  20 -18.524   4.301  11.462
  138    H    GLY  21           HN       GLY  21 -17.334   3.738  15.305
  139    HA2  GLY  21           HA2      GLY  21 -19.027   1.889  16.829
  140    HA3  GLY  21           HA1      GLY  21 -17.635   2.765  17.456
  141    H    THR  22           HN       THR  22 -20.836   3.403  16.041
  142    HA   THR  22           HA       THR  22 -21.131   5.591  17.999
  143    HB   THR  22           HB       THR  22 -22.698   5.423  15.430
  144    HG1  THR  22           HG1      THR  22 -20.718   5.578  14.569
  145   HG21  THR  22          HG21      THR  22 -22.844   7.857  15.763
  146   HG22  THR  22          HG22      THR  22 -21.901   7.705  17.244
  147   HG23  THR  22          HG23      THR  22 -23.504   6.971  17.136
  148    H    MET  23           HN       MET  23 -22.321   4.744  19.632
  149    HA   MET  23           HA       MET  23 -24.828   3.434  18.904
  150    HB2  MET  23           HB2      MET  23 -24.551   1.820  20.771
  151    HB3  MET  23           HB1      MET  23 -23.407   1.593  19.455
  152    HG2  MET  23           HG2      MET  23 -21.678   2.707  20.757
  153    HG3  MET  23           HG1      MET  23 -22.827   2.966  22.067
  154    HE1  MET  23           HE1      MET  23 -20.079   1.769  22.399
  155    HE2  MET  23           HE2      MET  23 -20.245   0.264  23.303
  156    HE3  MET  23           HE3      MET  23 -21.114   1.706  23.827
  157    H    ASN  24           HN       ASN  24 -26.318   4.795  19.553
  158    HA   ASN  24           HA       ASN  24 -26.152   5.843  22.299
  159    HB2  ASN  24           HB2      ASN  24 -27.195   7.190  19.802
  160    HB3  ASN  24           HB1      ASN  24 -27.552   7.781  21.422
  161   HD21  ASN  24          HD21      ASN  24 -25.960   8.789  22.596
  162   HD22  ASN  24          HD22      ASN  24 -24.433   9.249  21.917
  163    H    GLY  25           HN       GLY  25 -27.597   4.853  23.530
  164    HA2  GLY  25           HA2      GLY  25 -30.018   4.678  23.964
  165    HA3  GLY  25           HA1      GLY  25 -30.183   4.118  22.312
  166    HA   PRO  26           HA       PRO  26 -29.114  -0.044  23.794
  167    HB2  PRO  26           HB2      PRO  26 -26.284  -0.293  23.115
  168    HB3  PRO  26           HB1      PRO  26 -27.675  -1.128  22.422
  169    HG2  PRO  26           HG2      PRO  26 -26.258   0.726  21.054
  170    HG3  PRO  26           HG1      PRO  26 -27.996   0.473  20.799
  171    HD2  PRO  26           HD2      PRO  26 -26.599   2.590  22.396
  172    HD3  PRO  26           HD1      PRO  26 -27.994   2.737  21.309
  173    H    PHE  27           HN       PHE  27 -29.221   0.035  25.978
  174    HA   PHE  27           HA       PHE  27 -26.951   0.952  27.548
  175    HD1  PHE  27           HD2      PHE  27 -27.655   2.781  29.518
  176    HD2  PHE  27           HD1      PHE  27 -31.047   1.525  27.283
  177    HE1  PHE  27           HE2      PHE  27 -28.410   5.118  29.362
  178    HE2  PHE  27           HE1      PHE  27 -31.814   3.855  27.128
  179    HZ   PHE  27           HZ       PHE  27 -30.510   5.653  28.190
  180    HB2  PHE  27           HB2      PHE  27 -29.686  -0.062  28.344
  181    HB3  PHE  27           HB1      PHE  27 -28.452   0.416  29.502
  182    H    GLY  28           HN       GLY  28 -26.124  -1.106  26.095
  183    HA2  GLY  28           HA2      GLY  28 -25.041  -2.902  27.904
  184    HA3  GLY  28           HA1      GLY  28 -26.480  -3.674  27.253
  185    H    HIS  29           HN       HIS  29 -23.225  -3.381  26.869
  186    HA   HIS  29           HA       HIS  29 -23.359  -3.806  23.965
  187    HD1  HIS  29           HD1      HIS  29 -19.156  -4.568  24.423
  188    HD2  HIS  29           HD2      HIS  29 -21.604  -2.305  21.931
  189    HE1  HIS  29           HE1      HIS  29 -18.097  -4.675  22.145
  190    HE2  HIS  29           HE2      HIS  29 -19.691  -3.463  20.623
  191    HB2  HIS  29           HB2      HIS  29 -21.803  -2.041  24.802
  192    HB3  HIS  29           HB1      HIS  29 -20.926  -3.281  25.691
  193    H    GLY  30           HN       GLY  30 -23.245  -5.827  23.246
  194    HA2  GLY  30           HA2      GLY  30 -21.377  -7.721  24.194
  195    HA3  GLY  30           HA1      GLY  30 -22.970  -8.075  24.862
  196    H    TYR  31           HN       TYR  31 -20.967  -8.114  22.067
  197    HA   TYR  31           HA       TYR  31 -23.107  -9.531  20.638
  198    HD1  TYR  31           HD2      TYR  31 -24.696  -8.558  18.690
  199    HD2  TYR  31           HD1      TYR  31 -22.277  -5.442  20.278
  200    HE1  TYR  31           HE2      TYR  31 -26.650  -7.068  18.715
  201    HE2  TYR  31           HE1      TYR  31 -24.225  -3.940  20.316
  202    HH   TYR  31           HH       TYR  31 -26.430  -3.767  19.047
  203    HB2  TYR  31           HB2      TYR  31 -21.271  -7.408  19.527
  204    HB3  TYR  31           HB1      TYR  31 -22.150  -8.537  18.502
  205    H    GLY  32           HN       GLY  32 -22.526 -11.325  19.536
  206    HA2  GLY  32           HA2      GLY  32 -19.902 -12.427  19.957
  207    HA3  GLY  32           HA1      GLY  32 -21.200 -13.148  19.007
  208    H    GLU  33           HN       GLU  33 -18.321 -11.308  18.950
  209    HA   GLU  33           HA       GLU  33 -18.599 -10.227  16.342
  210    HB2  GLU  33           HB2      GLU  33 -17.153  -9.137  17.914
  211    HB3  GLU  33           HB1      GLU  33 -16.248 -10.616  18.195
  212    HG2  GLU  33           HG2      GLU  33 -15.378 -10.542  15.957
  213    HG3  GLU  33           HG1      GLU  33 -16.323  -9.097  15.606
  214    H    GLY  34           HN       GLY  34 -18.495 -11.321  14.520
  215    HA2  GLY  34           HA2      GLY  34 -17.518 -14.068  14.567
  216    HA3  GLY  34           HA1      GLY  34 -18.438 -13.308  13.280
  217    H    ALA  35           HN       ALA  35 -15.783 -14.838  13.504
  218    HA   ALA  35           HA       ALA  35 -13.791 -13.003  12.594
  219    HB1  ALA  35           HB1      ALA  35 -12.509 -15.026  12.035
  220    HB2  ALA  35           HB2      ALA  35 -13.934 -16.010  12.372
  221    HB3  ALA  35           HB3      ALA  35 -13.167 -15.091  13.668
  222    H    GLY  36           HN       GLY  36 -13.169 -12.506  10.537
  223    HA2  GLY  36           HA2      GLY  36 -14.994 -13.386   8.397
  224    HA3  GLY  36           HA1      GLY  36 -14.170 -11.834   8.431
  225    H    GLU  37           HN       GLU  37 -14.221 -14.397   6.672
  226    HA   GLU  37           HA       GLU  37 -11.388 -15.025   6.605
  227    HB2  GLU  37           HB2      GLU  37 -13.169 -16.775   6.305
  228    HB3  GLU  37           HB1      GLU  37 -13.593 -16.009   4.784
  229    HG2  GLU  37           HG2      GLU  37 -11.396 -16.490   3.893
  230    HG3  GLU  37           HG1      GLU  37 -10.901 -17.181   5.435
  231    H    GLY  38           HN       GLY  38 -10.492 -15.116   4.206
  232    HA2  GLY  38           HA2      GLY  38 -10.430 -12.350   3.430
  233    HA3  GLY  38           HA1      GLY  38  -9.445 -13.637   2.756
  234    H    ILE  39           HN       ILE  39 -12.577 -12.103   2.676
  235    HA   ILE  39           HA       ILE  39 -13.394 -13.339   0.264
  236    HB   ILE  39           HB       ILE  39 -14.647 -10.939   0.101
  237   HG12  ILE  39          HG12      ILE  39 -15.346 -10.273   2.388
  238   HG13  ILE  39          HG11      ILE  39 -14.166 -11.387   3.063
  239   HG21  ILE  39          HG21      ILE  39 -15.734 -13.089   0.091
  240   HG22  ILE  39          HG22      ILE  39 -16.541 -12.019   1.237
  241   HG23  ILE  39          HG23      ILE  39 -15.447 -13.276   1.821
  242   HD11  ILE  39          HD11      ILE  39 -13.373  -9.097   3.129
  243   HD12  ILE  39          HD12      ILE  39 -13.555  -8.964   1.382
  244   HD13  ILE  39          HD13      ILE  39 -12.367 -10.076   2.066
  245    H    ASP  40           HN       ASP  40 -13.284 -12.450  -1.886
  246    HA   ASP  40           HA       ASP  40 -10.724 -11.240  -2.346
  247    HB2  ASP  40           HB2      ASP  40 -12.877 -12.299  -4.139
  248    HB3  ASP  40           HB1      ASP  40 -11.589 -11.299  -4.808
  249    H    ASP  41           HN       ASP  41 -11.306  -9.342  -1.084
  250    HA   ASP  41           HA       ASP  41 -12.252  -7.241  -2.922
  251    HB2  ASP  41           HB2      ASP  41 -12.942  -7.510   0.015
  252    HB3  ASP  41           HB1      ASP  41 -13.223  -6.053  -0.927
  253    H    VAL  42           HN       VAL  42 -10.248  -6.476  -3.411
  254    HA   VAL  42           HA       VAL  42  -8.575  -5.620  -1.140
  255    HB   VAL  42           HB       VAL  42  -7.590  -6.574  -3.836
  256   HG11  VAL  42          HG11      VAL  42  -5.356  -6.482  -2.802
  257   HG12  VAL  42          HG12      VAL  42  -6.066  -5.761  -1.360
  258   HG13  VAL  42          HG13      VAL  42  -6.117  -4.895  -2.895
  259   HG21  VAL  42          HG21      VAL  42  -7.487  -7.936  -1.147
  260   HG22  VAL  42          HG22      VAL  42  -6.715  -8.519  -2.623
  261   HG23  VAL  42          HG23      VAL  42  -8.474  -8.418  -2.525
  262    H    GLU  43           HN       GLU  43  -8.368  -3.492  -1.018
  263    HA   GLU  43           HA       GLU  43  -8.531  -1.924  -3.504
  264    HB2  GLU  43           HB2      GLU  43 -10.523  -1.556  -2.142
  265    HB3  GLU  43           HB1      GLU  43  -9.525  -1.164  -0.747
  266    HG2  GLU  43           HG2      GLU  43  -8.609   0.760  -2.065
  267    HG3  GLU  43           HG1      GLU  43  -9.830   0.419  -3.291
  268    H    TRP  44           HN       TRP  44  -6.290  -1.799  -3.809
  269    HA   TRP  44           HA       TRP  44  -5.055   0.125  -1.967
  270    HD1  TRP  44           HD1      TRP  44  -3.270   1.362  -1.871
  271    HE1  TRP  44           HE1      TRP  44  -0.892   1.876  -1.042
  272    HE3  TRP  44           HE3      TRP  44  -1.244  -3.258  -2.307
  273    HZ2  TRP  44           HZ2      TRP  44   1.545   0.479  -0.697
  274    HZ3  TRP  44           HZ3      TRP  44   1.124  -3.584  -1.756
  275    HH2  TRP  44           HH2      TRP  44   2.492  -1.717  -0.924
  276    HB2  TRP  44           HB2      TRP  44  -3.945  -2.181  -1.922
  277    HB3  TRP  44           HB1      TRP  44  -3.431  -1.838  -3.579
  278    H    VAL  45           HN       VAL  45  -4.195   1.876  -2.850
  279    HA   VAL  45           HA       VAL  45  -4.871   2.515  -5.559
  280    HB   VAL  45           HB       VAL  45  -3.216   4.185  -3.676
  281   HG11  VAL  45          HG11      VAL  45  -4.310   6.065  -4.880
  282   HG12  VAL  45          HG12      VAL  45  -5.060   4.887  -5.957
  283   HG13  VAL  45          HG13      VAL  45  -3.305   5.053  -5.918
  284   HG21  VAL  45          HG21      VAL  45  -5.196   3.457  -2.459
  285   HG22  VAL  45          HG22      VAL  45  -6.228   3.998  -3.782
  286   HG23  VAL  45          HG23      VAL  45  -5.302   5.175  -2.847
  287    H    VAL  46           HN       VAL  46  -2.266   0.873  -4.248
  288    HA   VAL  46           HA       VAL  46  -0.303   2.096  -6.017
  289    HB   VAL  46           HB       VAL  46   0.013  -0.155  -3.961
  290   HG11  VAL  46          HG11      VAL  46   2.020   1.130  -5.813
  291   HG12  VAL  46          HG12      VAL  46   1.689  -0.590  -5.586
  292   HG13  VAL  46          HG13      VAL  46   2.476   0.344  -4.301
  293   HG21  VAL  46          HG21      VAL  46  -0.313   1.989  -2.956
  294   HG22  VAL  46          HG22      VAL  46   0.876   2.730  -4.034
  295   HG23  VAL  46          HG23      VAL  46   1.391   1.548  -2.830
  296    H    GLY  47           HN       GLY  47  -2.443  -0.596  -6.088
  297    HA2  GLY  47           HA2      GLY  47  -0.983  -2.177  -7.938
  298    HA3  GLY  47           HA1      GLY  47  -2.736  -2.231  -7.692
  299    H    LYS  48           HN       LYS  48  -2.431   0.841  -8.277
  300    HA   LYS  48           HA       LYS  48  -2.625   0.541 -11.185
  301    HB2  LYS  48           HB2      LYS  48  -3.842   2.746 -11.009
  302    HB3  LYS  48           HB1      LYS  48  -4.674   1.345 -10.362
  303    HG2  LYS  48           HG2      LYS  48  -4.035   2.029  -8.109
  304    HG3  LYS  48           HG1      LYS  48  -3.181   3.420  -8.776
  305    HD2  LYS  48           HD2      LYS  48  -6.130   2.889  -9.127
  306    HD3  LYS  48           HD1      LYS  48  -5.446   3.972  -7.915
  307    HE2  LYS  48           HE2      LYS  48  -4.525   5.389  -9.634
  308    HE3  LYS  48           HE1      LYS  48  -5.034   4.259 -10.884
  309    HZ1  LYS  48           HZ1      LYS  48  -6.885   5.741  -9.099
  310    HZ2  LYS  48           HZ2      LYS  48  -7.324   4.717 -10.371
  311    HZ3  LYS  48           HZ3      LYS  48  -6.523   6.175 -10.698
  312    H    ASP  49           HN       ASP  49  -0.913   2.193  -8.654
  313    HA   ASP  49           HA       ASP  49   0.258   4.054 -10.611
  314    HB2  ASP  49           HB2      ASP  49  -1.012   4.901  -8.531
  315    HB3  ASP  49           HB1      ASP  49   0.391   4.365  -7.617
  316    H    LYS  50           HN       LYS  50   0.877   1.201  -9.463
  317    HA   LYS  50           HA       LYS  50   3.367   1.242  -8.235
  318    HB2  LYS  50           HB2      LYS  50   1.780  -0.702  -8.350
  319    HB3  LYS  50           HB1      LYS  50   2.320  -0.952 -10.007
  320    HG2  LYS  50           HG2      LYS  50   4.629  -1.189  -9.178
  321    HG3  LYS  50           HG1      LYS  50   4.011  -1.069  -7.526
  322    HD2  LYS  50           HD2      LYS  50   2.663  -3.057  -7.870
  323    HD3  LYS  50           HD1      LYS  50   3.222  -3.163  -9.544
  324    HE2  LYS  50           HE2      LYS  50   5.502  -3.458  -8.788
  325    HE3  LYS  50           HE1      LYS  50   4.989  -3.277  -7.113
  326    HZ1  LYS  50           HZ1      LYS  50   5.334  -5.605  -7.949
  327    HZ2  LYS  50           HZ2      LYS  50   3.921  -5.406  -8.861
  328    HZ3  LYS  50           HZ3      LYS  50   3.855  -5.303  -7.167
  329    HA   PRO  51           HA       PRO  51   4.997   0.502 -12.930
  330    HB2  PRO  51           HB2      PRO  51   3.833   2.721 -14.280
  331    HB3  PRO  51           HB1      PRO  51   3.618   1.000 -14.642
  332    HG2  PRO  51           HG2      PRO  51   1.887   2.844 -13.096
  333    HG3  PRO  51           HG1      PRO  51   1.451   1.405 -14.037
  334    HD2  PRO  51           HD2      PRO  51   1.439   1.388 -11.360
  335    HD3  PRO  51           HD1      PRO  51   1.955  -0.037 -12.288
  336    H    THR  52           HN       THR  52   4.107   3.490 -11.286
  337    HA   THR  52           HA       THR  52   6.395   4.963 -12.196
  338    HB   THR  52           HB       THR  52   4.475   5.481  -9.908
  339    HG1  THR  52           HG1      THR  52   4.320   5.826 -12.602
  340   HG21  THR  52          HG21      THR  52   5.305   7.777  -9.953
  341   HG22  THR  52          HG22      THR  52   6.498   7.324 -11.173
  342   HG23  THR  52          HG23      THR  52   6.591   6.640  -9.550
  343    H    TYR  53           HN       TYR  53   5.554   3.078  -9.342
  344    HA   TYR  53           HA       TYR  53   7.874   3.934  -7.865
  345    HD1  TYR  53           HD2      TYR  53   6.272   5.261  -6.789
  346    HD2  TYR  53           HD1      TYR  53   3.988   1.692  -6.529
  347    HE1  TYR  53           HE2      TYR  53   4.282   6.581  -6.190
  348    HE2  TYR  53           HE1      TYR  53   1.996   2.996  -5.942
  349    HH   TYR  53           HH       TYR  53   1.667   6.152  -6.468
  350    HB2  TYR  53           HB2      TYR  53   6.115   1.567  -7.321
  351    HB3  TYR  53           HB1      TYR  53   7.092   2.456  -6.172
  352    H    ASP  54           HN       ASP  54   6.930   1.276  -9.912
  353    HA   ASP  54           HA       ASP  54   9.236  -0.330  -9.143
  354    HB2  ASP  54           HB2      ASP  54   8.149  -2.047 -10.104
  355    HB3  ASP  54           HB1      ASP  54   6.756  -0.986 -10.030
  356    H    GLU  55           HN       GLU  55   8.312   1.894 -11.728
  357    HA   GLU  55           HA       GLU  55  10.515   1.310 -13.418
  358    HB2  GLU  55           HB2      GLU  55  10.098   3.393 -14.538
  359    HB3  GLU  55           HB1      GLU  55   8.546   2.672 -14.155
  360    HG2  GLU  55           HG2      GLU  55   8.240   4.190 -12.311
  361    HG3  GLU  55           HG1      GLU  55   9.858   4.864 -12.563
  362    H    ILE  56           HN       ILE  56  10.095   3.598 -10.723
  363    HA   ILE  56           HA       ILE  56  12.766   4.568 -10.880
  364    HB   ILE  56           HB       ILE  56  11.014   4.471  -8.414
  365   HG12  ILE  56          HG12      ILE  56  11.297   6.720 -10.416
  366   HG13  ILE  56          HG11      ILE  56   9.959   5.575 -10.424
  367   HG21  ILE  56          HG21      ILE  56  12.369   6.383  -7.683
  368   HG22  ILE  56          HG22      ILE  56  13.345   6.248  -9.144
  369   HG23  ILE  56          HG23      ILE  56  13.365   4.952  -7.946
  370   HD11  ILE  56          HD11      ILE  56  10.648   7.442  -8.164
  371   HD12  ILE  56          HD12      ILE  56   9.276   6.333  -8.226
  372   HD13  ILE  56          HD13      ILE  56   9.370   7.687  -9.355
  373    H    PHE  57           HN       PHE  57  11.220   1.862  -9.309
  374    HA   PHE  57           HA       PHE  57  13.233   0.903  -7.673
  375    HD1  PHE  57           HD2      PHE  57  12.695  -1.073  -5.959
  376    HD2  PHE  57           HD1      PHE  57  11.757  -2.733  -9.757
  377    HE1  PHE  57           HE2      PHE  57  13.446  -3.284  -5.182
  378    HE2  PHE  57           HE1      PHE  57  12.489  -4.946  -8.985
  379    HZ   PHE  57           HZ       PHE  57  13.339  -5.223  -6.684
  380    HB2  PHE  57           HB2      PHE  57  11.010  -0.030  -7.659
  381    HB3  PHE  57           HB1      PHE  57  11.171  -0.567  -9.322
  382    H    TYR  58           HN       TYR  58  12.649   0.028 -11.095
  383    HA   TYR  58           HA       TYR  58  15.115  -1.413 -11.300
  384    HD1  TYR  58           HD2      TYR  58  14.931  -3.629 -13.327
  385    HD2  TYR  58           HD1      TYR  58  11.307  -1.654 -12.298
  386    HE1  TYR  58           HE2      TYR  58  13.834  -5.807 -13.039
  387    HE2  TYR  58           HE1      TYR  58  10.197  -3.832 -12.004
  388    HH   TYR  58           HH       TYR  58  10.450  -6.140 -12.784
  389    HB2  TYR  58           HB2      TYR  58  13.136  -0.441 -13.352
  390    HB3  TYR  58           HB1      TYR  58  14.627  -1.267 -13.802
  391    H    THR  59           HN       THR  59  14.207   1.883 -11.661
  392    HA   THR  59           HA       THR  59  16.336   2.772 -13.294
  393    HB   THR  59           HB       THR  59  14.581   4.197 -11.289
  394    HG1  THR  59           HG1      THR  59  13.554   3.489 -13.197
  395   HG21  THR  59          HG21      THR  59  16.722   5.402 -11.497
  396   HG22  THR  59          HG22      THR  59  15.365   6.304 -12.168
  397   HG23  THR  59          HG23      THR  59  16.487   5.473 -13.244
  398    H    LEU  60           HN       LEU  60  15.999   2.262  -9.834
  399    HA   LEU  60           HA       LEU  60  18.581   3.422  -9.248
  400    HG   LEU  60           HG       LEU  60  15.861   4.279  -8.087
  401    HB2  LEU  60           HB2      LEU  60  16.527   2.010  -7.562
  402    HB3  LEU  60           HB1      LEU  60  18.066   2.578  -6.921
  403   HD11  LEU  60          HD11      LEU  60  15.441   3.415  -5.841
  404   HD12  LEU  60          HD12      LEU  60  15.715   5.155  -5.824
  405   HD13  LEU  60          HD13      LEU  60  16.992   4.055  -5.303
  406   HD21  LEU  60          HD21      LEU  60  18.552   5.092  -6.988
  407   HD22  LEU  60          HD22      LEU  60  17.257   6.189  -7.476
  408   HD23  LEU  60          HD23      LEU  60  18.060   5.177  -8.677
  409    H    SER  61           HN       SER  61  17.588   0.554 -10.506
  410    HA   SER  61           HA       SER  61  18.563  -1.437 -10.914
  411    HG   SER  61           HG       SER  61  20.488  -2.551 -11.209
  412    HB2  SER  61           HB2      SER  61  20.627  -0.078 -11.283
  413    HB3  SER  61           HB1      SER  61  21.043  -0.314  -9.584
  414    HA   PRO  62           HA       PRO  62  17.732  -3.098  -6.788
  415    HB2  PRO  62           HB2      PRO  62  16.067  -5.061  -7.732
  416    HB3  PRO  62           HB1      PRO  62  15.539  -3.443  -7.263
  417    HG2  PRO  62           HG2      PRO  62  15.763  -4.629  -9.931
  418    HG3  PRO  62           HG1      PRO  62  14.873  -3.188  -9.410
  419    HD2  PRO  62           HD2      PRO  62  17.369  -3.312 -10.790
  420    HD3  PRO  62           HD1      PRO  62  16.494  -1.876 -10.230
  421    H    VAL  63           HN       VAL  63  18.784  -4.732  -5.817
  422    HA   VAL  63           HA       VAL  63  20.269  -6.602  -7.496
  423    HB   VAL  63           HB       VAL  63  21.576  -7.070  -5.406
  424   HG11  VAL  63          HG11      VAL  63  22.448  -5.607  -7.117
  425   HG12  VAL  63          HG12      VAL  63  22.883  -4.990  -5.522
  426   HG13  VAL  63          HG13      VAL  63  21.571  -4.242  -6.430
  427   HG21  VAL  63          HG21      VAL  63  20.093  -4.660  -4.358
  428   HG22  VAL  63          HG22      VAL  63  21.470  -5.444  -3.578
  429   HG23  VAL  63          HG23      VAL  63  19.946  -6.312  -3.758
  430    H    ASN  64           HN       ASN  64  19.593  -8.581  -7.713
  431    HA   ASN  64           HA       ASN  64  18.659 -10.611  -7.321
  432    HB2  ASN  64           HB2      ASN  64  18.932  -9.775  -4.422
  433    HB3  ASN  64           HB1      ASN  64  18.502 -11.404  -4.962
  434   HD21  ASN  64          HD21      ASN  64  21.022  -9.044  -4.669
  435   HD22  ASN  64          HD22      ASN  64  22.342 -10.098  -5.045
  436    H    GLY  65           HN       GLY  65  16.997  -8.103  -7.521
  437    HA2  GLY  65           HA2      GLY  65  14.687  -8.113  -7.992
  438    HA3  GLY  65           HA1      GLY  65  14.488  -9.470  -6.903
  439    H    LYS  66           HN       LYS  66  16.356  -6.977  -5.542
  440    HA   LYS  66           HA       LYS  66  14.124  -5.356  -4.700
  441    HB2  LYS  66           HB2      LYS  66  14.522  -5.595  -2.293
  442    HB3  LYS  66           HB1      LYS  66  13.991  -7.112  -3.009
  443    HG2  LYS  66           HG2      LYS  66  16.889  -6.507  -2.564
  444    HG3  LYS  66           HG1      LYS  66  15.873  -7.205  -1.301
  445    HD2  LYS  66           HD2      LYS  66  16.023  -8.379  -4.043
  446    HD3  LYS  66           HD1      LYS  66  17.188  -8.814  -2.796
  447    HE2  LYS  66           HE2      LYS  66  15.527  -9.754  -1.427
  448    HE3  LYS  66           HE1      LYS  66  14.225  -8.968  -2.319
  449    HZ1  LYS  66           HZ1      LYS  66  15.983 -11.072  -3.450
  450    HZ2  LYS  66           HZ2      LYS  66  14.610 -10.405  -4.170
  451    HZ3  LYS  66           HZ3      LYS  66  14.449 -11.367  -2.788
  452    H    ILE  67           HN       ILE  67  14.795  -3.342  -3.801
  453    HA   ILE  67           HA       ILE  67  17.500  -2.622  -4.501
  454    HB   ILE  67           HB       ILE  67  16.884  -0.353  -3.524
  455   HG12  ILE  67          HG12      ILE  67  14.236  -1.795  -3.236
  456   HG13  ILE  67          HG11      ILE  67  15.156  -0.962  -1.993
  457   HG21  ILE  67          HG21      ILE  67  15.127  -1.503  -5.731
  458   HG22  ILE  67          HG22      ILE  67  16.752  -0.838  -5.929
  459   HG23  ILE  67          HG23      ILE  67  15.422   0.213  -5.439
  460   HD11  ILE  67          HD11      ILE  67  13.731   0.303  -4.323
  461   HD12  ILE  67          HD12      ILE  67  14.693   1.171  -3.122
  462   HD13  ILE  67          HD13      ILE  67  13.222   0.328  -2.633
  463    H    THR  68           HN       THR  68  19.189  -2.472  -3.199
  464    HA   THR  68           HA       THR  68  19.208  -3.166  -0.496
  465    HB   THR  68           HB       THR  68  21.340  -1.599  -0.557
  466    HG1  THR  68           HG1      THR  68  22.089  -1.310  -2.705
  467   HG21  THR  68          HG21      THR  68  21.139  -4.147  -2.179
  468   HG22  THR  68          HG22      THR  68  21.424  -4.036  -0.442
  469   HG23  THR  68          HG23      THR  68  22.634  -3.431  -1.570
  470    H    GLY  69           HN       GLY  69  18.686  -2.003   1.303
  471    HA2  GLY  69           HA2      GLY  69  16.767  -0.065   1.070
  472    HA3  GLY  69           HA1      GLY  69  17.687  -0.351   2.526
  473    H    ALA  70           HN       ALA  70  20.218   0.436   1.234
  474    HA   ALA  70           HA       ALA  70  20.424   3.090   1.947
  475    HB1  ALA  70           HB1      ALA  70  22.050   1.665  -0.148
  476    HB2  ALA  70           HB2      ALA  70  22.330   1.608   1.592
  477    HB3  ALA  70           HB3      ALA  70  22.516   3.128   0.717
  478    H    ASN  71           HN       ASN  71  19.412   1.800  -1.207
  479    HA   ASN  71           HA       ASN  71  19.610   4.423  -2.422
  480    HB2  ASN  71           HB2      ASN  71  18.930   3.404  -4.489
  481    HB3  ASN  71           HB1      ASN  71  20.087   2.331  -3.724
  482   HD21  ASN  71          HD21      ASN  71  19.644   0.315  -3.750
  483   HD22  ASN  71          HD22      ASN  71  18.073  -0.377  -3.888
  484    H    ALA  72           HN       ALA  72  17.138   2.342  -1.108
  485    HA   ALA  72           HA       ALA  72  14.904   3.880  -1.972
  486    HB1  ALA  72           HB1      ALA  72  15.177   2.002   0.372
  487    HB2  ALA  72           HB2      ALA  72  14.657   1.566  -1.258
  488    HB3  ALA  72           HB3      ALA  72  13.662   2.635  -0.272
  489    H    LYS  73           HN       LYS  73  17.002   3.858   0.818
  490    HA   LYS  73           HA       LYS  73  15.653   5.870   2.294
  491    HB2  LYS  73           HB2      LYS  73  18.587   5.129   2.309
  492    HB3  LYS  73           HB1      LYS  73  17.795   6.144   3.502
  493    HG2  LYS  73           HG2      LYS  73  17.271   3.234   2.979
  494    HG3  LYS  73           HG1      LYS  73  18.060   3.933   4.394
  495    HD2  LYS  73           HD2      LYS  73  15.239   4.634   3.611
  496    HD3  LYS  73           HD1      LYS  73  15.614   3.247   4.637
  497    HE2  LYS  73           HE2      LYS  73  16.667   4.695   6.260
  498    HE3  LYS  73           HE1      LYS  73  16.409   6.098   5.221
  499    HZ1  LYS  73           HZ1      LYS  73  14.253   4.427   6.397
  500    HZ2  LYS  73           HZ2      LYS  73  14.042   5.833   5.483
  501    HZ3  LYS  73           HZ3      LYS  73  14.768   5.917   7.015
  502    H    LYS  74           HN       LYS  74  18.128   5.889  -0.196
  503    HA   LYS  74           HA       LYS  74  18.825   8.578  -0.242
  504    HB2  LYS  74           HB2      LYS  74  19.706   6.586  -1.639
  505    HB3  LYS  74           HB1      LYS  74  18.393   6.968  -2.744
  506    HG2  LYS  74           HG2      LYS  74  20.388   8.015  -3.521
  507    HG3  LYS  74           HG1      LYS  74  19.290   9.269  -2.929
  508    HD2  LYS  74           HD2      LYS  74  21.528   9.728  -2.145
  509    HD3  LYS  74           HD1      LYS  74  20.514   9.268  -0.779
  510    HE2  LYS  74           HE2      LYS  74  22.605   8.135  -0.536
  511    HE3  LYS  74           HE1      LYS  74  21.397   6.945  -1.002
  512    HZ1  LYS  74           HZ1      LYS  74  22.208   7.206  -3.326
  513    HZ2  LYS  74           HZ2      LYS  74  23.347   6.537  -2.270
  514    HZ3  LYS  74           HZ3      LYS  74  23.479   8.162  -2.738
  515    H    GLU  75           HN       GLU  75  16.214   6.883  -1.887
  516    HA   GLU  75           HA       GLU  75  15.149   9.121  -3.201
  517    HB2  GLU  75           HB2      GLU  75  13.759   6.572  -2.405
  518    HB3  GLU  75           HB1      GLU  75  13.113   7.767  -3.523
  519    HG2  GLU  75           HG2      GLU  75  15.305   5.800  -3.908
  520    HG3  GLU  75           HG1      GLU  75  13.997   6.277  -4.987
  521    H    MET  76           HN       MET  76  14.060   7.575  -0.181
  522    HA   MET  76           HA       MET  76  12.012   9.498   0.231
  523    HB2  MET  76           HB2      MET  76  12.033   8.589   2.616
  524    HB3  MET  76           HB1      MET  76  11.665   7.457   1.323
  525    HG2  MET  76           HG2      MET  76  13.906   6.578   1.406
  526    HG3  MET  76           HG1      MET  76  14.353   7.763   2.625
  527    HE1  MET  76           HE1      MET  76  11.004   5.529   2.365
  528    HE2  MET  76           HE2      MET  76  11.578   4.129   3.269
  529    HE3  MET  76           HE3      MET  76  12.358   4.578   1.751
  530    H    VAL  77           HN       VAL  77  15.413   9.503   0.967
  531    HA   VAL  77           HA       VAL  77  15.343  11.709   2.789
  532    HB   VAL  77           HB       VAL  77  17.563  10.547   1.116
  533   HG11  VAL  77          HG11      VAL  77  17.741  12.958   2.931
  534   HG12  VAL  77          HG12      VAL  77  18.040  12.919   1.190
  535   HG13  VAL  77          HG13      VAL  77  19.125  12.071   2.291
  536   HG21  VAL  77          HG21      VAL  77  16.883   9.298   3.091
  537   HG22  VAL  77          HG22      VAL  77  17.128  10.730   4.093
  538   HG23  VAL  77          HG23      VAL  77  18.502   9.966   3.295
  539    H    LYS  78           HN       LYS  78  15.978  11.513  -0.734
  540    HA   LYS  78           HA       LYS  78  16.292  14.338  -1.007
  541    HB2  LYS  78           HB2      LYS  78  16.499  13.989  -3.325
  542    HB3  LYS  78           HB1      LYS  78  17.162  12.534  -2.597
  543    HG2  LYS  78           HG2      LYS  78  14.443  12.003  -2.996
  544    HG3  LYS  78           HG1      LYS  78  14.995  12.831  -4.452
  545    HD2  LYS  78           HD2      LYS  78  16.382  10.456  -3.227
  546    HD3  LYS  78           HD1      LYS  78  15.190  10.341  -4.524
  547    HE2  LYS  78           HE2      LYS  78  16.675  11.869  -5.854
  548    HE3  LYS  78           HE1      LYS  78  17.889  11.667  -4.588
  549    HZ1  LYS  78           HZ1      LYS  78  18.410  10.050  -6.173
  550    HZ2  LYS  78           HZ2      LYS  78  16.786   9.632  -6.425
  551    HZ3  LYS  78           HZ3      LYS  78  17.554   9.180  -4.992
  552    H    SER  79           HN       SER  79  13.617  12.394  -0.532
  553    HA   SER  79           HA       SER  79  11.629  13.977  -1.811
  554    HG   SER  79           HG       SER  79   9.571  12.575  -1.667
  555    HB2  SER  79           HB2      SER  79  11.417  11.567  -0.988
  556    HB3  SER  79           HB1      SER  79  11.198  12.254   0.624
  557    H    LYS  80           HN       LYS  80  13.682  14.696   0.674
  558    HA   LYS  80           HA       LYS  80  13.925  16.648   1.797
  559    HB2  LYS  80           HB2      LYS  80  11.210  17.400   0.677
  560    HB3  LYS  80           HB1      LYS  80  12.363  18.496   1.439
  561    HG2  LYS  80           HG2      LYS  80  13.865  18.344  -0.353
  562    HG3  LYS  80           HG1      LYS  80  13.086  16.895  -0.991
  563    HD2  LYS  80           HD2      LYS  80  11.088  18.249  -1.524
  564    HD3  LYS  80           HD1      LYS  80  11.943  19.691  -0.968
  565    HE2  LYS  80           HE2      LYS  80  12.056  19.489  -3.393
  566    HE3  LYS  80           HE1      LYS  80  13.659  19.329  -2.677
  567    HZ1  LYS  80           HZ1      LYS  80  11.933  17.164  -3.747
  568    HZ2  LYS  80           HZ2      LYS  80  13.319  16.869  -2.822
  569    HZ3  LYS  80           HZ3      LYS  80  13.458  17.654  -4.316
  570    H    LEU  81           HN       LEU  81  13.663  14.930   3.482
  571    HA   LEU  81           HA       LEU  81  11.531  15.741   5.335
  572    HG   LEU  81           HG       LEU  81  10.989  13.781   2.985
  573    HB2  LEU  81           HB2      LEU  81  12.373  12.880   4.938
  574    HB3  LEU  81           HB1      LEU  81  11.097  13.473   5.970
  575   HD11  LEU  81          HD11      LEU  81  11.208  11.412   3.511
  576   HD12  LEU  81          HD12      LEU  81   9.574  11.790   2.968
  577   HD13  LEU  81          HD13      LEU  81   9.898  11.544   4.682
  578   HD21  LEU  81          HD21      LEU  81   8.919  13.875   5.179
  579   HD22  LEU  81          HD22      LEU  81   8.563  13.944   3.454
  580   HD23  LEU  81          HD23      LEU  81   9.499  15.233   4.212
  581    HA   PRO  82           HA       PRO  82  14.804  15.208   8.406
  582    HB2  PRO  82           HB2      PRO  82  13.298  14.882  10.619
  583    HB3  PRO  82           HB1      PRO  82  13.465  16.459   9.821
  584    HG2  PRO  82           HG2      PRO  82  11.224  14.484   9.664
  585    HG3  PRO  82           HG1      PRO  82  11.154  16.246   9.786
  586    HD2  PRO  82           HD2      PRO  82  10.845  14.852   7.458
  587    HD3  PRO  82           HD1      PRO  82  11.427  16.533   7.535
  588    H    ASN  83           HN       ASN  83  15.422  13.582  10.086
  589    HA   ASN  83           HA       ASN  83  15.419  11.016   8.920
  590    HB2  ASN  83           HB2      ASN  83  16.285  11.919  11.667
  591    HB3  ASN  83           HB1      ASN  83  16.562  10.298  11.033
  592   HD21  ASN  83          HD21      ASN  83  17.037  11.222   8.325
  593   HD22  ASN  83          HD22      ASN  83  18.605  11.946   8.328
  594    H    THR  84           HN       THR  84  13.385  12.425  11.357
  595    HA   THR  84           HA       THR  84  12.329  10.115  12.531
  596    HB   THR  84           HB       THR  84  10.404  12.277  12.190
  597    HG1  THR  84           HG1      THR  84  11.936  13.629  13.603
  598   HG21  THR  84          HG21      THR  84  10.452  12.223  14.640
  599   HG22  THR  84          HG22      THR  84  11.855  11.158  14.595
  600   HG23  THR  84          HG23      THR  84  10.303  10.594  13.975
  601    H    VAL  85           HN       VAL  85  11.035  12.095   9.859
  602    HA   VAL  85           HA       VAL  85   8.892  10.389   9.187
  603    HB   VAL  85           HB       VAL  85  10.367  12.232   7.297
  604   HG11  VAL  85          HG11      VAL  85   7.538  11.195   7.327
  605   HG12  VAL  85          HG12      VAL  85   8.814  10.744   6.194
  606   HG13  VAL  85          HG13      VAL  85   8.176  12.389   6.196
  607   HG21  VAL  85          HG21      VAL  85   8.770  13.957   7.975
  608   HG22  VAL  85          HG22      VAL  85   9.766  13.436   9.333
  609   HG23  VAL  85          HG23      VAL  85   8.105  12.868   9.190
  610    H    LEU  86           HN       LEU  86  12.205  10.635   7.975
  611    HA   LEU  86           HA       LEU  86  12.301   8.681   6.058
  612    HG   LEU  86           HG       LEU  86  15.647  10.141   6.168
  613    HB2  LEU  86           HB2      LEU  86  14.179   9.823   8.007
  614    HB3  LEU  86           HB1      LEU  86  14.624   8.226   7.406
  615   HD11  LEU  86          HD11      LEU  86  13.843   8.351   4.566
  616   HD12  LEU  86          HD12      LEU  86  15.428   7.915   5.206
  617   HD13  LEU  86          HD13      LEU  86  15.290   9.175   3.979
  618   HD21  LEU  86          HD21      LEU  86  12.827  10.577   5.207
  619   HD22  LEU  86          HD22      LEU  86  14.270  11.367   4.568
  620   HD23  LEU  86          HD23      LEU  86  13.754  11.675   6.226
  621    H    GLY  87           HN       GLY  87  12.640   8.251   9.570
  622    HA2  GLY  87           HA2      GLY  87  13.125   5.467   9.421
  623    HA3  GLY  87           HA1      GLY  87  12.675   6.355  10.867
  624    H    LYS  88           HN       LYS  88  10.129   7.294  10.074
  625    HA   LYS  88           HA       LYS  88   8.729   4.848  10.592
  626    HB2  LYS  88           HB2      LYS  88   6.761   6.152  10.949
  627    HB3  LYS  88           HB1      LYS  88   8.108   7.001  11.681
  628    HG2  LYS  88           HG2      LYS  88   8.149   8.626   9.982
  629    HG3  LYS  88           HG1      LYS  88   7.080   7.673   8.946
  630    HD2  LYS  88           HD2      LYS  88   5.259   7.957  10.563
  631    HD3  LYS  88           HD1      LYS  88   6.330   8.891  11.608
  632    HE2  LYS  88           HE2      LYS  88   6.539  10.600   9.895
  633    HE3  LYS  88           HE1      LYS  88   5.523   9.658   8.808
  634    HZ1  LYS  88           HZ1      LYS  88   4.531  10.464  11.462
  635    HZ2  LYS  88           HZ2      LYS  88   3.639  10.066  10.083
  636    HZ3  LYS  88           HZ3      LYS  88   4.467  11.543  10.172
  637    H    ILE  89           HN       ILE  89   9.121   6.931   7.796
  638    HA   ILE  89           HA       ILE  89   7.163   5.677   6.180
  639    HB   ILE  89           HB       ILE  89   9.720   7.104   5.441
  640   HG12  ILE  89          HG12      ILE  89   6.802   7.859   5.308
  641   HG13  ILE  89          HG11      ILE  89   8.031   8.548   6.365
  642   HG21  ILE  89          HG21      ILE  89   7.595   6.061   3.574
  643   HG22  ILE  89          HG22      ILE  89   9.257   5.484   3.700
  644   HG23  ILE  89          HG23      ILE  89   8.935   7.120   3.124
  645   HD11  ILE  89          HD11      ILE  89   7.966   8.772   3.369
  646   HD12  ILE  89          HD12      ILE  89   9.188   9.463   4.436
  647   HD13  ILE  89          HD13      ILE  89   7.521  10.031   4.522
  648    H    TRP  90           HN       TRP  90  10.618   5.125   6.660
  649    HA   TRP  90           HA       TRP  90  11.019   2.983   4.976
  650    HD1  TRP  90           HD1      TRP  90  13.112   1.148   8.488
  651    HE1  TRP  90           HE1      TRP  90  14.491  -0.739   7.388
  652    HE3  TRP  90           HE3      TRP  90  13.142   2.849   3.661
  653    HZ2  TRP  90           HZ2      TRP  90  15.449  -1.412   4.835
  654    HZ3  TRP  90           HZ3      TRP  90  14.315   1.511   1.958
  655    HH2  TRP  90           HH2      TRP  90  15.439  -0.569   2.535
  656    HB2  TRP  90           HB2      TRP  90  12.833   4.038   6.219
  657    HB3  TRP  90           HB1      TRP  90  12.192   3.401   7.723
  658    H    LYS  91           HN       LYS  91  10.054   2.852   8.400
  659    HA   LYS  91           HA       LYS  91   9.912  -0.007   8.328
  660    HB2  LYS  91           HB2      LYS  91   9.191   1.980  10.427
  661    HB3  LYS  91           HB1      LYS  91   9.157   0.248  10.678
  662    HG2  LYS  91           HG2      LYS  91  11.574   0.274   9.994
  663    HG3  LYS  91           HG1      LYS  91  11.504   2.024  10.158
  664    HD2  LYS  91           HD2      LYS  91  10.749   1.777  12.471
  665    HD3  LYS  91           HD1      LYS  91  10.858   0.021  12.308
  666    HE2  LYS  91           HE2      LYS  91  12.852   0.619  13.345
  667    HE3  LYS  91           HE1      LYS  91  13.288   0.412  11.657
  668    HZ1  LYS  91           HZ1      LYS  91  13.186   2.796  11.358
  669    HZ2  LYS  91           HZ2      LYS  91  14.288   2.396  12.573
  670    HZ3  LYS  91           HZ3      LYS  91  12.764   3.017  12.984
  671    H    LEU  92           HN       LEU  92   7.748   2.421   7.489
  672    HA   LEU  92           HA       LEU  92   5.397   0.827   8.099
  673    HG   LEU  92           HG       LEU  92   3.189   2.001   7.618
  674    HB2  LEU  92           HB2      LEU  92   5.789   3.538   7.778
  675    HB3  LEU  92           HB1      LEU  92   5.033   3.072   6.255
  676   HD11  LEU  92          HD11      LEU  92   2.941   2.819   9.945
  677   HD12  LEU  92          HD12      LEU  92   4.571   3.489   9.851
  678   HD13  LEU  92          HD13      LEU  92   4.327   1.745   9.726
  679   HD21  LEU  92          HD21      LEU  92   2.053   4.113   8.074
  680   HD22  LEU  92          HD22      LEU  92   2.908   4.178   6.534
  681   HD23  LEU  92          HD23      LEU  92   3.585   4.978   7.952
  682    H    ALA  93           HN       ALA  93   7.620   1.372   5.497
  683    HA   ALA  93           HA       ALA  93   5.833  -0.099   3.669
  684    HB1  ALA  93           HB1      ALA  93   6.688   1.999   2.806
  685    HB2  ALA  93           HB2      ALA  93   7.325   0.641   1.874
  686    HB3  ALA  93           HB3      ALA  93   8.345   1.453   3.064
  687    H    ASP  94           HN       ASP  94   9.061  -0.156   5.091
  688    HA   ASP  94           HA       ASP  94   9.683  -2.742   3.943
  689    HB2  ASP  94           HB2      ASP  94  11.442  -1.002   4.338
  690    HB3  ASP  94           HB1      ASP  94  11.179  -1.176   6.064
  691    H    VAL  95           HN       VAL  95   7.842  -3.813   4.773
  692    HA   VAL  95           HA       VAL  95   7.118  -4.082   7.472
  693    HB   VAL  95           HB       VAL  95   6.016  -6.222   6.676
  694   HG11  VAL  95          HG11      VAL  95   5.476  -3.689   5.132
  695   HG12  VAL  95          HG12      VAL  95   4.851  -4.071   6.737
  696   HG13  VAL  95          HG13      VAL  95   4.352  -5.029   5.341
  697   HG21  VAL  95          HG21      VAL  95   7.075  -5.277   4.018
  698   HG22  VAL  95          HG22      VAL  95   5.933  -6.594   4.275
  699   HG23  VAL  95          HG23      VAL  95   7.588  -6.733   4.870
  700    H    ASP  96           HN       ASP  96   9.458  -5.664   5.520
  701    HA   ASP  96           HA       ASP  96   9.895  -7.929   7.225
  702    HB2  ASP  96           HB2      ASP  96  11.851  -8.230   5.577
  703    HB3  ASP  96           HB1      ASP  96  10.214  -8.315   4.948
  704    H    LYS  97           HN       LYS  97  11.201  -4.778   6.833
  705    HA   LYS  97           HA       LYS  97  12.823  -3.615   7.844
  706    HB2  LYS  97           HB2      LYS  97  11.921  -5.334  10.145
  707    HB3  LYS  97           HB1      LYS  97  12.956  -3.916  10.315
  708    HG2  LYS  97           HG2      LYS  97  11.233  -2.511   9.371
  709    HG3  LYS  97           HG1      LYS  97  10.205  -3.921   9.113
  710    HD2  LYS  97           HD2      LYS  97  11.197  -3.011  11.819
  711    HD3  LYS  97           HD1      LYS  97   9.634  -2.562  11.135
  712    HE2  LYS  97           HE2      LYS  97  10.542  -5.395  11.607
  713    HE3  LYS  97           HE1      LYS  97   9.547  -4.471  12.731
  714    HZ1  LYS  97           HZ1      LYS  97   8.143  -5.846  11.400
  715    HZ2  LYS  97           HZ2      LYS  97   8.824  -5.268   9.960
  716    HZ3  LYS  97           HZ3      LYS  97   7.890  -4.235  10.929
  717    H    ASP  98           HN       ASP  98  14.032  -5.373   6.328
  718    HA   ASP  98           HA       ASP  98  16.214  -6.462   7.976
  719    HB2  ASP  98           HB2      ASP  98  16.742  -7.917   6.055
  720    HB3  ASP  98           HB1      ASP  98  15.103  -8.174   6.642
  721    H    GLY  99           HN       GLY  99  15.359  -3.955   5.913
  722    HA2  GLY  99           HA2      GLY  99  16.906  -2.136   5.572
  723    HA3  GLY  99           HA1      GLY  99  18.214  -3.304   5.568
  724    H    LEU 100           HN       LEU 100  15.401  -4.128   3.735
  725    HA   LEU 100           HA       LEU 100  16.298  -2.738   1.361
  726    HG   LEU 100           HG       LEU 100  16.164  -6.160   2.642
  727    HB2  LEU 100           HB2      LEU 100  16.423  -4.808  -0.003
  728    HB3  LEU 100           HB1      LEU 100  17.708  -4.634   1.173
  729   HD11  LEU 100          HD11      LEU 100  15.274  -6.862  -0.148
  730   HD12  LEU 100          HD12      LEU 100  14.268  -6.183   1.130
  731   HD13  LEU 100          HD13      LEU 100  14.939  -7.803   1.308
  732   HD21  LEU 100          HD21      LEU 100  17.380  -8.082   1.812
  733   HD22  LEU 100          HD22      LEU 100  18.421  -6.658   1.863
  734   HD23  LEU 100          HD23      LEU 100  17.764  -7.217   0.323
  735    H    LEU 101           HN       LEU 101  14.796  -3.543  -0.605
  736    HA   LEU 101           HA       LEU 101  12.061  -3.622   0.367
  737    HG   LEU 101           HG       LEU 101  13.191  -1.031   1.516
  738    HB2  LEU 101           HB2      LEU 101  13.282  -1.177  -0.941
  739    HB3  LEU 101           HB1      LEU 101  11.566  -1.500  -0.988
  740   HD11  LEU 101          HD11      LEU 101  11.143   0.705   0.139
  741   HD12  LEU 101          HD12      LEU 101  12.885   0.975   0.149
  742   HD13  LEU 101          HD13      LEU 101  11.976   1.063   1.656
  743   HD21  LEU 101          HD21      LEU 101  10.242  -1.473   1.098
  744   HD22  LEU 101          HD22      LEU 101  10.986  -0.932   2.600
  745   HD23  LEU 101          HD23      LEU 101  11.363  -2.529   1.957
  746    H    ASP 102           HN       ASP 102  11.121  -4.937  -1.087
  747    HA   ASP 102           HA       ASP 102  12.398  -5.370  -3.625
  748    HB2  ASP 102           HB2      ASP 102  11.046  -7.238  -3.864
  749    HB3  ASP 102           HB1      ASP 102  11.405  -7.179  -2.149
  750    H    ASP 103           HN       ASP 103  10.353  -5.886  -5.347
  751    HA   ASP 103           HA       ASP 103  10.024  -3.402  -6.606
  752    HB2  ASP 103           HB2      ASP 103  10.013  -5.590  -7.708
  753    HB3  ASP 103           HB1      ASP 103   8.503  -6.013  -6.887
  754    H    GLU 104           HN       GLU 104   7.784  -5.185  -4.474
  755    HA   GLU 104           HA       GLU 104   5.742  -3.107  -4.852
  756    HB2  GLU 104           HB2      GLU 104   5.306  -5.658  -4.608
  757    HB3  GLU 104           HB1      GLU 104   5.501  -5.350  -2.886
  758    HG2  GLU 104           HG2      GLU 104   3.234  -5.118  -3.136
  759    HG3  GLU 104           HG1      GLU 104   3.780  -3.443  -3.321
  760    H    GLU 105           HN       GLU 105   8.242  -3.991  -2.680
  761    HA   GLU 105           HA       GLU 105   7.247  -2.526  -0.438
  762    HB2  GLU 105           HB2      GLU 105   9.535  -4.158  -1.057
  763    HB3  GLU 105           HB1      GLU 105  10.038  -2.693  -0.230
  764    HG2  GLU 105           HG2      GLU 105   8.675  -3.181   1.646
  765    HG3  GLU 105           HG1      GLU 105   7.846  -4.477   0.783
  766    H    PHE 106           HN       PHE 106   9.267  -1.811  -3.220
  767    HA   PHE 106           HA       PHE 106   9.752   0.920  -2.452
  768    HD1  PHE 106           HD2      PHE 106   9.392   2.742  -4.063
  769    HD2  PHE 106           HD1      PHE 106  12.663   0.616  -5.735
  770    HE1  PHE 106           HE2      PHE 106  10.396   4.865  -4.796
  771    HE2  PHE 106           HE1      PHE 106  13.670   2.723  -6.464
  772    HZ   PHE 106           HZ       PHE 106  12.548   4.854  -5.991
  773    HB2  PHE 106           HB2      PHE 106  11.155  -0.441  -4.108
  774    HB3  PHE 106           HB1      PHE 106   9.847  -0.231  -5.256
  775    H    ALA 107           HN       ALA 107   7.377  -0.906  -4.305
  776    HA   ALA 107           HA       ALA 107   5.875   1.149  -5.393
  777    HB1  ALA 107           HB1      ALA 107   5.456  -1.230  -5.805
  778    HB2  ALA 107           HB2      ALA 107   3.987  -0.375  -5.341
  779    HB3  ALA 107           HB3      ALA 107   4.820  -1.399  -4.169
  780    H    LEU 108           HN       LEU 108   5.612  -0.296  -2.169
  781    HA   LEU 108           HA       LEU 108   3.705   1.641  -1.300
  782    HG   LEU 108           HG       LEU 108   4.650   1.319   1.844
  783    HB2  LEU 108           HB2      LEU 108   3.706  -0.562  -0.325
  784    HB3  LEU 108           HB1      LEU 108   5.357  -0.349   0.240
  785   HD11  LEU 108          HD11      LEU 108   2.511   2.188   2.040
  786   HD12  LEU 108          HD12      LEU 108   1.785   0.879   1.118
  787   HD13  LEU 108          HD13      LEU 108   2.728   2.122   0.291
  788   HD21  LEU 108          HD21      LEU 108   2.829  -1.062   1.867
  789   HD22  LEU 108          HD22      LEU 108   3.263  -0.065   3.257
  790   HD23  LEU 108          HD23      LEU 108   4.494  -1.034   2.446
  791    H    ALA 109           HN       ALA 109   7.215   1.254  -0.893
  792    HA   ALA 109           HA       ALA 109   7.758   3.248   0.930
  793    HB1  ALA 109           HB1      ALA 109   9.948   3.453  -0.088
  794    HB2  ALA 109           HB2      ALA 109   9.369   2.643  -1.542
  795    HB3  ALA 109           HB3      ALA 109   9.459   1.759  -0.020
  796    H    ASN 110           HN       ASN 110   7.622   3.647  -2.605
  797    HA   ASN 110           HA       ASN 110   7.919   6.483  -2.466
  798    HB2  ASN 110           HB2      ASN 110   8.597   4.928  -4.411
  799    HB3  ASN 110           HB1      ASN 110   6.899   4.984  -4.872
  800   HD21  ASN 110          HD21      ASN 110   6.023   6.929  -5.630
  801   HD22  ASN 110          HD22      ASN 110   7.024   8.237  -6.151
  802    H    HIS 111           HN       HIS 111   5.244   4.255  -2.413
  803    HA   HIS 111           HA       HIS 111   3.259   6.153  -3.202
  804    HD1  HIS 111           HD1      HIS 111   0.864   5.334  -4.280
  805    HD2  HIS 111           HD2      HIS 111   0.499   4.254  -0.279
  806    HE1  HIS 111           HE1      HIS 111  -1.516   5.853  -3.651
  807    HE2  HIS 111           HE2      HIS 111  -1.636   5.422  -1.163
  808    HB2  HIS 111           HB2      HIS 111   2.794   3.707  -3.265
  809    HB3  HIS 111           HB1      HIS 111   2.857   3.670  -1.508
  810    H    LEU 112           HN       LEU 112   4.555   5.063  -0.128
  811    HA   LEU 112           HA       LEU 112   2.851   6.620   1.506
  812    HG   LEU 112           HG       LEU 112   3.813   3.675   1.740
  813    HB2  LEU 112           HB2      LEU 112   5.575   5.406   1.995
  814    HB3  LEU 112           HB1      LEU 112   4.624   6.201   3.243
  815   HD11  LEU 112          HD11      LEU 112   4.663   4.104   4.611
  816   HD12  LEU 112          HD12      LEU 112   5.627   3.327   3.353
  817   HD13  LEU 112          HD13      LEU 112   4.121   2.585   3.895
  818   HD21  LEU 112          HD21      LEU 112   1.956   3.623   3.339
  819   HD22  LEU 112          HD22      LEU 112   1.894   5.065   2.324
  820   HD23  LEU 112          HD23      LEU 112   2.465   5.183   3.986
  821    H    ILE 113           HN       ILE 113   5.927   7.183  -0.073
  822    HA   ILE 113           HA       ILE 113   6.531   9.732   0.936
  823    HB   ILE 113           HB       ILE 113   7.055   8.406  -1.717
  824   HG12  ILE 113          HG12      ILE 113   8.871   9.182   0.577
  825   HG13  ILE 113          HG11      ILE 113   8.186   7.581   0.323
  826   HG21  ILE 113          HG21      ILE 113   8.625  10.234  -2.229
  827   HG22  ILE 113          HG22      ILE 113   8.012  11.121  -0.832
  828   HG23  ILE 113          HG23      ILE 113   6.944  10.775  -2.193
  829   HD11  ILE 113          HD11      ILE 113  10.495   7.674  -0.412
  830   HD12  ILE 113          HD12      ILE 113  10.107   9.003  -1.504
  831   HD13  ILE 113          HD13      ILE 113   9.420   7.403  -1.785
  832    H    LYS 114           HN       LYS 114   4.506   8.775  -1.864
  833    HA   LYS 114           HA       LYS 114   3.744  11.424  -2.486
  834    HB2  LYS 114           HB2      LYS 114   3.235  10.074  -4.259
  835    HB3  LYS 114           HB1      LYS 114   2.776   8.719  -3.235
  836    HG2  LYS 114           HG2      LYS 114   0.639   9.405  -3.030
  837    HG3  LYS 114           HG1      LYS 114   1.032  11.115  -3.192
  838    HD2  LYS 114           HD2      LYS 114  -0.202  10.452  -5.127
  839    HD3  LYS 114           HD1      LYS 114   1.471  10.699  -5.620
  840    HE2  LYS 114           HE2      LYS 114   1.855   8.292  -5.554
  841    HE3  LYS 114           HE1      LYS 114   0.201   8.038  -4.999
  842    HZ1  LYS 114           HZ1      LYS 114  -0.660   8.806  -7.047
  843    HZ2  LYS 114           HZ2      LYS 114   0.574   7.699  -7.434
  844    HZ3  LYS 114           HZ3      LYS 114   0.854   9.364  -7.564
  845    H    VAL 115           HN       VAL 115   2.367   8.996  -0.332
  846    HA   VAL 115           HA       VAL 115  -0.028  10.259   0.327
  847    HB   VAL 115           HB       VAL 115   1.745   8.455   1.972
  848   HG11  VAL 115          HG11      VAL 115  -1.049   9.401   2.597
  849   HG12  VAL 115          HG12      VAL 115   0.415   9.780   3.507
  850   HG13  VAL 115          HG13      VAL 115  -0.188   8.125   3.453
  851   HG21  VAL 115          HG21      VAL 115   0.003   6.789   1.458
  852   HG22  VAL 115          HG22      VAL 115   0.800   7.412   0.013
  853   HG23  VAL 115          HG23      VAL 115  -0.810   7.984   0.449
  854    H    LYS 116           HN       LYS 116   3.182  10.597   1.859
  855    HA   LYS 116           HA       LYS 116   2.330  12.478   3.808
  856    HB2  LYS 116           HB2      LYS 116   4.612  12.742   4.331
  857    HB3  LYS 116           HB1      LYS 116   4.501  11.088   3.739
  858    HG2  LYS 116           HG2      LYS 116   5.096  12.122   1.454
  859    HG3  LYS 116           HG1      LYS 116   5.653  13.493   2.407
  860    HD2  LYS 116           HD2      LYS 116   7.197  12.056   3.612
  861    HD3  LYS 116           HD1      LYS 116   6.582  10.653   2.735
  862    HE2  LYS 116           HE2      LYS 116   8.687  11.480   1.779
  863    HE3  LYS 116           HE1      LYS 116   7.349  11.566   0.641
  864    HZ1  LYS 116           HZ1      LYS 116   8.554  13.569   0.454
  865    HZ2  LYS 116           HZ2      LYS 116   8.588  13.806   2.127
  866    HZ3  LYS 116           HZ3      LYS 116   7.128  13.961   1.290
  867    H    LEU 117           HN       LEU 117   3.233  12.716   0.462
  868    HA   LEU 117           HA       LEU 117   3.676  15.567   0.504
  869    HG   LEU 117           HG       LEU 117   3.171  16.079  -2.501
  870    HB2  LEU 117           HB2      LEU 117   4.864  14.039  -1.044
  871    HB3  LEU 117           HB1      LEU 117   3.330  13.692  -1.843
  872   HD11  LEU 117          HD11      LEU 117   4.502  17.059  -0.722
  873   HD12  LEU 117          HD12      LEU 117   5.152  17.500  -2.301
  874   HD13  LEU 117          HD13      LEU 117   5.944  16.252  -1.338
  875   HD21  LEU 117          HD21      LEU 117   5.703  14.676  -3.338
  876   HD22  LEU 117          HD22      LEU 117   4.908  15.984  -4.219
  877   HD23  LEU 117          HD23      LEU 117   4.099  14.428  -4.029
  878    H    GLU 118           HN       GLU 118   0.964  13.493   0.234
  879    HA   GLU 118           HA       GLU 118  -0.695  15.288  -1.263
  880    HB2  GLU 118           HB2      GLU 118  -1.425  12.905   0.459
  881    HB3  GLU 118           HB1      GLU 118  -2.556  13.796  -0.555
  882    HG2  GLU 118           HG2      GLU 118  -1.121  13.251  -2.524
  883    HG3  GLU 118           HG1      GLU 118  -0.163  12.207  -1.460
  884    H    GLY 119           HN       GLY 119   0.571  15.542   1.760
  885    HA2  GLY 119           HA2      GLY 119   0.178  17.725   2.745
  886    HA3  GLY 119           HA1      GLY 119  -1.527  17.518   2.381
  887    H    HIS 120           HN       HIS 120  -0.348  14.600   3.473
  888    HA   HIS 120           HA       HIS 120  -0.702  15.308   6.274
  889    HD1  HIS 120           HD1      HIS 120  -2.441  11.638   7.242
  890    HD2  HIS 120           HD2      HIS 120  -2.326  12.298   3.127
  891    HE1  HIS 120           HE1      HIS 120  -2.683   9.373   6.185
  892    HE2  HIS 120           HE2      HIS 120  -2.884   9.833   3.715
  893    HB2  HIS 120           HB2      HIS 120  -2.553  14.035   6.684
  894    HB3  HIS 120           HB1      HIS 120  -2.897  14.480   5.021
  895    H    GLU 121           HN       GLU 121   0.546  14.204   7.614
  896    HA   GLU 121           HA       GLU 121   2.638  12.590   6.560
  897    HB2  GLU 121           HB2      GLU 121   3.381  12.413   8.885
  898    HB3  GLU 121           HB1      GLU 121   2.977  14.075   8.482
  899    HG2  GLU 121           HG2      GLU 121   0.916  13.940   9.670
  900    HG3  GLU 121           HG1      GLU 121   1.108  12.204   9.911
  901    H    LEU 122           HN       LEU 122   3.197  10.426   7.417
  902    HA   LEU 122           HA       LEU 122   1.033   8.609   7.152
  903    HG   LEU 122           HG       LEU 122   4.255   9.015   6.223
  904    HB2  LEU 122           HB2      LEU 122   3.720   7.959   8.331
  905    HB3  LEU 122           HB1      LEU 122   2.600   6.865   7.542
  906   HD11  LEU 122          HD11      LEU 122   4.235   6.008   5.992
  907   HD12  LEU 122          HD12      LEU 122   5.481   6.987   6.765
  908   HD13  LEU 122          HD13      LEU 122   5.220   7.102   5.024
  909   HD21  LEU 122          HD21      LEU 122   2.027   8.914   5.232
  910   HD22  LEU 122          HD22      LEU 122   2.209   7.172   5.008
  911   HD23  LEU 122          HD23      LEU 122   3.261   8.289   4.138
  912    HA   PRO 123           HA       PRO 123  -0.099   8.693  11.418
  913    HB2  PRO 123           HB2      PRO 123  -2.304   7.200  11.226
  914    HB3  PRO 123           HB1      PRO 123  -2.192   8.781  10.450
  915    HG2  PRO 123           HG2      PRO 123  -2.104   6.082   9.243
  916    HG3  PRO 123           HG1      PRO 123  -2.641   7.615   8.537
  917    HD2  PRO 123           HD2      PRO 123  -0.102   6.325   8.223
  918    HD3  PRO 123           HD1      PRO 123  -0.610   7.896   7.566
  919    H    ALA 124           HN       ALA 124   1.635   6.319  10.215
  920    HA   ALA 124           HA       ALA 124   2.599   4.414  10.984
  921    HB1  ALA 124           HB1      ALA 124   2.926   5.743  13.031
  922    HB2  ALA 124           HB2      ALA 124   2.705   4.026  13.370
  923    HB3  ALA 124           HB3      ALA 124   1.376   5.156  13.638
  924    H    ASP 125           HN       ASP 125  -0.297   4.552  10.117
  925    HA   ASP 125           HA       ASP 125  -1.298   2.076  11.323
  926    HB2  ASP 125           HB2      ASP 125  -2.836   4.017  11.351
  927    HB3  ASP 125           HB1      ASP 125  -2.740   4.105   9.597
  928    H    LEU 126           HN       LEU 126  -0.675   0.337  10.238
  929    HA   LEU 126           HA       LEU 126  -0.617   0.472   7.295
  930    HG   LEU 126           HG       LEU 126   0.413  -2.411   6.870
  931    HB2  LEU 126           HB2      LEU 126   1.554  -0.052   8.370
  932    HB3  LEU 126           HB1      LEU 126   0.825  -1.464   9.111
  933   HD11  LEU 126          HD11      LEU 126   1.459  -1.406   4.920
  934   HD12  LEU 126          HD12      LEU 126   1.957  -0.021   5.896
  935   HD13  LEU 126          HD13      LEU 126   0.244  -0.336   5.621
  936   HD21  LEU 126          HD21      LEU 126   2.776  -2.890   6.328
  937   HD22  LEU 126          HD22      LEU 126   2.415  -3.056   8.047
  938   HD23  LEU 126          HD23      LEU 126   3.262  -1.625   7.457
  939    HA   PRO 127           HA       PRO 127  -4.054  -2.356   8.067
  940    HB2  PRO 127           HB2      PRO 127  -5.381  -1.369   5.765
  941    HB3  PRO 127           HB1      PRO 127  -5.690  -0.907   7.442
  942    HG2  PRO 127           HG2      PRO 127  -4.672   0.750   5.456
  943    HG3  PRO 127           HG1      PRO 127  -4.570   1.056   7.201
  944    HD2  PRO 127           HD2      PRO 127  -2.536  -0.121   5.350
  945    HD3  PRO 127           HD1      PRO 127  -2.297   1.014   6.696
  946    HA   PRO 128           HA       PRO 128  -3.037  -5.518   5.126
  947    HB2  PRO 128           HB2      PRO 128  -5.421  -6.839   4.922
  948    HB3  PRO 128           HB1      PRO 128  -4.324  -6.993   6.305
  949    HG2  PRO 128           HG2      PRO 128  -6.794  -5.333   6.009
  950    HG3  PRO 128           HG1      PRO 128  -6.238  -6.274   7.403
  951    HD2  PRO 128           HD2      PRO 128  -5.959  -3.589   7.244
  952    HD3  PRO 128           HD1      PRO 128  -4.792  -4.618   8.100
  953    H    HIS 129           HN       HIS 129  -4.152  -2.872   4.071
  954    HA   HIS 129           HA       HIS 129  -5.304  -3.843   1.539
  955    HD1  HIS 129           HD1      HIS 129  -6.169  -2.685   4.567
  956    HD2  HIS 129           HD2      HIS 129  -8.074  -0.376   1.701
  957    HE1  HIS 129           HE1      HIS 129  -8.308  -1.940   5.626
  958    HE2  HIS 129           HE2      HIS 129  -9.441  -0.507   3.886
  959    HB2  HIS 129           HB2      HIS 129  -4.783  -0.958   2.293
  960    HB3  HIS 129           HB1      HIS 129  -5.764  -1.551   0.971
  961    H    LEU 130           HN       LEU 130  -2.408  -2.738   3.044
  962    HA   LEU 130           HA       LEU 130  -1.202  -2.153   0.421
  963    HG   LEU 130           HG       LEU 130  -2.619  -0.401   3.019
  964    HB2  LEU 130           HB2      LEU 130  -0.178  -0.660   2.752
  965    HB3  LEU 130           HB1      LEU 130  -0.363  -0.148   1.089
  966   HD11  LEU 130          HD11      LEU 130  -1.045   2.016   2.192
  967   HD12  LEU 130          HD12      LEU 130  -1.086   1.293   3.803
  968   HD13  LEU 130          HD13      LEU 130  -2.535   2.057   3.141
  969   HD21  LEU 130          HD21      LEU 130  -3.895   0.925   1.487
  970   HD22  LEU 130          HD22      LEU 130  -3.297  -0.528   0.692
  971   HD23  LEU 130          HD23      LEU 130  -2.513   1.022   0.396
  972    H    VAL 131           HN       VAL 131  -1.093  -4.267   2.856
  973    HA   VAL 131           HA       VAL 131   1.719  -4.266   3.359
  974    HB   VAL 131           HB       VAL 131  -0.017  -5.308   4.888
  975   HG11  VAL 131          HG11      VAL 131   0.126  -7.548   2.893
  976   HG12  VAL 131          HG12      VAL 131  -1.289  -6.549   3.245
  977   HG13  VAL 131          HG13      VAL 131  -0.639  -7.626   4.480
  978   HG21  VAL 131          HG21      VAL 131   2.345  -5.652   5.238
  979   HG22  VAL 131          HG22      VAL 131   2.352  -6.974   4.073
  980   HG23  VAL 131          HG23      VAL 131   1.463  -7.138   5.585
  981    HA   PRO 132           HA       PRO 132   2.929  -5.516  -0.677
  982    HB2  PRO 132           HB2      PRO 132   5.194  -6.726   0.784
  983    HB3  PRO 132           HB1      PRO 132   5.198  -5.647  -0.613
  984    HG2  PRO 132           HG2      PRO 132   5.775  -4.774   1.851
  985    HG3  PRO 132           HG1      PRO 132   4.920  -3.759   0.672
  986    HD2  PRO 132           HD2      PRO 132   3.897  -5.136   3.093
  987    HD3  PRO 132           HD1      PRO 132   3.307  -3.659   2.290
  988    HA   PRO 133           HA       PRO 133   1.306  -9.456  -1.607
  989    HB2  PRO 133           HB2      PRO 133   3.917 -10.041  -2.962
  990    HB3  PRO 133           HB1      PRO 133   2.260 -10.281  -3.546
  991    HG2  PRO 133           HG2      PRO 133   3.689  -8.188  -4.360
  992    HG3  PRO 133           HG1      PRO 133   1.951  -8.031  -4.009
  993    HD2  PRO 133           HD2      PRO 133   4.297  -7.081  -2.450
  994    HD3  PRO 133           HD1      PRO 133   2.659  -6.402  -2.562
  995    H    SER 134           HN       SER 134   4.791  -9.961  -0.992
  996    HA   SER 134           HA       SER 134   4.437 -12.615  -0.112
  997    HG   SER 134           HG       SER 134   7.351 -11.960  -1.653
  998    HB2  SER 134           HB2      SER 134   6.783 -10.860   0.588
  999    HB3  SER 134           HB1      SER 134   6.766 -12.596   0.276
 1000    H    LYS 135           HN       LYS 135   3.479  -9.867   1.476
 1001    HA   LYS 135           HA       LYS 135   4.170 -10.988   4.099
 1002    HB2  LYS 135           HB2      LYS 135   3.792  -8.227   4.511
 1003    HB3  LYS 135           HB1      LYS 135   5.298  -9.124   4.569
 1004    HG2  LYS 135           HG2      LYS 135   4.278  -8.129   1.938
 1005    HG3  LYS 135           HG1      LYS 135   5.098  -7.035   3.055
 1006    HD2  LYS 135           HD2      LYS 135   7.074  -8.258   2.971
 1007    HD3  LYS 135           HD1      LYS 135   6.286  -9.666   2.283
 1008    HE2  LYS 135           HE2      LYS 135   6.248  -8.759   0.167
 1009    HE3  LYS 135           HE1      LYS 135   6.356  -7.106   0.774
 1010    HZ1  LYS 135           HZ1      LYS 135   8.666  -7.493   1.361
 1011    HZ2  LYS 135           HZ2      LYS 135   8.427  -7.834  -0.284
 1012    HZ3  LYS 135           HZ3      LYS 135   8.566  -9.105   0.836
 1013    H    ARG 136           HN       ARG 136   1.620 -10.828   2.233
 1014    HA   ARG 136           HA       ARG 136  -0.257  -9.638   4.113
 1015    HE   ARG 136           HE       ARG 136  -2.867 -11.112  -0.470
 1016    HB2  ARG 136           HB2      ARG 136  -1.356 -11.336   1.965
 1017    HB3  ARG 136           HB1      ARG 136  -1.818  -9.716   2.461
 1018    HG2  ARG 136           HG2      ARG 136  -0.078  -8.740   1.172
 1019    HG3  ARG 136           HG1      ARG 136   0.646 -10.316   0.850
 1020    HD2  ARG 136           HD2      ARG 136  -1.840  -9.102  -0.293
 1021    HD3  ARG 136           HD1      ARG 136  -0.484  -9.863  -1.122
 1022   HH11  ARG 136          HH11      ARG 136   0.556 -11.818  -0.043
 1023   HH12  ARG 136          HH12      ARG 136   0.308 -13.531   0.035
 1024   HH21  ARG 136          HH21      ARG 136  -3.162 -13.366  -0.411
 1025   HH22  ARG 136          HH22      ARG 136  -1.783 -14.410  -0.206
 1026    H    ARG 137           HN       ARG 137   0.453 -11.139   5.875
 1027    HA   ARG 137           HA       ARG 137  -1.440 -13.253   6.119
 1028    HE   ARG 137           HE       ARG 137   1.997 -16.349   7.213
 1029    HB2  ARG 137           HB2      ARG 137   0.130 -15.114   6.396
 1030    HB3  ARG 137           HB1      ARG 137   0.188 -14.460   4.767
 1031    HG2  ARG 137           HG2      ARG 137   2.239 -13.263   5.304
 1032    HG3  ARG 137           HG1      ARG 137   2.174 -13.875   6.952
 1033    HD2  ARG 137           HD2      ARG 137   2.460 -15.517   4.455
 1034    HD3  ARG 137           HD1      ARG 137   3.734 -15.166   5.619
 1035   HH11  ARG 137          HH11      ARG 137   3.020 -17.235   3.985
 1036   HH12  ARG 137          HH12      ARG 137   2.656 -18.922   4.188
 1037   HH21  ARG 137          HH21      ARG 137   1.570 -18.519   7.533
 1038   HH22  ARG 137          HH22      ARG 137   1.850 -19.668   6.255
 1039    H    HIS 138           HN       HIS 138  -1.884 -13.705   8.165
 1040    HA   HIS 138           HA       HIS 138   0.067 -12.952  10.240
 1041    HD1  HIS 138           HD1      HIS 138  -0.810 -10.951  12.563
 1042    HD2  HIS 138           HD2      HIS 138  -2.957 -14.498  12.876
 1043    HE1  HIS 138           HE1      HIS 138  -0.909 -11.470  15.020
 1044    HE2  HIS 138           HE2      HIS 138  -2.003 -13.736  15.148
 1045    HB2  HIS 138           HB2      HIS 138  -2.032 -11.669  10.391
 1046    HB3  HIS 138           HB1      HIS 138  -2.949 -13.169  10.435
 1047    H    GLU 139           HN       GLU 139   1.048 -14.679  11.086
 1048    HA   GLU 139           HA       GLU 139   1.651 -16.825  11.437
 1049    HB2  GLU 139           HB2      GLU 139  -1.273 -16.928  11.997
 1050    HB3  GLU 139           HB1      GLU 139  -0.432 -18.455  11.795
 1051    HG2  GLU 139           HG2      GLU 139  -0.417 -18.054  14.090
 1052    HG3  GLU 139           HG1      GLU 139   1.201 -17.620  13.547
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1   5.523 -40.836 -37.239
    2    H2   GLY   1           HT2      GLY   1   6.239 -39.303 -37.179
    3    H3   GLY   1           HT3      GLY   1   5.320 -39.851 -35.870
    4    HA2  GLY   1           HA1      GLY   1   6.926 -41.591 -35.426
    5    HA3  GLY   1           HA2      GLY   1   7.881 -41.035 -36.793
    6    HA   PRO   2           HA       PRO   2   8.528 -38.378 -32.805
    7    HB2  PRO   2           HB2      PRO   2  10.100 -40.428 -31.450
    8    HB3  PRO   2           HB1      PRO   2   8.717 -39.513 -30.851
    9    HG2  PRO   2           HG2      PRO   2   8.600 -42.168 -31.388
   10    HG3  PRO   2           HG1      PRO   2   7.205 -41.086 -31.549
   11    HD2  PRO   2           HD2      PRO   2   9.021 -42.167 -33.674
   12    HD3  PRO   2           HD1      PRO   2   7.255 -41.962 -33.698
   13    H    LEU   3           HN       LEU   3  10.723 -40.873 -34.035
   14    HA   LEU   3           HA       LEU   3  13.085 -39.343 -33.596
   15    HG   LEU   3           HG       LEU   3  14.861 -40.619 -35.740
   16    HB2  LEU   3           HB2      LEU   3  13.001 -41.825 -33.688
   17    HB3  LEU   3           HB1      LEU   3  12.659 -41.722 -35.405
   18   HD11  LEU   3          HD11      LEU   3  15.140 -39.663 -33.513
   19   HD12  LEU   3          HD12      LEU   3  16.505 -40.704 -33.922
   20   HD13  LEU   3          HD13      LEU   3  15.253 -41.282 -32.822
   21   HD21  LEU   3          HD21      LEU   3  16.203 -42.634 -35.389
   22   HD22  LEU   3          HD22      LEU   3  14.623 -43.018 -36.070
   23   HD23  LEU   3          HD23      LEU   3  14.937 -43.297 -34.356
   24    H    GLY   4           HN       GLY   4  14.128 -37.951 -34.917
   25    HA2  GLY   4           HA2      GLY   4  14.714 -36.985 -36.983
   26    HA3  GLY   4           HA1      GLY   4  13.314 -37.752 -37.716
   27    H    SER   5           HN       SER   5  12.184 -36.521 -34.938
   28    HA   SER   5           HA       SER   5  11.208 -34.122 -36.288
   29    HG   SER   5           HG       SER   5   9.821 -33.118 -34.034
   30    HB2  SER   5           HB2      SER   5   9.510 -35.626 -35.332
   31    HB3  SER   5           HB1      SER   5  10.255 -35.459 -33.742
   32    H    GLU   6           HN       GLU   6  11.845 -32.148 -35.734
   33    HA   GLU   6           HA       GLU   6  13.732 -31.744 -33.608
   34    HB2  GLU   6           HB2      GLU   6  12.339 -29.856 -35.511
   35    HB3  GLU   6           HB1      GLU   6  13.470 -29.312 -34.280
   36    HG2  GLU   6           HG2      GLU   6  14.202 -31.344 -36.363
   37    HG3  GLU   6           HG1      GLU   6  14.384 -29.611 -36.612
   38    H    SER   7           HN       SER   7  13.235 -31.385 -31.564
   39    HA   SER   7           HA       SER   7  10.497 -31.039 -30.769
   40    HG   SER   7           HG       SER   7  11.350 -33.090 -30.009
   41    HB2  SER   7           HB2      SER   7  13.004 -30.997 -29.070
   42    HB3  SER   7           HB1      SER   7  11.348 -31.193 -28.493
   43    H    LEU   8           HN       LEU   8   9.561 -29.140 -30.977
   44    HA   LEU   8           HA       LEU   8  10.940 -26.675 -31.096
   45    HG   LEU   8           HG       LEU   8   7.796 -26.271 -33.022
   46    HB2  LEU   8           HB2      LEU   8   8.015 -27.309 -30.749
   47    HB3  LEU   8           HB1      LEU   8   8.624 -25.675 -30.899
   48   HD11  LEU   8          HD11      LEU   8   9.876 -25.092 -33.177
   49   HD12  LEU   8          HD12      LEU   8   9.818 -26.314 -34.450
   50   HD13  LEU   8          HD13      LEU   8  10.787 -26.593 -33.003
   51   HD21  LEU   8          HD21      LEU   8   7.631 -28.667 -32.744
   52   HD22  LEU   8          HD22      LEU   8   9.387 -28.818 -32.801
   53   HD23  LEU   8          HD23      LEU   8   8.502 -28.292 -34.233
   54    H    MET   9           HN       MET   9  11.476 -25.262 -29.561
   55    HA   MET   9           HA       MET   9  10.614 -25.837 -26.811
   56    HB2  MET   9           HB2      MET   9  13.060 -24.370 -27.810
   57    HB3  MET   9           HB1      MET   9  12.628 -24.559 -26.116
   58    HG2  MET   9           HG2      MET   9  12.840 -26.990 -26.354
   59    HG3  MET   9           HG1      MET   9  13.316 -26.775 -28.036
   60    HE1  MET   9           HE1      MET   9  15.516 -28.196 -27.607
   61    HE2  MET   9           HE2      MET   9  14.991 -28.430 -25.940
   62    HE3  MET   9           HE3      MET   9  16.635 -27.886 -26.278
   63    HA   PRO  10           HA       PRO  10   8.136 -22.125 -27.126
   64    HB2  PRO  10           HB2      PRO  10   7.814 -21.853 -24.380
   65    HB3  PRO  10           HB1      PRO  10   6.788 -22.832 -25.435
   66    HG2  PRO  10           HG2      PRO  10   9.058 -23.667 -23.685
   67    HG3  PRO  10           HG1      PRO  10   7.529 -24.500 -24.020
   68    HD2  PRO  10           HD2      PRO  10   9.835 -25.259 -25.164
   69    HD3  PRO  10           HD1      PRO  10   8.291 -25.346 -26.037
   70    H    SER  11           HN       SER  11  10.870 -22.421 -24.896
   71    HA   SER  11           HA       SER  11  11.319 -19.536 -25.181
   72    HG   SER  11           HG       SER  11  13.156 -21.957 -22.729
   73    HB2  SER  11           HB2      SER  11  12.930 -19.934 -23.228
   74    HB3  SER  11           HB1      SER  11  11.204 -20.064 -22.884
   75    H    GLN  12           HN       GLN  12  12.260 -19.617 -27.215
   76    HA   GLN  12           HA       GLN  12  14.766 -21.112 -27.434
   77    HB2  GLN  12           HB2      GLN  12  14.597 -20.494 -29.878
   78    HB3  GLN  12           HB1      GLN  12  13.346 -21.570 -29.277
   79    HG2  GLN  12           HG2      GLN  12  11.791 -19.709 -29.142
   80    HG3  GLN  12           HG1      GLN  12  13.050 -18.605 -29.692
   81   HE21  GLN  12          HE21      GLN  12  10.453 -19.254 -30.859
   82   HE22  GLN  12          HE22      GLN  12  10.777 -19.796 -32.469
   83    H    VAL  13           HN       VAL  13  15.330 -19.301 -25.775
   84    HA   VAL  13           HA       VAL  13  16.490 -17.052 -27.283
   85    HB   VAL  13           HB       VAL  13  15.646 -17.041 -24.374
   86   HG11  VAL  13          HG11      VAL  13  16.719 -14.828 -26.122
   87   HG12  VAL  13          HG12      VAL  13  17.575 -15.616 -24.796
   88   HG13  VAL  13          HG13      VAL  13  16.141 -14.643 -24.465
   89   HG21  VAL  13          HG21      VAL  13  13.926 -15.426 -25.102
   90   HG22  VAL  13          HG22      VAL  13  13.697 -17.020 -25.818
   91   HG23  VAL  13          HG23      VAL  13  14.390 -15.715 -26.780
   92    H    VAL  14           HN       VAL  14  18.545 -17.594 -27.595
   93    HA   VAL  14           HA       VAL  14  20.001 -19.060 -25.557
   94    HB   VAL  14           HB       VAL  14  21.878 -19.009 -27.273
   95   HG11  VAL  14          HG11      VAL  14  20.445 -20.954 -26.936
   96   HG12  VAL  14          HG12      VAL  14  20.852 -20.767 -28.641
   97   HG13  VAL  14          HG13      VAL  14  19.258 -20.287 -28.057
   98   HG21  VAL  14          HG21      VAL  14  19.664 -17.908 -29.005
   99   HG22  VAL  14          HG22      VAL  14  21.183 -18.569 -29.611
  100   HG23  VAL  14          HG23      VAL  14  21.191 -17.118 -28.609
  101    H    LYS  15           HN       LYS  15  20.578 -17.810 -23.916
  102    HA   LYS  15           HA       LYS  15  21.650 -15.161 -24.357
  103    HB2  LYS  15           HB2      LYS  15  21.296 -16.761 -21.813
  104    HB3  LYS  15           HB1      LYS  15  21.864 -15.098 -21.884
  105    HG2  LYS  15           HG2      LYS  15  19.743 -14.373 -22.801
  106    HG3  LYS  15           HG1      LYS  15  19.168 -16.045 -22.834
  107    HD2  LYS  15           HD2      LYS  15  19.348 -16.166 -20.406
  108    HD3  LYS  15           HD1      LYS  15  19.972 -14.516 -20.360
  109    HE2  LYS  15           HE2      LYS  15  17.249 -15.314 -21.392
  110    HE3  LYS  15           HE1      LYS  15  17.572 -14.667 -19.786
  111    HZ1  LYS  15           HZ1      LYS  15  18.058 -13.252 -22.356
  112    HZ2  LYS  15           HZ2      LYS  15  18.410 -12.635 -20.819
  113    HZ3  LYS  15           HZ3      LYS  15  16.800 -12.938 -21.263
  114    H    GLY  16           HN       GLY  16  23.502 -15.696 -25.586
  115    HA2  GLY  16           HA2      GLY  16  25.467 -17.539 -24.620
  116    HA3  GLY  16           HA1      GLY  16  25.648 -16.430 -25.971
  117    H    GLY  17           HN       GLY  17  26.562 -17.118 -22.810
  118    HA2  GLY  17           HA2      GLY  17  28.277 -16.121 -21.609
  119    HA3  GLY  17           HA1      GLY  17  28.273 -14.792 -22.757
  120    H    ALA  18           HN       ALA  18  25.149 -15.330 -21.757
  121    HA   ALA  18           HA       ALA  18  25.277 -13.021 -19.978
  122    HB1  ALA  18           HB1      ALA  18  22.882 -12.850 -20.278
  123    HB2  ALA  18           HB2      ALA  18  22.853 -14.383 -21.147
  124    HB3  ALA  18           HB3      ALA  18  23.674 -12.987 -21.847
  125    H    PHE  19           HN       PHE  19  25.916 -13.767 -18.019
  126    HA   PHE  19           HA       PHE  19  24.628 -16.092 -16.866
  127    HD1  PHE  19           HD1      PHE  19  27.904 -13.997 -17.732
  128    HD2  PHE  19           HD2      PHE  19  26.508 -13.629 -13.724
  129    HE1  PHE  19           HE1      PHE  19  29.158 -11.900 -17.492
  130    HE2  PHE  19           HE2      PHE  19  27.768 -11.527 -13.480
  131    HZ   PHE  19           HZ       PHE  19  29.112 -10.678 -15.322
  132    HB2  PHE  19           HB2      PHE  19  26.143 -15.624 -14.908
  133    HB3  PHE  19           HB1      PHE  19  26.971 -15.949 -16.424
  134    H    ASP  20           HN       ASP  20  22.762 -15.935 -15.851
  135    HA   ASP  20           HA       ASP  20  22.039 -13.365 -14.627
  136    HB2  ASP  20           HB2      ASP  20  19.738 -14.005 -14.791
  137    HB3  ASP  20           HB1      ASP  20  20.485 -14.354 -16.344
  138    H    GLY  21           HN       GLY  21  21.591 -13.187 -12.516
  139    HA2  GLY  21           HA2      GLY  21  22.007 -15.604 -10.875
  140    HA3  GLY  21           HA1      GLY  21  22.417 -13.971 -10.362
  141    H    THR  22           HN       THR  22  19.799 -16.187 -11.042
  142    HA   THR  22           HA       THR  22  18.150 -14.794  -9.094
  143    HB   THR  22           HB       THR  22  17.156 -15.342 -11.907
  144    HG1  THR  22           HG1      THR  22  18.423 -13.222 -10.783
  145   HG21  THR  22          HG21      THR  22  15.112 -14.217 -11.202
  146   HG22  THR  22          HG22      THR  22  15.767 -13.991  -9.582
  147   HG23  THR  22          HG23      THR  22  15.414 -15.617 -10.172
  148    H    MET  23           HN       MET  23  16.668 -16.130  -8.078
  149    HA   MET  23           HA       MET  23  17.288 -18.852  -7.911
  150    HB2  MET  23           HB2      MET  23  16.287 -17.635  -6.059
  151    HB3  MET  23           HB1      MET  23  14.820 -17.369  -6.989
  152    HG2  MET  23           HG2      MET  23  14.539 -19.128  -5.338
  153    HG3  MET  23           HG1      MET  23  14.357 -19.749  -6.978
  154    HE1  MET  23           HE1      MET  23  14.777 -21.651  -4.458
  155    HE2  MET  23           HE2      MET  23  15.931 -22.799  -5.135
  156    HE3  MET  23           HE3      MET  23  14.590 -22.210  -6.119
  157    H    ASN  24           HN       ASN  24  16.429 -20.667  -8.752
  158    HA   ASN  24           HA       ASN  24  14.733 -20.352 -11.097
  159    HB2  ASN  24           HB2      ASN  24  16.102 -22.826 -10.018
  160    HB3  ASN  24           HB1      ASN  24  15.326 -22.669 -11.591
  161   HD21  ASN  24          HD21      ASN  24  16.394 -21.607 -13.239
  162   HD22  ASN  24          HD22      ASN  24  18.050 -21.126 -13.123
  163    H    GLY  25           HN       GLY  25  12.790 -21.533 -11.390
  164    HA2  GLY  25           HA2      GLY  25  11.243 -23.194 -10.416
  165    HA3  GLY  25           HA1      GLY  25  11.598 -22.472  -8.860
  166    HA   PRO  26           HA       PRO  26   8.424 -19.320  -9.815
  167    HB2  PRO  26           HB2      PRO  26  10.044 -17.080 -10.782
  168    HB3  PRO  26           HB1      PRO  26   9.063 -17.198  -9.319
  169    HG2  PRO  26           HG2      PRO  26  11.759 -17.150  -9.224
  170    HG3  PRO  26           HG1      PRO  26  10.788 -18.086  -8.070
  171    HD2  PRO  26           HD2      PRO  26  12.253 -19.022 -10.511
  172    HD3  PRO  26           HD1      PRO  26  12.172 -19.758  -8.896
  173    H    PHE  27           HN       PHE  27  10.385 -20.403 -12.229
  174    HA   PHE  27           HA       PHE  27   9.219 -18.932 -14.421
  175    HD1  PHE  27           HD1      PHE  27  11.450 -18.120 -16.054
  176    HD2  PHE  27           HD2      PHE  27  12.696 -20.720 -12.924
  177    HE1  PHE  27           HE1      PHE  27  13.408 -16.685 -15.655
  178    HE2  PHE  27           HE2      PHE  27  14.659 -19.293 -12.516
  179    HZ   PHE  27           HZ       PHE  27  14.990 -17.253 -13.833
  180    HB2  PHE  27           HB2      PHE  27  10.992 -21.390 -14.435
  181    HB3  PHE  27           HB1      PHE  27  10.576 -20.418 -15.843
  182    H    GLY  28           HN       GLY  28   7.386 -19.438 -15.404
  183    HA2  GLY  28           HA2      GLY  28   5.881 -21.713 -14.462
  184    HA3  GLY  28           HA1      GLY  28   5.313 -20.464 -15.560
  185    H    HIS  29           HN       HIS  29   4.557 -22.947 -16.101
  186    HA   HIS  29           HA       HIS  29   6.127 -23.622 -18.501
  187    HD1  HIS  29           HD1      HIS  29   6.265 -26.243 -14.711
  188    HD2  HIS  29           HD2      HIS  29   8.557 -24.873 -17.900
  189    HE1  HIS  29           HE1      HIS  29   8.650 -26.336 -13.918
  190    HE2  HIS  29           HE2      HIS  29  10.012 -25.766 -15.957
  191    HB2  HIS  29           HB2      HIS  29   4.866 -25.649 -16.633
  192    HB3  HIS  29           HB1      HIS  29   5.682 -26.015 -18.146
  193    H    GLY  30           HN       GLY  30   4.763 -24.920 -20.067
  194    HA2  GLY  30           HA2      GLY  30   2.220 -23.579 -20.339
  195    HA3  GLY  30           HA1      GLY  30   2.937 -24.716 -21.473
  196    H    TYR  31           HN       TYR  31   0.838 -24.308 -18.761
  197    HA   TYR  31           HA       TYR  31   0.166 -27.181 -18.844
  198    HD1  TYR  31           HD1      TYR  31   1.569 -28.236 -17.174
  199    HD2  TYR  31           HD2      TYR  31   1.040 -24.494 -15.215
  200    HE1  TYR  31           HE1      TYR  31   3.686 -28.575 -15.964
  201    HE2  TYR  31           HE2      TYR  31   3.157 -24.816 -14.014
  202    HH   TYR  31           HH       TYR  31   4.583 -26.806 -13.284
  203    HB2  TYR  31           HB2      TYR  31  -0.551 -25.178 -16.690
  204    HB3  TYR  31           HB1      TYR  31  -0.846 -26.909 -16.648
  205    H    GLY  32           HN       GLY  32  -2.199 -27.633 -18.482
  206    HA2  GLY  32           HA2      GLY  32  -3.929 -26.111 -20.132
  207    HA3  GLY  32           HA1      GLY  32  -4.425 -27.338 -18.970
  208    H    GLU  33           HN       GLU  33  -5.854 -24.940 -19.424
  209    HA   GLU  33           HA       GLU  33  -5.282 -22.728 -17.923
  210    HB2  GLU  33           HB2      GLU  33  -7.931 -24.036 -18.465
  211    HB3  GLU  33           HB1      GLU  33  -7.796 -22.486 -17.650
  212    HG2  GLU  33           HG2      GLU  33  -6.761 -21.508 -19.583
  213    HG3  GLU  33           HG1      GLU  33  -6.732 -23.073 -20.401
  214    H    GLY  34           HN       GLY  34  -5.207 -22.156 -15.876
  215    HA2  GLY  34           HA2      GLY  34  -6.085 -24.119 -13.856
  216    HA3  GLY  34           HA1      GLY  34  -4.831 -22.906 -13.608
  217    H    ALA  35           HN       ALA  35  -8.107 -23.633 -13.213
  218    HA   ALA  35           HA       ALA  35  -9.281 -21.085 -13.383
  219    HB1  ALA  35           HB1      ALA  35 -10.598 -23.146 -13.306
  220    HB2  ALA  35           HB2      ALA  35 -11.100 -22.015 -12.050
  221    HB3  ALA  35           HB3      ALA  35 -10.097 -23.406 -11.636
  222    H    GLY  36           HN       GLY  36  -9.623 -19.489 -11.869
  223    HA2  GLY  36           HA2      GLY  36  -7.748 -19.598  -9.605
  224    HA3  GLY  36           HA1      GLY  36  -8.251 -18.130 -10.430
  225    H    GLU  37           HN       GLU  37  -8.772 -20.151  -7.800
  226    HA   GLU  37           HA       GLU  37 -11.466 -19.305  -7.274
  227    HB2  GLU  37           HB2      GLU  37 -10.889 -20.271  -4.945
  228    HB3  GLU  37           HB1      GLU  37 -11.044 -21.365  -6.311
  229    HG2  GLU  37           HG2      GLU  37  -8.367 -20.304  -5.493
  230    HG3  GLU  37           HG1      GLU  37  -9.096 -21.675  -4.654
  231    H    GLY  38           HN       GLY  38 -11.536 -18.522  -4.668
  232    HA2  GLY  38           HA2      GLY  38 -10.772 -15.772  -5.088
  233    HA3  GLY  38           HA1      GLY  38 -11.746 -16.382  -3.766
  234    H    ILE  39           HN       ILE  39  -8.421 -16.525  -4.979
  235    HA   ILE  39           HA       ILE  39  -7.265 -16.682  -2.410
  236    HB   ILE  39           HB       ILE  39  -5.246 -15.539  -3.656
  237   HG12  ILE  39          HG12      ILE  39  -5.244 -16.157  -6.085
  238   HG13  ILE  39          HG11      ILE  39  -6.962 -16.479  -5.970
  239   HG21  ILE  39          HG21      ILE  39  -4.552 -17.749  -4.462
  240   HG22  ILE  39          HG22      ILE  39  -6.204 -18.326  -4.257
  241   HG23  ILE  39          HG23      ILE  39  -5.270 -17.811  -2.851
  242   HD11  ILE  39          HD11      ILE  39  -7.330 -14.120  -5.365
  243   HD12  ILE  39          HD12      ILE  39  -6.588 -14.323  -6.953
  244   HD13  ILE  39          HD13      ILE  39  -5.602 -13.827  -5.578
  245    H    ASP  40           HN       ASP  40  -6.119 -14.923  -1.284
  246    HA   ASP  40           HA       ASP  40  -7.921 -12.715  -1.053
  247    HB2  ASP  40           HB2      ASP  40  -5.426 -13.530   0.405
  248    HB3  ASP  40           HB1      ASP  40  -6.127 -11.935   0.665
  249    H    ASP  41           HN       ASP  41  -7.599 -11.997  -3.271
  250    HA   ASP  41           HA       ASP  41  -5.172 -10.406  -3.692
  251    HB2  ASP  41           HB2      ASP  41  -6.665 -11.849  -5.452
  252    HB3  ASP  41           HB1      ASP  41  -7.387 -10.256  -5.654
  253    H    VAL  42           HN       VAL  42  -5.457  -8.821  -2.131
  254    HA   VAL  42           HA       VAL  42  -7.902  -7.313  -1.978
  255    HB   VAL  42           HB       VAL  42  -6.633  -7.748   0.055
  256   HG11  VAL  42          HG11      VAL  42  -4.490  -6.634   0.488
  257   HG12  VAL  42          HG12      VAL  42  -4.462  -6.058  -1.181
  258   HG13  VAL  42          HG13      VAL  42  -4.381  -7.787  -0.842
  259   HG21  VAL  42          HG21      VAL  42  -6.621  -5.508   0.993
  260   HG22  VAL  42          HG22      VAL  42  -8.022  -5.744  -0.053
  261   HG23  VAL  42          HG23      VAL  42  -6.638  -4.818  -0.630
  262    H    GLU  43           HN       GLU  43  -8.334  -5.353  -2.806
  263    HA   GLU  43           HA       GLU  43  -6.558  -4.367  -4.845
  264    HB2  GLU  43           HB2      GLU  43  -8.957  -4.440  -5.303
  265    HB3  GLU  43           HB1      GLU  43  -9.265  -3.347  -3.958
  266    HG2  GLU  43           HG2      GLU  43  -8.184  -1.548  -5.054
  267    HG3  GLU  43           HG1      GLU  43  -7.531  -2.610  -6.297
  268    H    TRP  44           HN       TRP  44  -4.905  -3.213  -4.254
  269    HA   TRP  44           HA       TRP  44  -5.332  -0.970  -2.411
  270    HD1  TRP  44           HD1      TRP  44  -3.414   0.935  -1.973
  271    HE1  TRP  44           HE1      TRP  44  -1.109   1.879  -1.316
  272    HE3  TRP  44           HE3      TRP  44  -0.878  -3.400  -1.525
  273    HZ2  TRP  44           HZ2      TRP  44   1.478   0.854  -0.699
  274    HZ3  TRP  44           HZ3      TRP  44   1.496  -3.371  -0.944
  275    HH2  TRP  44           HH2      TRP  44   2.654  -1.276  -0.509
  276    HB2  TRP  44           HB2      TRP  44  -3.840  -2.420  -1.295
  277    HB3  TRP  44           HB1      TRP  44  -2.965  -2.791  -2.776
  278    H    VAL  45           HN       VAL  45  -4.621   0.972  -3.021
  279    HA   VAL  45           HA       VAL  45  -4.712   1.783  -5.630
  280    HB   VAL  45           HB       VAL  45  -3.160   3.186  -3.450
  281   HG11  VAL  45          HG11      VAL  45  -3.893   5.229  -4.594
  282   HG12  VAL  45          HG12      VAL  45  -4.647   4.245  -5.849
  283   HG13  VAL  45          HG13      VAL  45  -2.896   4.210  -5.631
  284   HG21  VAL  45          HG21      VAL  45  -5.260   2.631  -2.485
  285   HG22  VAL  45          HG22      VAL  45  -6.124   3.077  -3.956
  286   HG23  VAL  45          HG23      VAL  45  -5.351   4.322  -2.977
  287    H    VAL  46           HN       VAL  46  -1.983   0.295  -4.068
  288    HA   VAL  46           HA       VAL  46  -0.062   1.474  -5.831
  289    HB   VAL  46           HB       VAL  46   0.041  -0.462  -3.585
  290   HG11  VAL  46          HG11      VAL  46   2.190  -1.429  -4.179
  291   HG12  VAL  46          HG12      VAL  46   2.106  -0.691  -5.778
  292   HG13  VAL  46          HG13      VAL  46   0.939  -1.933  -5.317
  293   HG21  VAL  46          HG21      VAL  46   0.759   1.874  -3.437
  294   HG22  VAL  46          HG22      VAL  46   1.984   1.587  -4.673
  295   HG23  VAL  46          HG23      VAL  46   2.096   0.773  -3.112
  296    H    GLY  47           HN       GLY  47  -2.322  -1.052  -6.207
  297    HA2  GLY  47           HA2      GLY  47  -0.894  -2.562  -8.141
  298    HA3  GLY  47           HA1      GLY  47  -2.663  -2.495  -7.979
  299    H    LYS  48           HN       LYS  48  -2.185   0.585  -8.226
  300    HA   LYS  48           HA       LYS  48  -2.054   0.621 -11.157
  301    HB2  LYS  48           HB2      LYS  48  -3.253   2.787 -10.957
  302    HB3  LYS  48           HB1      LYS  48  -4.187   1.409 -10.413
  303    HG2  LYS  48           HG2      LYS  48  -4.618   2.626  -8.603
  304    HG3  LYS  48           HG1      LYS  48  -2.941   2.337  -8.136
  305    HD2  LYS  48           HD2      LYS  48  -3.484   4.715  -8.056
  306    HD3  LYS  48           HD1      LYS  48  -2.252   4.372  -9.270
  307    HE2  LYS  48           HE2      LYS  48  -3.876   4.523 -11.040
  308    HE3  LYS  48           HE1      LYS  48  -5.187   4.686  -9.874
  309    HZ1  LYS  48           HZ1      LYS  48  -4.470   6.806 -10.907
  310    HZ2  LYS  48           HZ2      LYS  48  -2.972   6.638 -10.138
  311    HZ3  LYS  48           HZ3      LYS  48  -4.377   6.810  -9.211
  312    H    ASP  49           HN       ASP  49  -0.736   1.872  -8.234
  313    HA   ASP  49           HA       ASP  49   0.742   4.006  -9.512
  314    HB2  ASP  49           HB2      ASP  49   0.254   3.078  -6.727
  315    HB3  ASP  49           HB1      ASP  49   1.744   3.946  -7.022
  316    H    LYS  50           HN       LYS  50   1.202   0.699  -8.829
  317    HA   LYS  50           HA       LYS  50   3.827   0.468  -8.076
  318    HB2  LYS  50           HB2      LYS  50   2.125  -1.400  -8.250
  319    HB3  LYS  50           HB1      LYS  50   2.495  -1.456  -9.970
  320    HG2  LYS  50           HG2      LYS  50   4.856  -1.907  -9.438
  321    HG3  LYS  50           HG1      LYS  50   4.446  -1.922  -7.726
  322    HD2  LYS  50           HD2      LYS  50   2.913  -3.791  -8.116
  323    HD3  LYS  50           HD1      LYS  50   3.357  -3.790  -9.823
  324    HE2  LYS  50           HE2      LYS  50   5.304  -4.195  -7.559
  325    HE3  LYS  50           HE1      LYS  50   4.530  -5.505  -8.438
  326    HZ1  LYS  50           HZ1      LYS  50   6.677  -5.161  -9.370
  327    HZ2  LYS  50           HZ2      LYS  50   6.431  -3.500  -9.529
  328    HZ3  LYS  50           HZ3      LYS  50   5.560  -4.578 -10.503
  329    HA   PRO  51           HA       PRO  51   4.894   0.005 -12.979
  330    HB2  PRO  51           HB2      PRO  51   3.209   2.409 -13.574
  331    HB3  PRO  51           HB1      PRO  51   3.683   1.071 -14.637
  332    HG2  PRO  51           HG2      PRO  51   1.253   1.157 -13.533
  333    HG3  PRO  51           HG1      PRO  51   2.120  -0.376 -13.735
  334    HD2  PRO  51           HD2      PRO  51   1.561   1.164 -11.271
  335    HD3  PRO  51           HD1      PRO  51   1.871  -0.571 -11.480
  336    H    THR  52           HN       THR  52   4.201   3.064 -11.310
  337    HA   THR  52           HA       THR  52   6.382   4.462 -12.518
  338    HB   THR  52           HB       THR  52   4.618   5.151 -10.157
  339    HG1  THR  52           HG1      THR  52   4.547   5.685 -12.937
  340   HG21  THR  52          HG21      THR  52   6.728   6.375 -10.025
  341   HG22  THR  52          HG22      THR  52   5.401   7.455 -10.458
  342   HG23  THR  52          HG23      THR  52   6.538   6.908 -11.694
  343    H    TYR  53           HN       TYR  53   5.768   2.980  -9.369
  344    HA   TYR  53           HA       TYR  53   8.282   3.788  -8.246
  345    HD1  TYR  53           HD2      TYR  53   6.749   5.205  -7.248
  346    HD2  TYR  53           HD1      TYR  53   4.574   1.691  -6.272
  347    HE1  TYR  53           HE2      TYR  53   4.822   6.584  -6.578
  348    HE2  TYR  53           HE1      TYR  53   2.654   3.047  -5.616
  349    HH   TYR  53           HH       TYR  53   2.197   6.127  -6.433
  350    HB2  TYR  53           HB2      TYR  53   6.573   1.492  -7.351
  351    HB3  TYR  53           HB1      TYR  53   7.647   2.472  -6.380
  352    H    ASP  54           HN       ASP  54   7.097   1.208 -10.152
  353    HA   ASP  54           HA       ASP  54   9.189  -0.685  -9.506
  354    HB2  ASP  54           HB2      ASP  54   6.850  -1.295 -10.156
  355    HB3  ASP  54           HB1      ASP  54   7.151  -0.660 -11.767
  356    H    GLU  55           HN       GLU  55   8.435   1.575 -12.149
  357    HA   GLU  55           HA       GLU  55  10.644   0.871 -13.790
  358    HB2  GLU  55           HB2      GLU  55  10.237   2.951 -14.977
  359    HB3  GLU  55           HB1      GLU  55   8.724   2.121 -14.669
  360    HG2  GLU  55           HG2      GLU  55   8.343   3.640 -12.738
  361    HG3  GLU  55           HG1      GLU  55   9.801   4.524 -13.218
  362    H    ILE  56           HN       ILE  56  10.218   3.315 -11.245
  363    HA   ILE  56           HA       ILE  56  12.895   4.274 -11.430
  364    HB   ILE  56           HB       ILE  56  11.073   4.353  -9.009
  365   HG12  ILE  56          HG12      ILE  56  11.454   6.497 -11.111
  366   HG13  ILE  56          HG11      ILE  56  10.118   5.340 -11.139
  367   HG21  ILE  56          HG21      ILE  56  12.424   6.293  -8.353
  368   HG22  ILE  56          HG22      ILE  56  13.455   6.057  -9.764
  369   HG23  ILE  56          HG23      ILE  56  13.410   4.838  -8.489
  370   HD11  ILE  56          HD11      ILE  56  10.677   7.354  -8.976
  371   HD12  ILE  56          HD12      ILE  56   9.375   6.165  -8.957
  372   HD13  ILE  56          HD13      ILE  56   9.395   7.433 -10.186
  373    H    PHE  57           HN       PHE  57  11.334   1.634  -9.803
  374    HA   PHE  57           HA       PHE  57  13.288   0.868  -7.978
  375    HD1  PHE  57           HD1      PHE  57  12.957  -1.040  -6.267
  376    HD2  PHE  57           HD2      PHE  57  11.794  -2.919  -9.899
  377    HE1  PHE  57           HE1      PHE  57  13.800  -3.189  -5.422
  378    HE2  PHE  57           HE2      PHE  57  12.630  -5.065  -9.052
  379    HZ   PHE  57           HZ       PHE  57  13.631  -5.217  -6.838
  380    HB2  PHE  57           HB2      PHE  57  11.123  -0.126  -7.919
  381    HB3  PHE  57           HB1      PHE  57  11.271  -0.709  -9.570
  382    H    TYR  58           HN       TYR  58  12.817  -0.350 -11.315
  383    HA   TYR  58           HA       TYR  58  15.284  -1.776 -11.292
  384    HD1  TYR  58           HD2      TYR  58  14.991  -4.074 -12.184
  385    HD2  TYR  58           HD1      TYR  58  11.426  -1.991 -13.197
  386    HE1  TYR  58           HE2      TYR  58  13.669  -6.042 -11.539
  387    HE2  TYR  58           HE1      TYR  58  10.098  -3.956 -12.554
  388    HH   TYR  58           HH       TYR  58  11.124  -6.335 -10.668
  389    HB2  TYR  58           HB2      TYR  58  13.469  -0.946 -13.564
  390    HB3  TYR  58           HB1      TYR  58  14.904  -1.960 -13.773
  391    H    THR  59           HN       THR  59  14.401   1.454 -11.922
  392    HA   THR  59           HA       THR  59  16.723   2.259 -13.360
  393    HB   THR  59           HB       THR  59  14.607   3.740 -11.807
  394    HG1  THR  59           HG1      THR  59  13.816   2.990 -13.716
  395   HG21  THR  59          HG21      THR  59  16.817   4.954 -13.461
  396   HG22  THR  59          HG22      THR  59  16.653   5.076 -11.707
  397   HG23  THR  59          HG23      THR  59  15.450   5.818 -12.758
  398    H    LEU  60           HN       LEU  60  15.976   1.738 -10.002
  399    HA   LEU  60           HA       LEU  60  18.415   3.087  -9.127
  400    HG   LEU  60           HG       LEU  60  15.452   3.909  -8.309
  401    HB2  LEU  60           HB2      LEU  60  16.189   1.747  -7.588
  402    HB3  LEU  60           HB1      LEU  60  17.618   2.429  -6.830
  403   HD11  LEU  60          HD11      LEU  60  16.489   4.159  -5.490
  404   HD12  LEU  60          HD12      LEU  60  15.039   3.272  -5.953
  405   HD13  LEU  60          HD13      LEU  60  15.121   5.018  -6.199
  406   HD21  LEU  60          HD21      LEU  60  18.088   4.946  -7.268
  407   HD22  LEU  60          HD22      LEU  60  16.747   5.946  -7.828
  408   HD23  LEU  60          HD23      LEU  60  17.580   4.878  -8.957
  409    H    SER  61           HN       SER  61  17.848   0.290 -10.533
  410    HA   SER  61           HA       SER  61  19.061  -1.594 -10.816
  411    HG   SER  61           HG       SER  61  21.521  -2.450  -9.198
  412    HB2  SER  61           HB2      SER  61  21.006  -0.098 -10.697
  413    HB3  SER  61           HB1      SER  61  21.038  -0.276  -8.943
  414    HA   PRO  62           HA       PRO  62  17.508  -3.621  -7.019
  415    HB2  PRO  62           HB2      PRO  62  16.408  -5.613  -8.785
  416    HB3  PRO  62           HB1      PRO  62  15.558  -4.480  -7.731
  417    HG2  PRO  62           HG2      PRO  62  15.536  -4.386 -10.482
  418    HG3  PRO  62           HG1      PRO  62  15.179  -3.010  -9.417
  419    HD2  PRO  62           HD2      PRO  62  17.656  -3.654 -10.945
  420    HD3  PRO  62           HD1      PRO  62  16.939  -2.078 -10.544
  421    H    VAL  63           HN       VAL  63  18.425  -5.290  -5.980
  422    HA   VAL  63           HA       VAL  63  20.112  -7.157  -7.516
  423    HB   VAL  63           HB       VAL  63  20.574  -6.208  -4.673
  424   HG11  VAL  63          HG11      VAL  63  22.732  -7.366  -4.884
  425   HG12  VAL  63          HG12      VAL  63  22.245  -7.959  -6.474
  426   HG13  VAL  63          HG13      VAL  63  21.362  -8.466  -5.036
  427   HG21  VAL  63          HG21      VAL  63  22.085  -5.486  -7.184
  428   HG22  VAL  63          HG22      VAL  63  22.507  -5.003  -5.540
  429   HG23  VAL  63          HG23      VAL  63  21.013  -4.421  -6.273
  430    H    ASN  64           HN       ASN  64  19.243  -9.130  -7.477
  431    HA   ASN  64           HA       ASN  64  18.238 -11.053  -6.780
  432    HB2  ASN  64           HB2      ASN  64  18.405  -9.808  -4.020
  433    HB3  ASN  64           HB1      ASN  64  17.974 -11.488  -4.361
  434   HD21  ASN  64          HD21      ASN  64  20.227 -10.149  -2.899
  435   HD22  ASN  64          HD22      ASN  64  21.645 -10.892  -3.558
  436    H    GLY  65           HN       GLY  65  16.770  -8.433  -7.319
  437    HA2  GLY  65           HA2      GLY  65  14.498  -8.318  -7.933
  438    HA3  GLY  65           HA1      GLY  65  14.140  -9.552  -6.737
  439    H    LYS  66           HN       LYS  66  16.132  -6.897  -5.779
  440    HA   LYS  66           HA       LYS  66  13.997  -5.196  -4.911
  441    HB2  LYS  66           HB2      LYS  66  14.599  -5.327  -2.474
  442    HB3  LYS  66           HB1      LYS  66  13.791  -6.756  -3.096
  443    HG2  LYS  66           HG2      LYS  66  16.760  -6.635  -2.962
  444    HG3  LYS  66           HG1      LYS  66  15.810  -7.043  -1.534
  445    HD2  LYS  66           HD2      LYS  66  14.942  -8.461  -3.887
  446    HD3  LYS  66           HD1      LYS  66  16.636  -8.776  -3.530
  447    HE2  LYS  66           HE2      LYS  66  16.121  -9.554  -1.372
  448    HE3  LYS  66           HE1      LYS  66  14.459  -8.978  -1.470
  449    HZ1  LYS  66           HZ1      LYS  66  14.092 -10.616  -3.257
  450    HZ2  LYS  66           HZ2      LYS  66  14.523 -11.345  -1.786
  451    HZ3  LYS  66           HZ3      LYS  66  15.668 -11.204  -3.024
  452    H    ILE  67           HN       ILE  67  14.784  -3.206  -3.957
  453    HA   ILE  67           HA       ILE  67  17.482  -2.605  -4.886
  454    HB   ILE  67           HB       ILE  67  16.889  -0.259  -3.907
  455   HG12  ILE  67          HG12      ILE  67  14.157  -1.546  -4.088
  456   HG13  ILE  67          HG11      ILE  67  14.933  -0.916  -2.642
  457   HG21  ILE  67          HG21      ILE  67  15.694   0.321  -6.010
  458   HG22  ILE  67          HG22      ILE  67  15.525  -1.401  -6.356
  459   HG23  ILE  67          HG23      ILE  67  17.128  -0.671  -6.273
  460   HD11  ILE  67          HD11      ILE  67  14.081   0.704  -5.022
  461   HD12  ILE  67          HD12      ILE  67  14.802   1.330  -3.536
  462   HD13  ILE  67          HD13      ILE  67  13.211   0.571  -3.495
  463    H    THR  68           HN       THR  68  19.206  -2.343  -3.619
  464    HA   THR  68           HA       THR  68  19.218  -2.974  -0.900
  465    HB   THR  68           HB       THR  68  21.408  -1.517  -0.979
  466    HG1  THR  68           HG1      THR  68  22.154  -1.184  -3.094
  467   HG21  THR  68          HG21      THR  68  22.575  -3.411  -2.096
  468   HG22  THR  68          HG22      THR  68  21.003  -4.048  -2.582
  469   HG23  THR  68          HG23      THR  68  21.418  -3.934  -0.871
  470    H    GLY  69           HN       GLY  69  18.818  -1.787   0.893
  471    HA2  GLY  69           HA2      GLY  69  16.752  -0.016   0.587
  472    HA3  GLY  69           HA1      GLY  69  17.633  -0.249   2.086
  473    H    ALA  70           HN       ALA  70  20.143   0.784   0.962
  474    HA   ALA  70           HA       ALA  70  19.952   3.438   1.737
  475    HB1  ALA  70           HB1      ALA  70  22.063   2.156   1.530
  476    HB2  ALA  70           HB2      ALA  70  22.147   3.762   0.811
  477    HB3  ALA  70           HB3      ALA  70  21.970   2.345  -0.222
  478    H    ASN  71           HN       ASN  71  19.207   2.064  -1.391
  479    HA   ASN  71           HA       ASN  71  19.382   4.565  -2.822
  480    HB2  ASN  71           HB2      ASN  71  17.872   2.149  -3.789
  481    HB3  ASN  71           HB1      ASN  71  18.732   3.357  -4.738
  482   HD21  ASN  71          HD21      ASN  71  18.878   0.400  -4.587
  483   HD22  ASN  71          HD22      ASN  71  20.526   0.025  -4.261
  484    H    ALA  72           HN       ALA  72  16.837   2.505  -1.502
  485    HA   ALA  72           HA       ALA  72  14.679   4.180  -2.312
  486    HB1  ALA  72           HB1      ALA  72  14.341   1.825  -1.769
  487    HB2  ALA  72           HB2      ALA  72  13.342   2.862  -0.751
  488    HB3  ALA  72           HB3      ALA  72  14.811   2.136  -0.098
  489    H    LYS  73           HN       LYS  73  16.803   3.976   0.422
  490    HA   LYS  73           HA       LYS  73  15.527   5.897   2.067
  491    HB2  LYS  73           HB2      LYS  73  18.454   5.122   1.899
  492    HB3  LYS  73           HB1      LYS  73  17.761   6.136   3.159
  493    HG2  LYS  73           HG2      LYS  73  17.112   3.253   2.607
  494    HG3  LYS  73           HG1      LYS  73  18.018   3.900   3.976
  495    HD2  LYS  73           HD2      LYS  73  15.206   4.767   3.414
  496    HD3  LYS  73           HD1      LYS  73  15.551   3.293   4.325
  497    HE2  LYS  73           HE2      LYS  73  16.775   4.551   5.972
  498    HE3  LYS  73           HE1      LYS  73  16.581   6.041   5.041
  499    HZ1  LYS  73           HZ1      LYS  73  14.177   5.851   5.371
  500    HZ2  LYS  73           HZ2      LYS  73  15.003   5.943   6.852
  501    HZ3  LYS  73           HZ3      LYS  73  14.410   4.457   6.304
  502    H    LYS  74           HN       LYS  74  17.861   6.053  -0.529
  503    HA   LYS  74           HA       LYS  74  18.517   8.762  -0.473
  504    HB2  LYS  74           HB2      LYS  74  19.340   6.764  -1.967
  505    HB3  LYS  74           HB1      LYS  74  18.067   7.306  -3.054
  506    HG2  LYS  74           HG2      LYS  74  20.265   8.234  -3.613
  507    HG3  LYS  74           HG1      LYS  74  19.079   9.481  -3.219
  508    HD2  LYS  74           HD2      LYS  74  21.265   9.894  -2.186
  509    HD3  LYS  74           HD1      LYS  74  19.987   9.699  -0.997
  510    HE2  LYS  74           HE2      LYS  74  21.969   8.514  -0.279
  511    HE3  LYS  74           HE1      LYS  74  20.680   7.373  -0.653
  512    HZ1  LYS  74           HZ1      LYS  74  21.932   6.400  -2.198
  513    HZ2  LYS  74           HZ2      LYS  74  23.241   7.316  -1.612
  514    HZ3  LYS  74           HZ3      LYS  74  22.337   7.884  -2.920
  515    H    GLU  75           HN       GLU  75  15.902   7.061  -2.098
  516    HA   GLU  75           HA       GLU  75  14.626   9.203  -3.315
  517    HB2  GLU  75           HB2      GLU  75  13.342   6.732  -2.134
  518    HB3  GLU  75           HB1      GLU  75  12.562   7.829  -3.262
  519    HG2  GLU  75           HG2      GLU  75  14.837   5.932  -3.768
  520    HG3  GLU  75           HG1      GLU  75  13.247   5.975  -4.521
  521    H    MET  76           HN       MET  76  13.947   7.817  -0.124
  522    HA   MET  76           HA       MET  76  11.963   9.782   0.455
  523    HB2  MET  76           HB2      MET  76  12.121   8.799   2.802
  524    HB3  MET  76           HB1      MET  76  11.663   7.704   1.506
  525    HG2  MET  76           HG2      MET  76  13.900   6.833   1.416
  526    HG3  MET  76           HG1      MET  76  14.426   7.981   2.638
  527    HE1  MET  76           HE1      MET  76  11.162   5.626   2.373
  528    HE2  MET  76           HE2      MET  76  11.796   4.252   3.281
  529    HE3  MET  76           HE3      MET  76  12.569   4.745   1.776
  530    H    VAL  77           HN       VAL  77  15.405   9.655   0.916
  531    HA   VAL  77           HA       VAL  77  15.639  11.743   2.831
  532    HB   VAL  77           HB       VAL  77  17.542  10.645   0.763
  533   HG11  VAL  77          HG11      VAL  77  18.149  12.868   2.719
  534   HG12  VAL  77          HG12      VAL  77  18.015  13.051   0.968
  535   HG13  VAL  77          HG13      VAL  77  19.306  12.067   1.657
  536   HG21  VAL  77          HG21      VAL  77  18.803   9.922   2.732
  537   HG22  VAL  77          HG22      VAL  77  17.156   9.290   2.756
  538   HG23  VAL  77          HG23      VAL  77  17.592  10.656   3.782
  539    H    LYS  78           HN       LYS  78  15.994  11.773  -0.722
  540    HA   LYS  78           HA       LYS  78  16.282  14.586  -0.906
  541    HB2  LYS  78           HB2      LYS  78  16.070  14.267  -3.291
  542    HB3  LYS  78           HB1      LYS  78  17.105  13.018  -2.603
  543    HG2  LYS  78           HG2      LYS  78  15.118  11.520  -2.550
  544    HG3  LYS  78           HG1      LYS  78  14.243  12.754  -3.455
  545    HD2  LYS  78           HD2      LYS  78  15.977  12.618  -5.208
  546    HD3  LYS  78           HD1      LYS  78  16.713  11.275  -4.327
  547    HE2  LYS  78           HE2      LYS  78  14.512  10.111  -4.435
  548    HE3  LYS  78           HE1      LYS  78  13.949  11.401  -5.500
  549    HZ1  LYS  78           HZ1      LYS  78  16.178   9.511  -6.029
  550    HZ2  LYS  78           HZ2      LYS  78  15.746  10.802  -7.053
  551    HZ3  LYS  78           HZ3      LYS  78  14.664   9.524  -6.786
  552    H    SER  79           HN       SER  79  13.576  12.566  -0.510
  553    HA   SER  79           HA       SER  79  11.544  14.231  -1.536
  554    HG   SER  79           HG       SER  79   9.585  13.465  -1.137
  555    HB2  SER  79           HB2      SER  79  11.361  11.806  -0.746
  556    HB3  SER  79           HB1      SER  79  11.251  12.466   0.891
  557    H    LYS  80           HN       LYS  80  13.690  14.744   0.987
  558    HA   LYS  80           HA       LYS  80  14.051  16.559   2.280
  559    HB2  LYS  80           HB2      LYS  80  11.496  17.636   1.085
  560    HB3  LYS  80           HB1      LYS  80  12.635  18.560   2.061
  561    HG2  LYS  80           HG2      LYS  80  14.347  18.312   0.381
  562    HG3  LYS  80           HG1      LYS  80  13.311  17.245  -0.567
  563    HD2  LYS  80           HD2      LYS  80  13.279  19.440  -1.544
  564    HD3  LYS  80           HD1      LYS  80  11.705  19.113  -0.821
  565    HE2  LYS  80           HE2      LYS  80  12.316  20.426   1.135
  566    HE3  LYS  80           HE1      LYS  80  13.910  20.727   0.445
  567    HZ1  LYS  80           HZ1      LYS  80  11.312  21.627  -0.668
  568    HZ2  LYS  80           HZ2      LYS  80  12.814  21.847  -1.423
  569    HZ3  LYS  80           HZ3      LYS  80  12.488  22.610   0.059
  570    H    LEU  81           HN       LEU  81  13.633  14.882   3.890
  571    HA   LEU  81           HA       LEU  81  11.350  15.620   5.596
  572    HG   LEU  81           HG       LEU  81  11.116  13.542   3.222
  573    HB2  LEU  81           HB2      LEU  81  12.438  12.829   5.244
  574    HB3  LEU  81           HB1      LEU  81  11.069  13.306   6.223
  575   HD11  LEU  81          HD11      LEU  81   9.717  11.523   3.239
  576   HD12  LEU  81          HD12      LEU  81   9.985  11.362   4.974
  577   HD13  LEU  81          HD13      LEU  81  11.338  11.207   3.853
  578   HD21  LEU  81          HD21      LEU  81   9.552  15.038   4.370
  579   HD22  LEU  81          HD22      LEU  81   8.874  13.663   5.242
  580   HD23  LEU  81          HD23      LEU  81   8.693  13.773   3.491
  581    HA   PRO  82           HA       PRO  82  14.449  15.296   8.900
  582    HB2  PRO  82           HB2      PRO  82  12.848  14.705  10.996
  583    HB3  PRO  82           HB1      PRO  82  12.908  16.333  10.287
  584    HG2  PRO  82           HG2      PRO  82  10.894  14.159   9.874
  585    HG3  PRO  82           HG1      PRO  82  10.637  15.897  10.090
  586    HD2  PRO  82           HD2      PRO  82  10.603  14.645   7.671
  587    HD3  PRO  82           HD1      PRO  82  11.054  16.348   7.890
  588    H    ASN  83           HN       ASN  83  15.112  13.634  10.569
  589    HA   ASN  83           HA       ASN  83  15.381  11.150   9.236
  590    HB2  ASN  83           HB2      ASN  83  16.079  11.939  12.068
  591    HB3  ASN  83           HB1      ASN  83  16.534  10.412  11.326
  592   HD21  ASN  83          HD21      ASN  83  16.991  11.693   8.696
  593   HD22  ASN  83          HD22      ASN  83  18.500  12.517   8.856
  594    H    THR  84           HN       THR  84  13.238  12.276  11.760
  595    HA   THR  84           HA       THR  84  12.392   9.780  12.746
  596    HB   THR  84           HB       THR  84  10.665  12.249  12.615
  597    HG1  THR  84           HG1      THR  84  12.013  13.228  13.933
  598   HG21  THR  84          HG21      THR  84   9.889  11.419  14.811
  599   HG22  THR  84          HG22      THR  84  10.941  10.015  14.630
  600   HG23  THR  84          HG23      THR  84   9.598  10.259  13.514
  601    H    VAL  85           HN       VAL  85  10.938  11.927  10.304
  602    HA   VAL  85           HA       VAL  85   8.788  10.240   9.626
  603    HB   VAL  85           HB       VAL  85  10.134  12.338   7.909
  604   HG11  VAL  85          HG11      VAL  85   8.789  10.818   6.561
  605   HG12  VAL  85          HG12      VAL  85   8.015  12.399   6.675
  606   HG13  VAL  85          HG13      VAL  85   7.417  11.050   7.643
  607   HG21  VAL  85          HG21      VAL  85   9.293  13.220  10.030
  608   HG22  VAL  85          HG22      VAL  85   7.709  12.525   9.693
  609   HG23  VAL  85          HG23      VAL  85   8.346  13.808   8.665
  610    H    LEU  86           HN       LEU  86  12.052  10.548   8.310
  611    HA   LEU  86           HA       LEU  86  11.808   8.791   6.146
  612    HG   LEU  86           HG       LEU  86  13.386   9.239   4.839
  613    HB2  LEU  86           HB2      LEU  86  13.909  10.085   7.590
  614    HB3  LEU  86           HB1      LEU  86  14.367   8.414   7.261
  615   HD11  LEU  86          HD11      LEU  86  14.962  11.521   6.022
  616   HD12  LEU  86          HD12      LEU  86  13.237  11.552   5.661
  617   HD13  LEU  86          HD13      LEU  86  14.408  11.379   4.353
  618   HD21  LEU  86          HD21      LEU  86  15.374   7.906   5.333
  619   HD22  LEU  86          HD22      LEU  86  16.218   9.369   5.838
  620   HD23  LEU  86          HD23      LEU  86  15.706   9.182   4.161
  621    H    GLY  87           HN       GLY  87  12.834   8.176   9.480
  622    HA2  GLY  87           HA2      GLY  87  13.366   5.443   9.195
  623    HA3  GLY  87           HA1      GLY  87  12.956   6.247  10.703
  624    H    LYS  88           HN       LYS  88  10.362   7.149   9.829
  625    HA   LYS  88           HA       LYS  88   9.039   4.644  10.458
  626    HB2  LYS  88           HB2      LYS  88   7.116   5.903  11.049
  627    HB3  LYS  88           HB1      LYS  88   8.504   6.785  11.667
  628    HG2  LYS  88           HG2      LYS  88   8.371   8.319   9.770
  629    HG3  LYS  88           HG1      LYS  88   6.978   7.432   9.160
  630    HD2  LYS  88           HD2      LYS  88   7.183   9.082  11.675
  631    HD3  LYS  88           HD1      LYS  88   6.112   9.332  10.294
  632    HE2  LYS  88           HE2      LYS  88   5.003   7.169  10.863
  633    HE3  LYS  88           HE1      LYS  88   5.972   7.122  12.338
  634    HZ1  LYS  88           HZ1      LYS  88   3.888   9.091  11.589
  635    HZ2  LYS  88           HZ2      LYS  88   5.006   9.386  12.827
  636    HZ3  LYS  88           HZ3      LYS  88   3.935   8.078  12.954
  637    H    ILE  89           HN       ILE  89   9.249   6.886   7.763
  638    HA   ILE  89           HA       ILE  89   7.373   5.695   6.060
  639    HB   ILE  89           HB       ILE  89   9.997   7.075   5.497
  640   HG12  ILE  89          HG12      ILE  89   8.036   8.410   6.277
  641   HG13  ILE  89          HG11      ILE  89   8.615   8.876   4.682
  642   HG21  ILE  89          HG21      ILE  89   9.695   5.435   3.731
  643   HG22  ILE  89          HG22      ILE  89   9.434   7.068   3.113
  644   HG23  ILE  89          HG23      ILE  89   8.056   6.019   3.449
  645   HD11  ILE  89          HD11      ILE  89   6.802   7.567   3.670
  646   HD12  ILE  89          HD12      ILE  89   6.212   8.851   4.726
  647   HD13  ILE  89          HD13      ILE  89   6.208   7.178   5.286
  648    H    TRP  90           HN       TRP  90  10.796   4.985   6.621
  649    HA   TRP  90           HA       TRP  90  11.088   2.854   4.848
  650    HD1  TRP  90           HD1      TRP  90  13.351   0.898   8.158
  651    HE1  TRP  90           HE1      TRP  90  14.661  -0.944   6.903
  652    HE3  TRP  90           HE3      TRP  90  13.231   2.887   3.437
  653    HZ2  TRP  90           HZ2      TRP  90  15.524  -1.468   4.264
  654    HZ3  TRP  90           HZ3      TRP  90  14.318   1.645   1.614
  655    HH2  TRP  90           HH2      TRP  90  15.442  -0.484   2.019
  656    HB2  TRP  90           HB2      TRP  90  12.980   3.908   5.988
  657    HB3  TRP  90           HB1      TRP  90  12.432   3.238   7.521
  658    H    LYS  91           HN       LYS  91  10.260   2.769   8.308
  659    HA   LYS  91           HA       LYS  91  10.117  -0.091   8.274
  660    HB2  LYS  91           HB2      LYS  91   9.722   0.060  10.627
  661    HB3  LYS  91           HB1      LYS  91  10.942   1.247  10.198
  662    HG2  LYS  91           HG2      LYS  91   9.267   3.015  10.270
  663    HG3  LYS  91           HG1      LYS  91   8.043   1.828  10.730
  664    HD2  LYS  91           HD2      LYS  91   8.853   2.946  12.716
  665    HD3  LYS  91           HD1      LYS  91   9.399   1.267  12.720
  666    HE2  LYS  91           HE2      LYS  91  11.581   1.956  11.891
  667    HE3  LYS  91           HE1      LYS  91  11.047   3.635  11.855
  668    HZ1  LYS  91           HZ1      LYS  91  11.264   1.945  14.291
  669    HZ2  LYS  91           HZ2      LYS  91  10.773   3.565  14.249
  670    HZ3  LYS  91           HZ3      LYS  91  12.361   3.154  13.825
  671    H    LEU  92           HN       LEU  92   7.918   2.314   7.433
  672    HA   LEU  92           HA       LEU  92   5.607   0.650   8.063
  673    HG   LEU  92           HG       LEU  92   3.464   1.927   6.567
  674    HB2  LEU  92           HB2      LEU  92   5.624   3.188   8.271
  675    HB3  LEU  92           HB1      LEU  92   5.617   3.230   6.504
  676   HD11  LEU  92          HD11      LEU  92   3.712   0.974   8.804
  677   HD12  LEU  92          HD12      LEU  92   2.209   1.889   8.657
  678   HD13  LEU  92          HD13      LEU  92   3.586   2.587   9.507
  679   HD21  LEU  92          HD21      LEU  92   3.484   4.331   6.209
  680   HD22  LEU  92          HD22      LEU  92   3.493   4.606   7.952
  681   HD23  LEU  92          HD23      LEU  92   2.093   3.858   7.184
  682    H    ALA  93           HN       ALA  93   7.635   1.595   5.368
  683    HA   ALA  93           HA       ALA  93   5.934   0.368   3.388
  684    HB1  ALA  93           HB1      ALA  93   8.772   1.372   3.183
  685    HB2  ALA  93           HB2      ALA  93   7.314   2.285   2.791
  686    HB3  ALA  93           HB3      ALA  93   7.757   0.874   1.832
  687    H    ASP  94           HN       ASP  94   8.962  -0.423   5.065
  688    HA   ASP  94           HA       ASP  94   9.157  -2.955   3.644
  689    HB2  ASP  94           HB2      ASP  94  11.171  -1.540   4.224
  690    HB3  ASP  94           HB1      ASP  94  10.906  -1.982   5.901
  691    H    VAL  95           HN       VAL  95   7.574  -4.274   4.279
  692    HA   VAL  95           HA       VAL  95   6.694  -4.504   6.977
  693    HB   VAL  95           HB       VAL  95   5.321  -6.384   6.207
  694   HG11  VAL  95          HG11      VAL  95   3.916  -5.114   4.667
  695   HG12  VAL  95          HG12      VAL  95   5.240  -3.979   4.392
  696   HG13  VAL  95          HG13      VAL  95   4.497  -4.099   5.986
  697   HG21  VAL  95          HG21      VAL  95   5.317  -7.020   3.875
  698   HG22  VAL  95          HG22      VAL  95   6.909  -7.287   4.589
  699   HG23  VAL  95          HG23      VAL  95   6.630  -5.890   3.548
  700    H    ASP  96           HN       ASP  96   9.068  -6.087   5.081
  701    HA   ASP  96           HA       ASP  96   9.345  -8.312   6.924
  702    HB2  ASP  96           HB2      ASP  96  11.538  -7.669   5.082
  703    HB3  ASP  96           HB1      ASP  96  10.771  -9.227   5.392
  704    H    LYS  97           HN       LYS  97  10.591  -5.157   6.398
  705    HA   LYS  97           HA       LYS  97  12.228  -3.895   7.290
  706    HB2  LYS  97           HB2      LYS  97  11.887  -5.772   9.628
  707    HB3  LYS  97           HB1      LYS  97  12.734  -4.226   9.670
  708    HG2  LYS  97           HG2      LYS  97  10.670  -3.103   8.997
  709    HG3  LYS  97           HG1      LYS  97   9.831  -4.647   9.027
  710    HD2  LYS  97           HD2      LYS  97  10.326  -4.880  11.411
  711    HD3  LYS  97           HD1      LYS  97  11.170  -3.328  11.383
  712    HE2  LYS  97           HE2      LYS  97   8.894  -3.100  12.249
  713    HE3  LYS  97           HE1      LYS  97   9.105  -2.198  10.756
  714    HZ1  LYS  97           HZ1      LYS  97   8.061  -4.085   9.580
  715    HZ2  LYS  97           HZ2      LYS  97   7.016  -3.352  10.698
  716    HZ3  LYS  97           HZ3      LYS  97   7.761  -4.828  11.072
  717    H    ASP  98           HN       ASP  98  13.474  -4.859   5.551
  718    HA   ASP  98           HA       ASP  98  15.404  -6.915   6.337
  719    HB2  ASP  98           HB2      ASP  98  15.185  -5.678   3.603
  720    HB3  ASP  98           HB1      ASP  98  15.813  -7.267   4.040
  721    H    GLY  99           HN       GLY  99  15.208  -3.610   5.159
  722    HA2  GLY  99           HA2      GLY  99  17.035  -2.030   5.310
  723    HA3  GLY  99           HA1      GLY  99  18.152  -3.397   5.326
  724    H    LEU 100           HN       LEU 100  15.560  -3.821   3.290
  725    HA   LEU 100           HA       LEU 100  16.584  -2.444   0.982
  726    HG   LEU 100           HG       LEU 100  16.477  -5.896   2.293
  727    HB2  LEU 100           HB2      LEU 100  16.627  -4.551  -0.393
  728    HB3  LEU 100           HB1      LEU 100  17.933  -4.401   0.764
  729   HD11  LEU 100          HD11      LEU 100  14.415  -5.791   1.031
  730   HD12  LEU 100          HD12      LEU 100  15.017  -7.451   1.081
  731   HD13  LEU 100          HD13      LEU 100  15.221  -6.481  -0.379
  732   HD21  LEU 100          HD21      LEU 100  18.582  -6.596   1.278
  733   HD22  LEU 100          HD22      LEU 100  17.730  -7.017  -0.207
  734   HD23  LEU 100          HD23      LEU 100  17.406  -7.908   1.278
  735    H    LEU 101           HN       LEU 101  15.014  -3.111  -0.959
  736    HA   LEU 101           HA       LEU 101  12.306  -3.489   0.085
  737    HG   LEU 101           HG       LEU 101  13.379  -0.741   1.100
  738    HB2  LEU 101           HB2      LEU 101  13.251  -0.984  -1.320
  739    HB3  LEU 101           HB1      LEU 101  11.557  -1.434  -1.211
  740   HD11  LEU 101          HD11      LEU 101  12.624   1.165  -0.249
  741   HD12  LEU 101          HD12      LEU 101  11.916   1.171   1.367
  742   HD13  LEU 101          HD13      LEU 101  10.953   0.650  -0.017
  743   HD21  LEU 101          HD21      LEU 101  11.779  -2.497   1.697
  744   HD22  LEU 101          HD22      LEU 101  10.464  -1.481   1.100
  745   HD23  LEU 101          HD23      LEU 101  11.411  -0.968   2.496
  746    H    ASP 102           HN       ASP 102  11.408  -4.940  -1.290
  747    HA   ASP 102           HA       ASP 102  12.568  -5.420  -3.867
  748    HB2  ASP 102           HB2      ASP 102  10.853  -7.165  -4.099
  749    HB3  ASP 102           HB1      ASP 102  11.685  -7.271  -2.554
  750    H    ASP 103           HN       ASP 103  10.556  -5.914  -5.609
  751    HA   ASP 103           HA       ASP 103  10.110  -3.428  -6.817
  752    HB2  ASP 103           HB2      ASP 103   8.152  -5.678  -7.187
  753    HB3  ASP 103           HB1      ASP 103   8.853  -4.607  -8.406
  754    H    GLU 104           HN       GLU 104   8.204  -5.268  -4.543
  755    HA   GLU 104           HA       GLU 104   5.851  -3.604  -4.903
  756    HB2  GLU 104           HB2      GLU 104   5.897  -6.149  -4.644
  757    HB3  GLU 104           HB1      GLU 104   6.255  -5.864  -2.951
  758    HG2  GLU 104           HG2      GLU 104   4.154  -4.769  -2.621
  759    HG3  GLU 104           HG1      GLU 104   3.799  -4.843  -4.362
  760    H    GLU 105           HN       GLU 105   8.541  -3.999  -2.758
  761    HA   GLU 105           HA       GLU 105   7.320  -2.482  -0.638
  762    HB2  GLU 105           HB2      GLU 105   9.619  -4.160  -0.860
  763    HB3  GLU 105           HB1      GLU 105  10.126  -2.582  -0.264
  764    HG2  GLU 105           HG2      GLU 105   8.756  -2.653   1.590
  765    HG3  GLU 105           HG1      GLU 105   7.705  -3.875   0.886
  766    H    PHE 106           HN       PHE 106   9.571  -1.822  -3.264
  767    HA   PHE 106           HA       PHE 106  10.028   0.892  -2.609
  768    HD1  PHE 106           HD1      PHE 106   9.158   2.616  -4.439
  769    HD2  PHE 106           HD2      PHE 106  12.618   0.779  -6.070
  770    HE1  PHE 106           HE1      PHE 106   9.891   4.779  -5.312
  771    HE2  PHE 106           HE2      PHE 106  13.352   2.954  -6.956
  772    HZ   PHE 106           HZ       PHE 106  12.086   4.897  -6.624
  773    HB2  PHE 106           HB2      PHE 106  11.235  -0.394  -4.425
  774    HB3  PHE 106           HB1      PHE 106   9.772  -0.285  -5.386
  775    H    ALA 107           HN       ALA 107   7.531  -0.825  -4.447
  776    HA   ALA 107           HA       ALA 107   5.933   1.249  -5.260
  777    HB1  ALA 107           HB1      ALA 107   5.492  -1.078  -5.816
  778    HB2  ALA 107           HB2      ALA 107   4.052  -0.310  -5.148
  779    HB3  ALA 107           HB3      ALA 107   5.017  -1.398  -4.149
  780    H    LEU 108           HN       LEU 108   5.816  -0.374  -2.073
  781    HA   LEU 108           HA       LEU 108   3.840   1.343  -1.005
  782    HG   LEU 108           HG       LEU 108   2.818   0.008   0.791
  783    HB2  LEU 108           HB2      LEU 108   4.870  -0.976  -0.184
  784    HB3  LEU 108           HB1      LEU 108   5.844   0.103   0.810
  785   HD11  LEU 108          HD11      LEU 108   3.012  -1.010   2.970
  786   HD12  LEU 108          HD12      LEU 108   4.772  -0.998   2.840
  787   HD13  LEU 108          HD13      LEU 108   3.812  -1.995   1.748
  788   HD21  LEU 108          HD21      LEU 108   2.990   1.392   2.800
  789   HD22  LEU 108          HD22      LEU 108   3.626   2.208   1.371
  790   HD23  LEU 108          HD23      LEU 108   4.732   1.512   2.555
  791    H    ALA 109           HN       ALA 109   7.391   1.380  -0.752
  792    HA   ALA 109           HA       ALA 109   7.713   3.437   1.072
  793    HB1  ALA 109           HB1      ALA 109   9.537   2.026   0.279
  794    HB2  ALA 109           HB2      ALA 109   9.939   3.738   0.129
  795    HB3  ALA 109           HB3      ALA 109   9.467   2.814  -1.296
  796    H    ASN 110           HN       ASN 110   7.638   3.720  -2.478
  797    HA   ASN 110           HA       ASN 110   7.989   6.543  -2.438
  798    HB2  ASN 110           HB2      ASN 110   8.571   4.887  -4.315
  799    HB3  ASN 110           HB1      ASN 110   6.865   4.977  -4.743
  800   HD21  ASN 110          HD21      ASN 110   9.895   6.614  -4.713
  801   HD22  ASN 110          HD22      ASN 110   9.417   7.992  -5.638
  802    H    HIS 111           HN       HIS 111   5.289   4.337  -2.471
  803    HA   HIS 111           HA       HIS 111   3.293   6.213  -3.197
  804    HD1  HIS 111           HD1      HIS 111   1.184   5.098  -4.618
  805    HD2  HIS 111           HD2      HIS 111   0.342   4.152  -0.655
  806    HE1  HIS 111           HE1      HIS 111  -1.308   5.362  -4.376
  807    HE2  HIS 111           HE2      HIS 111  -1.739   5.066  -1.902
  808    HB2  HIS 111           HB2      HIS 111   3.060   3.694  -3.268
  809    HB3  HIS 111           HB1      HIS 111   2.883   3.740  -1.508
  810    H    LEU 112           HN       LEU 112   4.664   5.161  -0.126
  811    HA   LEU 112           HA       LEU 112   2.960   6.721   1.513
  812    HG   LEU 112           HG       LEU 112   3.723   3.976   2.197
  813    HB2  LEU 112           HB2      LEU 112   5.652   5.458   1.884
  814    HB3  LEU 112           HB1      LEU 112   5.014   6.558   3.106
  815   HD11  LEU 112          HD11      LEU 112   4.288   3.201   4.442
  816   HD12  LEU 112          HD12      LEU 112   5.098   4.731   4.773
  817   HD13  LEU 112          HD13      LEU 112   5.737   3.647   3.539
  818   HD21  LEU 112          HD21      LEU 112   2.908   5.956   4.327
  819   HD22  LEU 112          HD22      LEU 112   2.165   4.381   4.042
  820   HD23  LEU 112          HD23      LEU 112   2.056   5.641   2.813
  821    H    ILE 113           HN       ILE 113   5.940   7.348  -0.204
  822    HA   ILE 113           HA       ILE 113   6.563   9.856   0.895
  823    HB   ILE 113           HB       ILE 113   7.152   8.633  -1.792
  824   HG12  ILE 113          HG12      ILE 113   8.912   9.254   0.588
  825   HG13  ILE 113          HG11      ILE 113   8.180   7.683   0.267
  826   HG21  ILE 113          HG21      ILE 113   8.763  10.438  -2.161
  827   HG22  ILE 113          HG22      ILE 113   8.198  11.241  -0.697
  828   HG23  ILE 113          HG23      ILE 113   7.113  11.055  -2.075
  829   HD11  ILE 113          HD11      ILE 113   9.462   7.500  -1.787
  830   HD12  ILE 113          HD12      ILE 113  10.526   7.778  -0.410
  831   HD13  ILE 113          HD13      ILE 113  10.148   9.101  -1.513
  832    H    LYS 114           HN       LYS 114   4.620   8.992  -1.977
  833    HA   LYS 114           HA       LYS 114   3.825  11.723  -2.383
  834    HB2  LYS 114           HB2      LYS 114   2.251  10.893  -4.034
  835    HB3  LYS 114           HB1      LYS 114   3.817  10.125  -4.239
  836    HG2  LYS 114           HG2      LYS 114   3.001   8.111  -3.152
  837    HG3  LYS 114           HG1      LYS 114   1.435   8.881  -2.885
  838    HD2  LYS 114           HD2      LYS 114   2.640   8.517  -5.616
  839    HD3  LYS 114           HD1      LYS 114   1.576   7.326  -4.866
  840    HE2  LYS 114           HE2      LYS 114  -0.212   8.948  -4.743
  841    HE3  LYS 114           HE1      LYS 114   0.853  10.209  -5.363
  842    HZ1  LYS 114           HZ1      LYS 114   1.000   9.107  -7.452
  843    HZ2  LYS 114           HZ2      LYS 114  -0.649   9.231  -7.056
  844    HZ3  LYS 114           HZ3      LYS 114   0.160   7.745  -6.882
  845    H    VAL 115           HN       VAL 115   2.596   9.108  -0.444
  846    HA   VAL 115           HA       VAL 115   0.029  10.122   0.096
  847    HB   VAL 115           HB       VAL 115   1.842   8.226   1.540
  848   HG11  VAL 115          HG11      VAL 115   0.851   9.473   3.365
  849   HG12  VAL 115          HG12      VAL 115   0.105   7.878   3.259
  850   HG13  VAL 115          HG13      VAL 115  -0.753   9.292   2.650
  851   HG21  VAL 115          HG21      VAL 115   0.545   7.384  -0.313
  852   HG22  VAL 115          HG22      VAL 115  -0.936   8.032   0.388
  853   HG23  VAL 115          HG23      VAL 115  -0.083   6.713   1.193
  854    H    LYS 116           HN       LYS 116   3.114  10.596   1.838
  855    HA   LYS 116           HA       LYS 116   1.978  12.474   3.670
  856    HB2  LYS 116           HB2      LYS 116   4.333  13.025   4.227
  857    HB3  LYS 116           HB1      LYS 116   3.977  11.303   4.313
  858    HG2  LYS 116           HG2      LYS 116   5.028  10.913   2.217
  859    HG3  LYS 116           HG1      LYS 116   5.225  12.643   1.938
  860    HD2  LYS 116           HD2      LYS 116   6.726  12.748   3.888
  861    HD3  LYS 116           HD1      LYS 116   6.576  10.992   4.070
  862    HE2  LYS 116           HE2      LYS 116   8.592  11.582   2.817
  863    HE3  LYS 116           HE1      LYS 116   7.447  10.680   1.825
  864    HZ1  LYS 116           HZ1      LYS 116   7.672  13.638   1.792
  865    HZ2  LYS 116           HZ2      LYS 116   6.770  12.670   0.740
  866    HZ3  LYS 116           HZ3      LYS 116   8.463  12.622   0.692
  867    H    LEU 117           HN       LEU 117   3.169  12.633   0.456
  868    HA   LEU 117           HA       LEU 117   3.721  15.427   0.378
  869    HG   LEU 117           HG       LEU 117   3.178  16.076  -2.477
  870    HB2  LEU 117           HB2      LEU 117   4.553  13.678  -1.249
  871    HB3  LEU 117           HB1      LEU 117   2.925  13.650  -1.931
  872   HD11  LEU 117          HD11      LEU 117   5.417  17.053  -2.435
  873   HD12  LEU 117          HD12      LEU 117   6.041  15.604  -1.645
  874   HD13  LEU 117          HD13      LEU 117   4.877  16.633  -0.810
  875   HD21  LEU 117          HD21      LEU 117   4.711  15.713  -4.365
  876   HD22  LEU 117          HD22      LEU 117   3.569  14.383  -4.169
  877   HD23  LEU 117          HD23      LEU 117   5.238  14.198  -3.631
  878    H    GLU 118           HN       GLU 118   0.862  13.481   0.204
  879    HA   GLU 118           HA       GLU 118  -0.897  15.434  -0.855
  880    HB2  GLU 118           HB2      GLU 118  -1.483  13.142   1.049
  881    HB3  GLU 118           HB1      GLU 118  -2.690  14.071   0.162
  882    HG2  GLU 118           HG2      GLU 118  -1.652  13.300  -1.955
  883    HG3  GLU 118           HG1      GLU 118  -0.577  12.276  -1.004
  884    H    GLY 119           HN       GLY 119   0.798  15.272   2.058
  885    HA2  GLY 119           HA2      GLY 119   0.885  17.178   3.488
  886    HA3  GLY 119           HA1      GLY 119  -0.801  17.507   3.102
  887    H    HIS 120           HN       HIS 120  -1.032  14.423   3.397
  888    HA   HIS 120           HA       HIS 120  -1.673  14.566   6.233
  889    HD1  HIS 120           HD1      HIS 120  -2.947  11.281   7.043
  890    HD2  HIS 120           HD2      HIS 120  -2.261  11.029   2.940
  891    HE1  HIS 120           HE1      HIS 120  -2.713   8.827   6.554
  892    HE2  HIS 120           HE2      HIS 120  -2.490   8.687   4.043
  893    HB2  HIS 120           HB2      HIS 120  -3.511  13.442   5.647
  894    HB3  HIS 120           HB1      HIS 120  -2.975  13.469   3.976
  895    H    GLU 121           HN       GLU 121  -0.533  13.574   7.707
  896    HA   GLU 121           HA       GLU 121   1.951  12.368   6.914
  897    HB2  GLU 121           HB2      GLU 121   2.495  12.411   9.320
  898    HB3  GLU 121           HB1      GLU 121   1.995  13.979   8.704
  899    HG2  GLU 121           HG2      GLU 121  -0.295  13.482   9.626
  900    HG3  GLU 121           HG1      GLU 121   0.424  12.083  10.422
  901    H    LEU 122           HN       LEU 122   2.647  10.373   7.190
  902    HA   LEU 122           HA       LEU 122   0.846   8.229   7.352
  903    HG   LEU 122           HG       LEU 122   5.010   7.885   6.640
  904    HB2  LEU 122           HB2      LEU 122   3.198   6.994   7.893
  905    HB3  LEU 122           HB1      LEU 122   2.616   7.376   6.280
  906   HD11  LEU 122          HD11      LEU 122   3.774   9.046   4.917
  907   HD12  LEU 122          HD12      LEU 122   5.005  10.090   5.628
  908   HD13  LEU 122          HD13      LEU 122   3.310  10.295   6.073
  909   HD21  LEU 122          HD21      LEU 122   5.637   9.873   7.952
  910   HD22  LEU 122          HD22      LEU 122   5.022   8.555   8.946
  911   HD23  LEU 122          HD23      LEU 122   3.994   9.944   8.591
  912    HA   PRO 123           HA       PRO 123   0.344   8.130  11.678
  913    HB2  PRO 123           HB2      PRO 123  -1.471   6.234  11.834
  914    HB3  PRO 123           HB1      PRO 123  -1.800   7.643  10.809
  915    HG2  PRO 123           HG2      PRO 123  -0.700   4.952  10.006
  916    HG3  PRO 123           HG1      PRO 123  -2.098   5.797   9.321
  917    HD2  PRO 123           HD2      PRO 123   0.389   5.938   8.226
  918    HD3  PRO 123           HD1      PRO 123  -0.771   7.285   8.133
  919    H    ALA 124           HN       ALA 124   2.237   5.891  10.180
  920    HA   ALA 124           HA       ALA 124   3.448   4.060  10.756
  921    HB1  ALA 124           HB1      ALA 124   3.905   3.603  13.136
  922    HB2  ALA 124           HB2      ALA 124   2.717   4.826  13.585
  923    HB3  ALA 124           HB3      ALA 124   4.178   5.291  12.713
  924    H    ASP 125           HN       ASP 125   0.445   4.170  10.459
  925    HA   ASP 125           HA       ASP 125  -0.218   1.516  11.528
  926    HB2  ASP 125           HB2      ASP 125  -1.869   3.310  12.012
  927    HB3  ASP 125           HB1      ASP 125  -2.030   3.599  10.279
  928    H    LEU 126           HN       LEU 126  -0.744  -0.090  10.149
  929    HA   LEU 126           HA       LEU 126  -0.299   0.420   7.289
  930    HG   LEU 126           HG       LEU 126   2.204  -0.209   6.878
  931    HB2  LEU 126           HB2      LEU 126   1.379  -1.002   8.968
  932    HB3  LEU 126           HB1      LEU 126   0.432  -2.253   8.194
  933   HD11  LEU 126          HD11      LEU 126   3.369  -2.180   6.030
  934   HD12  LEU 126          HD12      LEU 126   2.250  -3.222   6.910
  935   HD13  LEU 126          HD13      LEU 126   3.338  -2.150   7.793
  936   HD21  LEU 126          HD21      LEU 126   0.329  -2.164   5.551
  937   HD22  LEU 126          HD22      LEU 126   1.525  -1.157   4.734
  938   HD23  LEU 126          HD23      LEU 126   0.163  -0.406   5.568
  939    HA   PRO 127           HA       PRO 127  -4.318  -1.637   7.504
  940    HB2  PRO 127           HB2      PRO 127  -5.049  -0.239   5.114
  941    HB3  PRO 127           HB1      PRO 127  -5.558   0.107   6.769
  942    HG2  PRO 127           HG2      PRO 127  -3.974   1.751   5.242
  943    HG3  PRO 127           HG1      PRO 127  -4.015   1.760   7.016
  944    HD2  PRO 127           HD2      PRO 127  -2.059   0.440   5.170
  945    HD3  PRO 127           HD1      PRO 127  -1.752   1.332   6.673
  946    HA   PRO 128           HA       PRO 128  -3.804  -4.913   4.568
  947    HB2  PRO 128           HB2      PRO 128  -6.720  -4.991   4.209
  948    HB3  PRO 128           HB1      PRO 128  -5.635  -6.221   4.874
  949    HG2  PRO 128           HG2      PRO 128  -7.355  -4.802   6.389
  950    HG3  PRO 128           HG1      PRO 128  -5.807  -5.395   7.006
  951    HD2  PRO 128           HD2      PRO 128  -6.609  -2.650   6.181
  952    HD3  PRO 128           HD1      PRO 128  -5.495  -3.163   7.464
  953    H    HIS 129           HN       HIS 129  -5.596  -2.080   3.791
  954    HA   HIS 129           HA       HIS 129  -5.717  -2.751   0.960
  955    HD1  HIS 129           HD1      HIS 129  -8.393  -0.184   3.809
  956    HD2  HIS 129           HD2      HIS 129  -5.086   1.411   1.858
  957    HE1  HIS 129           HE1      HIS 129  -7.878   1.975   4.994
  958    HE2  HIS 129           HE2      HIS 129  -6.041   3.038   3.629
  959    HB2  HIS 129           HB2      HIS 129  -6.945  -0.671   0.642
  960    HB3  HIS 129           HB1      HIS 129  -7.674  -1.606   1.935
  961    H    LEU 130           HN       LEU 130  -3.315  -2.104   2.755
  962    HA   LEU 130           HA       LEU 130  -1.866  -0.734   0.621
  963    HG   LEU 130           HG       LEU 130  -0.861   1.262   0.707
  964    HB2  LEU 130           HB2      LEU 130  -2.608   0.565   2.966
  965    HB3  LEU 130           HB1      LEU 130  -0.908   0.214   3.177
  966   HD11  LEU 130          HD11      LEU 130  -2.323   3.190   0.577
  967   HD12  LEU 130          HD12      LEU 130  -3.095   2.730   2.094
  968   HD13  LEU 130          HD13      LEU 130  -3.268   1.704   0.669
  969   HD21  LEU 130          HD21      LEU 130  -0.070   3.299   1.706
  970   HD22  LEU 130          HD22      LEU 130   0.488   1.915   2.644
  971   HD23  LEU 130          HD23      LEU 130  -0.858   2.891   3.232
  972    H    VAL 131           HN       VAL 131  -2.171  -3.418   2.041
  973    HA   VAL 131           HA       VAL 131   0.530  -3.688   3.106
  974    HB   VAL 131           HB       VAL 131  -1.415  -4.495   4.466
  975   HG11  VAL 131          HG11      VAL 131  -2.394  -6.673   3.942
  976   HG12  VAL 131          HG12      VAL 131  -1.566  -6.661   2.381
  977   HG13  VAL 131          HG13      VAL 131  -2.804  -5.449   2.738
  978   HG21  VAL 131          HG21      VAL 131   0.687  -6.498   3.709
  979   HG22  VAL 131          HG22      VAL 131  -0.313  -6.563   5.163
  980   HG23  VAL 131          HG23      VAL 131   0.817  -5.229   4.925
  981    HA   PRO 132           HA       PRO 132   1.669  -5.242  -0.890
  982    HB2  PRO 132           HB2      PRO 132   4.121  -6.183   0.419
  983    HB3  PRO 132           HB1      PRO 132   3.919  -4.989  -0.859
  984    HG2  PRO 132           HG2      PRO 132   4.601  -4.375   1.708
  985    HG3  PRO 132           HG1      PRO 132   3.786  -3.261   0.597
  986    HD2  PRO 132           HD2      PRO 132   2.707  -4.765   2.905
  987    HD3  PRO 132           HD1      PRO 132   2.172  -3.225   2.194
  988    HA   PRO 133           HA       PRO 133   0.252  -9.375   0.177
  989    HB2  PRO 133           HB2      PRO 133  -0.359 -10.206  -2.325
  990    HB3  PRO 133           HB1      PRO 133  -1.359  -9.061  -1.417
  991    HG2  PRO 133           HG2      PRO 133   0.680  -8.519  -3.552
  992    HG3  PRO 133           HG1      PRO 133  -0.938  -7.815  -3.337
  993    HD2  PRO 133           HD2      PRO 133   1.328  -6.535  -2.572
  994    HD3  PRO 133           HD1      PRO 133  -0.227  -6.335  -1.725
  995    H    SER 134           HN       SER 134   3.022  -8.753  -1.865
  996    HA   SER 134           HA       SER 134   3.579 -11.539  -2.360
  997    HG   SER 134           HG       SER 134   3.820  -8.881  -4.177
  998    HB2  SER 134           HB2      SER 134   5.341  -9.098  -2.662
  999    HB3  SER 134           HB1      SER 134   5.736 -10.715  -3.247
 1000    H    LYS 135           HN       LYS 135   3.885  -9.571   0.318
 1001    HA   LYS 135           HA       LYS 135   5.913 -11.358   1.507
 1002    HB2  LYS 135           HB2      LYS 135   5.702  -9.332   3.339
 1003    HB3  LYS 135           HB1      LYS 135   6.899  -9.400   2.053
 1004    HG2  LYS 135           HG2      LYS 135   4.240  -8.009   1.809
 1005    HG3  LYS 135           HG1      LYS 135   5.746  -7.222   2.301
 1006    HD2  LYS 135           HD2      LYS 135   5.992  -8.767  -0.162
 1007    HD3  LYS 135           HD1      LYS 135   4.814  -7.459  -0.263
 1008    HE2  LYS 135           HE2      LYS 135   7.014  -6.784  -0.969
 1009    HE3  LYS 135           HE1      LYS 135   6.479  -5.864   0.428
 1010    HZ1  LYS 135           HZ1      LYS 135   8.028  -8.207   1.084
 1011    HZ2  LYS 135           HZ2      LYS 135   8.184  -6.623   1.650
 1012    HZ3  LYS 135           HZ3      LYS 135   8.882  -7.071   0.169
 1013    H    ARG 136           HN       ARG 136   2.725 -10.620   1.288
 1014    HA   ARG 136           HA       ARG 136   2.067 -11.771   3.916
 1015    HE   ARG 136           HE       ARG 136   0.180  -9.548   5.670
 1016    HB2  ARG 136           HB2      ARG 136   0.083 -10.888   1.818
 1017    HB3  ARG 136           HB1      ARG 136  -0.205 -11.165   3.530
 1018    HG2  ARG 136           HG2      ARG 136   1.181  -8.869   2.208
 1019    HG3  ARG 136           HG1      ARG 136  -0.202  -8.850   3.295
 1020    HD2  ARG 136           HD2      ARG 136   2.622  -9.568   4.049
 1021    HD3  ARG 136           HD1      ARG 136   1.839  -8.023   4.361
 1022   HH11  ARG 136          HH11      ARG 136   3.648  -9.965   5.429
 1023   HH12  ARG 136          HH12      ARG 136   3.820 -10.622   7.026
 1024   HH21  ARG 136          HH21      ARG 136   0.404 -10.357   7.810
 1025   HH22  ARG 136          HH22      ARG 136   1.983 -10.829   8.388
 1026    H    ARG 137           HN       ARG 137   2.164 -13.881   4.022
 1027    HA   ARG 137           HA       ARG 137   0.496 -15.424   2.233
 1028    HE   ARG 137           HE       ARG 137   5.817 -15.769   0.391
 1029    HB2  ARG 137           HB2      ARG 137   2.328 -17.202   2.026
 1030    HB3  ARG 137           HB1      ARG 137   2.465 -15.784   0.998
 1031    HG2  ARG 137           HG2      ARG 137   3.848 -15.628   3.591
 1032    HG3  ARG 137           HG1      ARG 137   4.488 -16.799   2.437
 1033    HD2  ARG 137           HD2      ARG 137   3.910 -13.939   1.700
 1034    HD3  ARG 137           HD1      ARG 137   5.465 -14.456   2.348
 1035   HH11  ARG 137          HH11      ARG 137   2.905 -13.804   0.222
 1036   HH12  ARG 137          HH12      ARG 137   2.889 -13.757  -1.508
 1037   HH21  ARG 137          HH21      ARG 137   5.821 -15.680  -1.884
 1038   HH22  ARG 137          HH22      ARG 137   4.547 -14.846  -2.715
 1039    H    HIS 138           HN       HIS 138  -0.261 -17.290   3.135
 1040    HA   HIS 138           HA       HIS 138  -0.064 -17.336   6.039
 1041    HD1  HIS 138           HD1      HIS 138  -1.814 -20.807   6.210
 1042    HD2  HIS 138           HD2      HIS 138  -3.259 -17.085   7.375
 1043    HE1  HIS 138           HE1      HIS 138  -2.944 -21.184   8.417
 1044    HE2  HIS 138           HE2      HIS 138  -4.016 -18.969   8.980
 1045    HB2  HIS 138           HB2      HIS 138  -2.282 -17.312   4.822
 1046    HB3  HIS 138           HB1      HIS 138  -1.922 -18.951   4.289
 1047    H    GLU 139           HN       GLU 139   1.179 -18.744   7.064
 1048    HA   GLU 139           HA       GLU 139   2.135 -21.111   5.676
 1049    HB2  GLU 139           HB2      GLU 139   3.481 -21.453   7.779
 1050    HB3  GLU 139           HB1      GLU 139   3.828 -19.963   6.921
 1051    HG2  GLU 139           HG2      GLU 139   2.331 -18.775   8.513
 1052    HG3  GLU 139           HG1      GLU 139   2.182 -20.280   9.413
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  21.414  15.980 -32.040
    2    H2   GLY   1           HT2      GLY   1  21.858  16.666 -33.526
    3    H3   GLY   1           HT3      GLY   1  20.281  16.093 -33.294
    4    HA2  GLY   1           HA1      GLY   1  21.456  18.315 -31.731
    5    HA3  GLY   1           HA2      GLY   1  20.496  18.551 -33.186
    6    HA   PRO   2           HA       PRO   2  17.515  18.296 -29.629
    7    HB2  PRO   2           HB2      PRO   2  16.711  20.998 -30.298
    8    HB3  PRO   2           HB1      PRO   2  17.353  20.384 -28.772
    9    HG2  PRO   2           HG2      PRO   2  18.723  22.099 -30.385
   10    HG3  PRO   2           HG1      PRO   2  19.517  20.923 -29.323
   11    HD2  PRO   2           HD2      PRO   2  18.978  20.750 -32.268
   12    HD3  PRO   2           HD1      PRO   2  20.441  20.299 -31.361
   13    H    LEU   3           HN       LEU   3  17.140  20.092 -32.670
   14    HA   LEU   3           HA       LEU   3  14.438  19.013 -32.974
   15    HG   LEU   3           HG       LEU   3  13.549  21.340 -32.587
   16    HB2  LEU   3           HB2      LEU   3  15.897  21.194 -34.470
   17    HB3  LEU   3           HB1      LEU   3  14.303  20.622 -34.903
   18   HD11  LEU   3          HD11      LEU   3  16.196  22.774 -32.636
   19   HD12  LEU   3          HD12      LEU   3  15.729  21.483 -31.530
   20   HD13  LEU   3          HD13      LEU   3  14.899  23.037 -31.470
   21   HD21  LEU   3          HD21      LEU   3  12.974  22.607 -34.560
   22   HD22  LEU   3          HD22      LEU   3  14.538  23.420 -34.531
   23   HD23  LEU   3          HD23      LEU   3  13.370  23.709 -33.242
   24    H    GLY   4           HN       GLY   4  13.900  17.626 -34.613
   25    HA2  GLY   4           HA2      GLY   4  14.137  16.544 -36.676
   26    HA3  GLY   4           HA1      GLY   4  15.760  17.200 -36.809
   27    H    SER   5           HN       SER   5  16.423  16.243 -34.072
   28    HA   SER   5           HA       SER   5  17.120  13.526 -34.836
   29    HG   SER   5           HG       SER   5  18.863  15.053 -35.029
   30    HB2  SER   5           HB2      SER   5  17.963  15.124 -32.401
   31    HB3  SER   5           HB1      SER   5  18.668  13.604 -32.954
   32    H    GLU   6           HN       GLU   6  15.869  11.912 -34.280
   33    HA   GLU   6           HA       GLU   6  13.743  12.142 -32.405
   34    HB2  GLU   6           HB2      GLU   6  14.946   9.764 -33.829
   35    HB3  GLU   6           HB1      GLU   6  13.523   9.666 -32.806
   36    HG2  GLU   6           HG2      GLU   6  13.715  11.418 -35.241
   37    HG3  GLU   6           HG1      GLU   6  13.051   9.784 -35.242
   38    H    SER   7           HN       SER   7  13.741  11.748 -30.278
   39    HA   SER   7           HA       SER   7  16.128  10.982 -28.917
   40    HG   SER   7           HG       SER   7  13.984  13.430 -27.915
   41    HB2  SER   7           HB2      SER   7  13.619  10.815 -27.402
   42    HB3  SER   7           HB1      SER   7  15.048  11.807 -27.104
   43    H    LEU   8           HN       LEU   8  16.773   8.927 -29.340
   44    HA   LEU   8           HA       LEU   8  14.836   6.799 -29.590
   45    HG   LEU   8           HG       LEU   8  16.831   4.472 -29.178
   46    HB2  LEU   8           HB2      LEU   8  16.825   6.862 -31.033
   47    HB3  LEU   8           HB1      LEU   8  17.853   6.702 -29.619
   48   HD11  LEU   8          HD11      LEU   8  14.699   4.822 -30.289
   49   HD12  LEU   8          HD12      LEU   8  15.522   3.407 -30.948
   50   HD13  LEU   8          HD13      LEU   8  15.514   4.922 -31.849
   51   HD21  LEU   8          HD21      LEU   8  18.068   4.788 -31.910
   52   HD22  LEU   8          HD22      LEU   8  17.982   3.293 -30.978
   53   HD23  LEU   8          HD23      LEU   8  18.947   4.646 -30.386
   54    H    MET   9           HN       MET   9  14.123   5.606 -27.980
   55    HA   MET   9           HA       MET   9  15.591   5.496 -25.463
   56    HB2  MET   9           HB2      MET   9  13.561   4.310 -24.618
   57    HB3  MET   9           HB1      MET   9  13.238   5.927 -25.222
   58    HG2  MET   9           HG2      MET   9  12.449   4.918 -27.347
   59    HG3  MET   9           HG1      MET   9  12.661   3.329 -26.619
   60    HE1  MET   9           HE1      MET   9   8.753   3.785 -26.721
   61    HE2  MET   9           HE2      MET   9  10.116   2.792 -27.238
   62    HE3  MET   9           HE3      MET   9   9.902   4.413 -27.899
   63    HA   PRO  10           HA       PRO  10  17.675   1.808 -26.632
   64    HB2  PRO  10           HB2      PRO  10  17.553   1.188 -23.727
   65    HB3  PRO  10           HB1      PRO  10  18.950   1.271 -24.806
   66    HG2  PRO  10           HG2      PRO  10  18.473   3.214 -23.048
   67    HG3  PRO  10           HG1      PRO  10  19.084   3.581 -24.675
   68    HD2  PRO  10           HD2      PRO  10  16.319   3.871 -23.576
   69    HD3  PRO  10           HD1      PRO  10  17.200   4.920 -24.704
   70    H    SER  11           HN       SER  11  15.053   1.541 -24.253
   71    HA   SER  11           HA       SER  11  14.533  -1.198 -25.031
   72    HG   SER  11           HG       SER  11  14.265   1.142 -22.259
   73    HB2  SER  11           HB2      SER  11  12.567  -0.794 -23.345
   74    HB3  SER  11           HB1      SER  11  14.217  -0.945 -22.740
   75    H    GLN  12           HN       GLN  12  13.862  -1.072 -27.148
   76    HA   GLN  12           HA       GLN  12  11.211   0.131 -27.550
   77    HB2  GLN  12           HB2      GLN  12  12.887   1.614 -28.593
   78    HB3  GLN  12           HB1      GLN  12  13.492   0.258 -29.536
   79    HG2  GLN  12           HG2      GLN  12  11.227   0.054 -30.559
   80    HG3  GLN  12           HG1      GLN  12  10.775   1.537 -29.724
   81   HE21  GLN  12          HE21      GLN  12  10.385   2.597 -31.661
   82   HE22  GLN  12          HE22      GLN  12  11.659   3.120 -32.702
   83    H    VAL  13           HN       VAL  13  10.060  -1.704 -27.573
   84    HA   VAL  13           HA       VAL  13  10.587  -3.526 -29.807
   85    HB   VAL  13           HB       VAL  13   9.597  -5.393 -28.381
   86   HG11  VAL  13          HG11      VAL  13  12.259  -4.267 -27.519
   87   HG12  VAL  13          HG12      VAL  13  11.977  -5.256 -28.950
   88   HG13  VAL  13          HG13      VAL  13  11.729  -5.940 -27.342
   89   HG21  VAL  13          HG21      VAL  13  10.258  -3.464 -26.156
   90   HG22  VAL  13          HG22      VAL  13   9.843  -5.163 -25.941
   91   HG23  VAL  13          HG23      VAL  13   8.651  -4.042 -26.596
   92    H    VAL  14           HN       VAL  14   8.937  -3.573 -31.168
   93    HA   VAL  14           HA       VAL  14   6.504  -2.198 -30.439
   94    HB   VAL  14           HB       VAL  14   7.199  -3.524 -33.061
   95   HG11  VAL  14          HG11      VAL  14   5.097  -1.467 -32.377
   96   HG12  VAL  14          HG12      VAL  14   4.803  -3.157 -32.785
   97   HG13  VAL  14          HG13      VAL  14   5.466  -2.059 -33.996
   98   HG21  VAL  14          HG21      VAL  14   7.533  -0.656 -32.188
   99   HG22  VAL  14          HG22      VAL  14   7.777  -1.263 -33.825
  100   HG23  VAL  14          HG23      VAL  14   8.829  -1.809 -32.519
  101    H    LYS  15           HN       LYS  15   5.384  -3.446 -29.030
  102    HA   LYS  15           HA       LYS  15   4.551  -6.106 -29.917
  103    HB2  LYS  15           HB2      LYS  15   3.531  -6.257 -27.609
  104    HB3  LYS  15           HB1      LYS  15   5.281  -6.118 -27.645
  105    HG2  LYS  15           HG2      LYS  15   5.070  -3.708 -27.144
  106    HG3  LYS  15           HG1      LYS  15   3.323  -3.915 -27.021
  107    HD2  LYS  15           HD2      LYS  15   3.653  -5.524 -25.196
  108    HD3  LYS  15           HD1      LYS  15   5.396  -5.291 -25.313
  109    HE2  LYS  15           HE2      LYS  15   5.056  -2.886 -24.813
  110    HE3  LYS  15           HE1      LYS  15   3.339  -3.215 -24.580
  111    HZ1  LYS  15           HZ1      LYS  15   4.460  -3.197 -22.470
  112    HZ2  LYS  15           HZ2      LYS  15   5.577  -4.359 -23.003
  113    HZ3  LYS  15           HZ3      LYS  15   3.947  -4.778 -22.812
  114    H    GLY  16           HN       GLY  16   3.258  -5.285 -31.636
  115    HA2  GLY  16           HA2      GLY  16   0.853  -3.808 -30.796
  116    HA3  GLY  16           HA1      GLY  16   1.495  -3.849 -32.431
  117    H    GLY  17           HN       GLY  17  -0.736  -5.163 -30.278
  118    HA2  GLY  17           HA2      GLY  17  -2.436  -6.673 -30.623
  119    HA3  GLY  17           HA1      GLY  17  -1.975  -6.706 -32.316
  120    H    ALA  18           HN       ALA  18   0.371  -7.533 -29.889
  121    HA   ALA  18           HA       ALA  18   0.099 -10.367 -30.654
  122    HB1  ALA  18           HB1      ALA  18   2.648  -8.851 -30.114
  123    HB2  ALA  18           HB2      ALA  18   2.055  -9.344 -31.700
  124    HB3  ALA  18           HB3      ALA  18   2.522 -10.564 -30.516
  125    H    PHE  19           HN       PHE  19  -0.830 -11.278 -28.934
  126    HA   PHE  19           HA       PHE  19   0.324 -10.724 -26.288
  127    HD1  PHE  19           HD1      PHE  19  -1.329  -9.393 -24.528
  128    HD2  PHE  19           HD2      PHE  19  -3.446 -10.194 -28.133
  129    HE1  PHE  19           HE1      PHE  19  -2.306  -7.132 -24.456
  130    HE2  PHE  19           HE2      PHE  19  -4.425  -7.940 -28.071
  131    HZ   PHE  19           HZ       PHE  19  -3.824  -6.391 -26.251
  132    HB2  PHE  19           HB2      PHE  19  -2.355 -11.936 -27.002
  133    HB3  PHE  19           HB1      PHE  19  -1.753 -11.723 -25.365
  134    H    ASP  20           HN       ASP  20   2.095 -12.073 -26.483
  135    HA   ASP  20           HA       ASP  20   1.476 -14.940 -26.713
  136    HB2  ASP  20           HB2      ASP  20   3.889 -13.389 -27.637
  137    HB3  ASP  20           HB1      ASP  20   3.942 -15.133 -27.398
  138    H    GLY  21           HN       GLY  21   1.516 -15.837 -24.774
  139    HA2  GLY  21           HA2      GLY  21   3.656 -15.033 -22.907
  140    HA3  GLY  21           HA1      GLY  21   2.124 -15.753 -22.418
  141    H    THR  22           HN       THR  22   4.907 -16.457 -24.510
  142    HA   THR  22           HA       THR  22   4.745 -19.242 -23.591
  143    HB   THR  22           HB       THR  22   4.097 -19.187 -25.918
  144    HG1  THR  22           HG1      THR  22   5.713 -20.582 -26.739
  145   HG21  THR  22          HG21      THR  22   6.709 -17.760 -26.427
  146   HG22  THR  22          HG22      THR  22   5.092 -17.074 -26.593
  147   HG23  THR  22          HG23      THR  22   5.622 -18.365 -27.674
  148    H    MET  23           HN       MET  23   6.511 -20.050 -22.676
  149    HA   MET  23           HA       MET  23   8.974 -18.458 -22.787
  150    HB2  MET  23           HB2      MET  23   7.989 -20.414 -20.713
  151    HB3  MET  23           HB1      MET  23   9.599 -19.707 -20.708
  152    HG2  MET  23           HG2      MET  23   8.655 -17.496 -20.450
  153    HG3  MET  23           HG1      MET  23   7.026 -18.161 -20.545
  154    HE1  MET  23           HE1      MET  23   8.254 -16.267 -18.177
  155    HE2  MET  23           HE2      MET  23   7.494 -17.016 -16.775
  156    HE3  MET  23           HE3      MET  23   6.564 -16.764 -18.254
  157    H    ASN  24           HN       ASN  24   9.941 -19.261 -24.572
  158    HA   ASN  24           HA       ASN  24  10.582 -22.132 -24.536
  159    HB2  ASN  24           HB2      ASN  24   9.285 -21.561 -26.517
  160    HB3  ASN  24           HB1      ASN  24  10.397 -20.254 -26.902
  161   HD21  ASN  24          HD21      ASN  24  10.055 -23.735 -26.657
  162   HD22  ASN  24          HD22      ASN  24  11.353 -24.124 -27.741
  163    H    GLY  25           HN       GLY  25  12.694 -22.745 -24.746
  164    HA2  GLY  25           HA2      GLY  25  14.999 -22.097 -25.359
  165    HA3  GLY  25           HA1      GLY  25  14.676 -20.568 -24.563
  166    HA   PRO  26           HA       PRO  26  15.613 -22.850 -20.640
  167    HB2  PRO  26           HB2      PRO  26  12.859 -23.379 -19.737
  168    HB3  PRO  26           HB1      PRO  26  14.142 -22.460 -18.941
  169    HG2  PRO  26           HG2      PRO  26  12.001 -21.240 -20.008
  170    HG3  PRO  26           HG1      PRO  26  13.612 -20.503 -20.059
  171    HD2  PRO  26           HD2      PRO  26  12.140 -21.975 -22.213
  172    HD3  PRO  26           HD1      PRO  26  13.087 -20.474 -22.320
  173    H    PHE  27           HN       PHE  27  16.399 -24.690 -21.627
  174    HA   PHE  27           HA       PHE  27  14.617 -26.671 -22.706
  175    HD1  PHE  27           HD2      PHE  27  14.960 -26.730 -25.043
  176    HD2  PHE  27           HD1      PHE  27  18.632 -25.057 -23.698
  177    HE1  PHE  27           HE2      PHE  27  15.054 -25.319 -27.059
  178    HE2  PHE  27           HE1      PHE  27  18.736 -23.647 -25.712
  179    HZ   PHE  27           HZ       PHE  27  16.943 -23.777 -27.397
  180    HB2  PHE  27           HB2      PHE  27  17.629 -26.663 -22.431
  181    HB3  PHE  27           HB1      PHE  27  16.701 -27.876 -23.308
  182    H    GLY  28           HN       GLY  28  13.631 -28.099 -21.497
  183    HA2  GLY  28           HA2      GLY  28  14.938 -30.056 -20.018
  184    HA3  GLY  28           HA1      GLY  28  14.408 -28.827 -18.874
  185    H    HIS  29           HN       HIS  29  13.575 -31.720 -19.890
  186    HA   HIS  29           HA       HIS  29  10.798 -31.314 -20.483
  187    HD1  HIS  29           HD1      HIS  29  14.150 -34.431 -20.533
  188    HD2  HIS  29           HD2      HIS  29  11.030 -34.828 -17.807
  189    HE1  HIS  29           HE1      HIS  29  14.975 -36.032 -18.779
  190    HE2  HIS  29           HE2      HIS  29  13.002 -36.408 -17.258
  191    HB2  HIS  29           HB2      HIS  29  10.562 -33.716 -20.441
  192    HB3  HIS  29           HB1      HIS  29  12.031 -33.310 -21.310
  193    H    GLY  30           HN       GLY  30   9.035 -31.512 -19.134
  194    HA2  GLY  30           HA2      GLY  30   8.816 -32.522 -16.628
  195    HA3  GLY  30           HA1      GLY  30   9.601 -30.971 -16.361
  196    H    TYR  31           HN       TYR  31   7.370 -31.122 -15.118
  197    HA   TYR  31           HA       TYR  31   5.538 -29.467 -16.677
  198    HD1  TYR  31           HD2      TYR  31   4.122 -31.592 -13.215
  199    HD2  TYR  31           HD1      TYR  31   5.567 -33.560 -16.706
  200    HE1  TYR  31           HE2      TYR  31   4.578 -33.611 -11.886
  201    HE2  TYR  31           HE1      TYR  31   6.019 -35.581 -15.381
  202    HH   TYR  31           HH       TYR  31   4.778 -36.071 -12.296
  203    HB2  TYR  31           HB2      TYR  31   3.613 -30.736 -15.498
  204    HB3  TYR  31           HB1      TYR  31   4.374 -31.475 -16.901
  205    H    GLY  32           HN       GLY  32   4.453 -27.907 -15.481
  206    HA2  GLY  32           HA2      GLY  32   5.093 -27.841 -12.600
  207    HA3  GLY  32           HA1      GLY  32   5.208 -26.403 -13.605
  208    H    GLU  33           HN       GLU  33   3.084 -28.634 -12.006
  209    HA   GLU  33           HA       GLU  33   0.667 -27.406 -12.925
  210    HB2  GLU  33           HB2      GLU  33   0.869 -28.986 -10.375
  211    HB3  GLU  33           HB1      GLU  33  -0.483 -28.864 -11.488
  212    HG2  GLU  33           HG2      GLU  33   0.233 -30.938 -12.030
  213    HG3  GLU  33           HG1      GLU  33   1.250 -30.010 -13.133
  214    H    GLY  34           HN       GLY  34  -0.169 -25.545 -12.263
  215    HA2  GLY  34           HA2      GLY  34   0.961 -24.212  -9.937
  216    HA3  GLY  34           HA1      GLY  34  -0.149 -23.508 -11.105
  217    H    ALA  35           HN       ALA  35   0.167 -24.639  -8.003
  218    HA   ALA  35           HA       ALA  35  -2.537 -25.555  -7.641
  219    HB1  ALA  35           HB1      ALA  35  -2.007 -25.521  -5.246
  220    HB2  ALA  35           HB2      ALA  35  -0.473 -24.725  -5.601
  221    HB3  ALA  35           HB3      ALA  35  -0.771 -26.365  -6.177
  222    H    GLY  36           HN       GLY  36  -4.247 -24.274  -7.639
  223    HA2  GLY  36           HA2      GLY  36  -3.852 -21.454  -6.871
  224    HA3  GLY  36           HA1      GLY  36  -4.977 -21.968  -8.116
  225    H    GLU  37           HN       GLU  37  -4.500 -21.410  -4.781
  226    HA   GLU  37           HA       GLU  37  -7.175 -22.386  -4.165
  227    HB2  GLU  37           HB2      GLU  37  -6.564 -21.853  -1.822
  228    HB3  GLU  37           HB1      GLU  37  -5.483 -23.023  -2.556
  229    HG2  GLU  37           HG2      GLU  37  -3.790 -21.359  -2.850
  230    HG3  GLU  37           HG1      GLU  37  -4.889 -20.085  -2.326
  231    H    GLY  38           HN       GLY  38  -8.147 -20.695  -2.350
  232    HA2  GLY  38           HA2      GLY  38  -8.614 -18.276  -3.858
  233    HA3  GLY  38           HA1      GLY  38  -9.318 -18.666  -2.301
  234    H    ILE  39           HN       ILE  39  -6.237 -17.846  -3.783
  235    HA   ILE  39           HA       ILE  39  -5.020 -16.735  -1.523
  236    HB   ILE  39           HB       ILE  39  -3.701 -15.382  -3.203
  237   HG12  ILE  39          HG12      ILE  39  -5.593 -16.796  -5.088
  238   HG13  ILE  39          HG11      ILE  39  -5.243 -15.074  -4.987
  239   HG21  ILE  39          HG21      ILE  39  -2.884 -17.508  -2.429
  240   HG22  ILE  39          HG22      ILE  39  -2.571 -17.372  -4.159
  241   HG23  ILE  39          HG23      ILE  39  -3.907 -18.367  -3.581
  242   HD11  ILE  39          HD11      ILE  39  -4.229 -16.007  -6.953
  243   HD12  ILE  39          HD12      ILE  39  -3.405 -17.233  -5.991
  244   HD13  ILE  39          HD13      ILE  39  -2.967 -15.532  -5.814
  245    H    ASP  40           HN       ASP  40  -4.839 -14.518  -0.884
  246    HA   ASP  40           HA       ASP  40  -7.396 -13.237  -0.982
  247    HB2  ASP  40           HB2      ASP  40  -5.789 -13.265   1.016
  248    HB3  ASP  40           HB1      ASP  40  -4.884 -12.017   0.165
  249    H    ASP  41           HN       ASP  41  -7.507 -12.942  -3.266
  250    HA   ASP  41           HA       ASP  41  -5.735 -11.061  -4.530
  251    HB2  ASP  41           HB2      ASP  41  -7.269 -11.154  -6.446
  252    HB3  ASP  41           HB1      ASP  41  -6.861 -12.766  -5.877
  253    H    VAL  42           HN       VAL  42  -5.676  -9.147  -3.554
  254    HA   VAL  42           HA       VAL  42  -8.177  -7.592  -3.566
  255    HB   VAL  42           HB       VAL  42  -7.463  -8.013  -1.266
  256   HG11  VAL  42          HG11      VAL  42  -4.883  -6.640  -2.010
  257   HG12  VAL  42          HG12      VAL  42  -5.073  -8.361  -1.668
  258   HG13  VAL  42          HG13      VAL  42  -5.350  -7.173  -0.394
  259   HG21  VAL  42          HG21      VAL  42  -7.317  -5.696  -0.470
  260   HG22  VAL  42          HG22      VAL  42  -8.545  -5.893  -1.720
  261   HG23  VAL  42          HG23      VAL  42  -6.990  -5.161  -2.118
  262    H    GLU  43           HN       GLU  43  -8.081  -5.535  -4.469
  263    HA   GLU  43           HA       GLU  43  -5.562  -4.891  -5.805
  264    HB2  GLU  43           HB2      GLU  43  -7.616  -4.922  -7.206
  265    HB3  GLU  43           HB1      GLU  43  -8.271  -3.611  -6.230
  266    HG2  GLU  43           HG2      GLU  43  -6.276  -2.248  -6.865
  267    HG3  GLU  43           HG1      GLU  43  -5.828  -3.531  -7.983
  268    H    TRP  44           HN       TRP  44  -4.394  -4.048  -4.154
  269    HA   TRP  44           HA       TRP  44  -5.321  -1.836  -2.594
  270    HD1  TRP  44           HD1      TRP  44  -3.651   0.281  -1.807
  271    HE1  TRP  44           HE1      TRP  44  -1.502   1.439  -0.987
  272    HE3  TRP  44           HE3      TRP  44  -0.585  -3.709  -1.728
  273    HZ2  TRP  44           HZ2      TRP  44   1.186   0.689  -0.390
  274    HZ3  TRP  44           HZ3      TRP  44   1.751  -3.450  -1.078
  275    HH2  TRP  44           HH2      TRP  44   2.621  -1.288  -0.392
  276    HB2  TRP  44           HB2      TRP  44  -3.698  -3.116  -1.508
  277    HB3  TRP  44           HB1      TRP  44  -2.710  -3.272  -2.960
  278    H    VAL  45           HN       VAL  45  -4.919   0.253  -2.856
  279    HA   VAL  45           HA       VAL  45  -4.956   1.557  -5.233
  280    HB   VAL  45           HB       VAL  45  -3.589   2.672  -2.789
  281   HG11  VAL  45          HG11      VAL  45  -3.520   4.131  -4.728
  282   HG12  VAL  45          HG12      VAL  45  -4.601   4.790  -3.500
  283   HG13  VAL  45          HG13      VAL  45  -5.269   3.989  -4.920
  284   HG21  VAL  45          HG21      VAL  45  -6.521   2.226  -3.288
  285   HG22  VAL  45          HG22      VAL  45  -5.917   3.406  -2.126
  286   HG23  VAL  45          HG23      VAL  45  -5.550   1.696  -1.911
  287    H    VAL  46           HN       VAL  46  -2.142   0.008  -3.974
  288    HA   VAL  46           HA       VAL  46  -0.358   1.723  -5.489
  289    HB   VAL  46           HB       VAL  46   0.047  -0.453  -3.472
  290   HG11  VAL  46          HG11      VAL  46   2.148   0.196  -5.543
  291   HG12  VAL  46          HG12      VAL  46   1.301  -1.342  -5.378
  292   HG13  VAL  46          HG13      VAL  46   2.371  -0.783  -4.092
  293   HG21  VAL  46          HG21      VAL  46   1.732   1.123  -2.684
  294   HG22  VAL  46          HG22      VAL  46   0.188   1.940  -2.933
  295   HG23  VAL  46          HG23      VAL  46   1.485   2.128  -4.113
  296    H    GLY  47           HN       GLY  47  -2.006  -1.294  -5.933
  297    HA2  GLY  47           HA2      GLY  47  -0.330  -2.415  -7.909
  298    HA3  GLY  47           HA1      GLY  47  -2.049  -2.738  -7.725
  299    H    LYS  48           HN       LYS  48  -2.155   0.417  -8.024
  300    HA   LYS  48           HA       LYS  48  -2.459   0.288 -10.924
  301    HB2  LYS  48           HB2      LYS  48  -3.791   2.416 -10.525
  302    HB3  LYS  48           HB1      LYS  48  -4.493   0.914  -9.951
  303    HG2  LYS  48           HG2      LYS  48  -3.598   1.492  -7.687
  304    HG3  LYS  48           HG1      LYS  48  -3.146   3.063  -8.346
  305    HD2  LYS  48           HD2      LYS  48  -5.226   3.393  -7.294
  306    HD3  LYS  48           HD1      LYS  48  -5.581   3.320  -9.020
  307    HE2  LYS  48           HE2      LYS  48  -5.784   0.909  -7.238
  308    HE3  LYS  48           HE1      LYS  48  -7.121   2.037  -7.436
  309    HZ1  LYS  48           HZ1      LYS  48  -5.823   0.516  -9.627
  310    HZ2  LYS  48           HZ2      LYS  48  -7.136   1.572  -9.800
  311    HZ3  LYS  48           HZ3      LYS  48  -7.312   0.130  -8.915
  312    H    ASP  49           HN       ASP  49  -0.637   1.908  -8.430
  313    HA   ASP  49           HA       ASP  49   0.435   3.752 -10.469
  314    HB2  ASP  49           HB2      ASP  49  -0.807   4.836  -8.567
  315    HB3  ASP  49           HB1      ASP  49   0.421   4.207  -7.473
  316    H    LYS  50           HN       LYS  50   1.159   0.962  -9.089
  317    HA   LYS  50           HA       LYS  50   3.698   1.156  -8.024
  318    HB2  LYS  50           HB2      LYS  50   2.440  -0.960  -7.995
  319    HB3  LYS  50           HB1      LYS  50   2.643  -1.106  -9.741
  320    HG2  LYS  50           HG2      LYS  50   5.155  -0.976  -9.279
  321    HG3  LYS  50           HG1      LYS  50   4.732  -1.270  -7.594
  322    HD2  LYS  50           HD2      LYS  50   3.812  -3.393  -8.115
  323    HD3  LYS  50           HD1      LYS  50   3.888  -3.071  -9.852
  324    HE2  LYS  50           HE2      LYS  50   6.341  -2.966  -9.707
  325    HE3  LYS  50           HE1      LYS  50   6.248  -3.326  -7.986
  326    HZ1  LYS  50           HZ1      LYS  50   6.759  -5.252  -9.447
  327    HZ2  LYS  50           HZ2      LYS  50   5.193  -5.133 -10.078
  328    HZ3  LYS  50           HZ3      LYS  50   5.421  -5.471  -8.429
  329    HA   PRO  51           HA       PRO  51   5.208   0.576 -12.779
  330    HB2  PRO  51           HB2      PRO  51   3.778   2.671 -14.074
  331    HB3  PRO  51           HB1      PRO  51   3.741   0.940 -14.432
  332    HG2  PRO  51           HG2      PRO  51   1.860   2.574 -12.828
  333    HG3  PRO  51           HG1      PRO  51   1.562   1.093 -13.753
  334    HD2  PRO  51           HD2      PRO  51   1.641   1.083 -11.079
  335    HD3  PRO  51           HD1      PRO  51   2.283  -0.277 -12.030
  336    H    THR  52           HN       THR  52   4.146   3.441 -11.051
  337    HA   THR  52           HA       THR  52   6.134   5.188 -12.129
  338    HB   THR  52           HB       THR  52   4.537   5.466  -9.570
  339    HG1  THR  52           HG1      THR  52   2.863   6.016 -10.775
  340   HG21  THR  52          HG21      THR  52   4.872   7.865  -9.891
  341   HG22  THR  52          HG22      THR  52   5.839   7.546 -11.331
  342   HG23  THR  52          HG23      THR  52   6.418   7.025  -9.747
  343    H    TYR  53           HN       TYR  53   5.758   3.241  -9.216
  344    HA   TYR  53           HA       TYR  53   8.197   4.278  -8.030
  345    HD1  TYR  53           HD2      TYR  53   6.406   5.546  -6.747
  346    HD2  TYR  53           HD1      TYR  53   4.615   1.710  -6.390
  347    HE1  TYR  53           HE2      TYR  53   4.265   6.598  -6.144
  348    HE2  TYR  53           HE1      TYR  53   2.479   2.752  -5.800
  349    HH   TYR  53           HH       TYR  53   1.745   5.872  -6.327
  350    HB2  TYR  53           HB2      TYR  53   6.771   1.835  -7.097
  351    HB3  TYR  53           HB1      TYR  53   7.646   3.019  -6.149
  352    H    ASP  54           HN       ASP  54   7.127   1.632  -9.928
  353    HA   ASP  54           HA       ASP  54   9.349  -0.138  -9.404
  354    HB2  ASP  54           HB2      ASP  54   7.274  -1.131 -10.056
  355    HB3  ASP  54           HB1      ASP  54   7.089  -0.043 -11.422
  356    H    GLU  55           HN       GLU  55   8.452   2.264 -11.856
  357    HA   GLU  55           HA       GLU  55  10.689   1.776 -13.539
  358    HB2  GLU  55           HB2      GLU  55  10.147   3.853 -14.650
  359    HB3  GLU  55           HB1      GLU  55   8.665   2.976 -14.324
  360    HG2  GLU  55           HG2      GLU  55   7.882   4.868 -13.519
  361    HG3  GLU  55           HG1      GLU  55   8.923   4.590 -12.117
  362    H    ILE  56           HN       ILE  56  10.148   3.920 -10.770
  363    HA   ILE  56           HA       ILE  56  12.765   5.046 -10.867
  364    HB   ILE  56           HB       ILE  56  10.986   4.713  -8.443
  365   HG12  ILE  56          HG12      ILE  56  11.212   7.127 -10.251
  366   HG13  ILE  56          HG11      ILE  56   9.950   5.905 -10.439
  367   HG21  ILE  56          HG21      ILE  56  13.284   6.588  -9.015
  368   HG22  ILE  56          HG22      ILE  56  13.270   5.262  -7.851
  369   HG23  ILE  56          HG23      ILE  56  12.239   6.668  -7.596
  370   HD11  ILE  56          HD11      ILE  56  10.407   7.658  -8.037
  371   HD12  ILE  56          HD12      ILE  56   9.185   6.392  -8.163
  372   HD13  ILE  56          HD13      ILE  56   9.109   7.799  -9.223
  373    H    PHE  57           HN       PHE  57  11.344   2.187  -9.470
  374    HA   PHE  57           HA       PHE  57  13.366   1.277  -7.810
  375    HD1  PHE  57           HD2      PHE  57  12.706  -0.746  -6.097
  376    HD2  PHE  57           HD1      PHE  57  12.273  -2.326 -10.020
  377    HE1  PHE  57           HE2      PHE  57  13.527  -2.924  -5.310
  378    HE2  PHE  57           HE1      PHE  57  13.087  -4.510  -9.237
  379    HZ   PHE  57           HZ       PHE  57  13.712  -4.811  -6.882
  380    HB2  PHE  57           HB2      PHE  57  11.170   0.260  -7.879
  381    HB3  PHE  57           HB1      PHE  57  11.415  -0.248  -9.543
  382    H    TYR  58           HN       TYR  58  12.836   0.317 -11.226
  383    HA   TYR  58           HA       TYR  58  15.341  -1.014 -11.420
  384    HD1  TYR  58           HD2      TYR  58  11.723  -1.380 -12.080
  385    HD2  TYR  58           HD1      TYR  58  15.148  -3.175 -13.848
  386    HE1  TYR  58           HE2      TYR  58  10.694  -3.595 -11.806
  387    HE2  TYR  58           HE1      TYR  58  14.133  -5.394 -13.570
  388    HH   TYR  58           HH       TYR  58  12.471  -6.540 -12.456
  389    HB2  TYR  58           HB2      TYR  58  13.343  -0.078 -13.468
  390    HB3  TYR  58           HB1      TYR  58  14.872  -0.825 -13.947
  391    H    THR  59           HN       THR  59  14.400   2.270 -11.738
  392    HA   THR  59           HA       THR  59  16.627   3.199 -13.230
  393    HB   THR  59           HB       THR  59  14.623   4.559 -11.430
  394    HG1  THR  59           HG1      THR  59  13.739   4.039 -13.374
  395   HG21  THR  59          HG21      THR  59  16.812   5.890 -13.021
  396   HG22  THR  59          HG22      THR  59  16.672   5.854 -11.262
  397   HG23  THR  59          HG23      THR  59  15.469   6.712 -12.225
  398    H    LEU  60           HN       LEU  60  16.095   2.456  -9.854
  399    HA   LEU  60           HA       LEU  60  18.548   3.767  -9.026
  400    HG   LEU  60           HG       LEU  60  15.541   4.123  -7.960
  401    HB2  LEU  60           HB2      LEU  60  16.618   2.018  -7.491
  402    HB3  LEU  60           HB1      LEU  60  18.004   2.840  -6.787
  403   HD11  LEU  60          HD11      LEU  60  15.194   4.912  -5.703
  404   HD12  LEU  60          HD12      LEU  60  16.688   4.135  -5.177
  405   HD13  LEU  60          HD13      LEU  60  15.322   3.151  -5.708
  406   HD21  LEU  60          HD21      LEU  60  17.575   5.406  -8.513
  407   HD22  LEU  60          HD22      LEU  60  17.978   5.453  -6.797
  408   HD23  LEU  60          HD23      LEU  60  16.520   6.255  -7.382
  409    H    SER  61           HN       SER  61  17.844   0.951 -10.558
  410    HA   SER  61           HA       SER  61  19.004  -0.908 -11.093
  411    HG   SER  61           HG       SER  61  21.992  -1.633  -9.759
  412    HB2  SER  61           HB2      SER  61  20.993   0.503 -11.222
  413    HB3  SER  61           HB1      SER  61  21.245   0.335  -9.486
  414    HA   PRO  62           HA       PRO  62  17.866  -2.926  -7.164
  415    HB2  PRO  62           HB2      PRO  62  16.234  -4.761  -8.285
  416    HB3  PRO  62           HB1      PRO  62  15.698  -3.118  -7.895
  417    HG2  PRO  62           HG2      PRO  62  16.493  -4.283 -10.525
  418    HG3  PRO  62           HG1      PRO  62  15.192  -3.145 -10.147
  419    HD2  PRO  62           HD2      PRO  62  17.620  -2.426 -11.213
  420    HD3  PRO  62           HD1      PRO  62  16.586  -1.339 -10.260
  421    H    VAL  63           HN       VAL  63  18.515  -4.864  -6.305
  422    HA   VAL  63           HA       VAL  63  20.020  -6.662  -8.063
  423    HB   VAL  63           HB       VAL  63  21.379  -7.221  -6.022
  424   HG11  VAL  63          HG11      VAL  63  21.541  -4.379  -7.018
  425   HG12  VAL  63          HG12      VAL  63  22.251  -5.793  -7.798
  426   HG13  VAL  63          HG13      VAL  63  22.837  -5.267  -6.220
  427   HG21  VAL  63          HG21      VAL  63  21.442  -5.593  -4.194
  428   HG22  VAL  63          HG22      VAL  63  19.855  -6.351  -4.325
  429   HG23  VAL  63          HG23      VAL  63  20.099  -4.717  -4.933
  430    H    ASN  64           HN       ASN  64  19.161  -8.593  -8.256
  431    HA   ASN  64           HA       ASN  64  18.114 -10.555  -7.822
  432    HB2  ASN  64           HB2      ASN  64  19.009  -9.726  -5.099
  433    HB3  ASN  64           HB1      ASN  64  17.879 -11.080  -5.226
  434   HD21  ASN  64          HD21      ASN  64  21.086  -9.929  -6.044
  435   HD22  ASN  64          HD22      ASN  64  21.749 -11.480  -6.419
  436    H    GLY  65           HN       GLY  65  16.601  -7.976  -7.926
  437    HA2  GLY  65           HA2      GLY  65  14.293  -7.713  -8.185
  438    HA3  GLY  65           HA1      GLY  65  14.046  -9.181  -7.250
  439    H    LYS  66           HN       LYS  66  16.028  -6.508  -6.157
  440    HA   LYS  66           HA       LYS  66  13.943  -4.988  -5.014
  441    HB2  LYS  66           HB2      LYS  66  14.380  -5.287  -2.658
  442    HB3  LYS  66           HB1      LYS  66  13.939  -6.838  -3.354
  443    HG2  LYS  66           HG2      LYS  66  16.817  -6.116  -3.108
  444    HG3  LYS  66           HG1      LYS  66  15.927  -6.645  -1.683
  445    HD2  LYS  66           HD2      LYS  66  15.882  -8.218  -4.230
  446    HD3  LYS  66           HD1      LYS  66  17.174  -8.417  -3.051
  447    HE2  LYS  66           HE2      LYS  66  15.647 -10.065  -2.446
  448    HE3  LYS  66           HE1      LYS  66  15.268  -8.743  -1.356
  449    HZ1  LYS  66           HZ1      LYS  66  13.804  -8.845  -3.881
  450    HZ2  LYS  66           HZ2      LYS  66  13.285  -8.351  -2.343
  451    HZ3  LYS  66           HZ3      LYS  66  13.409  -9.997  -2.705
  452    H    ILE  67           HN       ILE  67  14.798  -3.127  -3.849
  453    HA   ILE  67           HA       ILE  67  17.551  -2.539  -4.609
  454    HB   ILE  67           HB       ILE  67  16.983  -0.290  -3.474
  455   HG12  ILE  67          HG12      ILE  67  14.240  -1.504  -3.789
  456   HG13  ILE  67          HG11      ILE  67  14.987  -0.899  -2.315
  457   HG21  ILE  67          HG21      ILE  67  15.580  -1.093  -6.024
  458   HG22  ILE  67          HG22      ILE  67  17.273  -0.624  -5.883
  459   HG23  ILE  67          HG23      ILE  67  16.000   0.551  -5.543
  460   HD11  ILE  67          HD11      ILE  67  13.350   0.665  -3.067
  461   HD12  ILE  67          HD12      ILE  67  14.057   0.707  -4.681
  462   HD13  ILE  67          HD13      ILE  67  14.948   1.376  -3.309
  463    H    THR  68           HN       THR  68  19.195  -2.587  -3.213
  464    HA   THR  68           HA       THR  68  18.978  -3.400  -0.548
  465    HB   THR  68           HB       THR  68  21.247  -2.210  -0.300
  466    HG1  THR  68           HG1      THR  68  20.478  -1.216  -2.670
  467   HG21  THR  68          HG21      THR  68  21.048  -4.609  -0.698
  468   HG22  THR  68          HG22      THR  68  22.407  -3.944  -1.605
  469   HG23  THR  68          HG23      THR  68  20.897  -4.319  -2.437
  470    H    GLY  69           HN       GLY  69  18.649  -2.246   1.335
  471    HA2  GLY  69           HA2      GLY  69  16.793  -0.263   1.075
  472    HA3  GLY  69           HA1      GLY  69  17.636  -0.607   2.569
  473    H    ALA  70           HN       ALA  70  20.240   0.242   1.358
  474    HA   ALA  70           HA       ALA  70  20.298   2.941   2.034
  475    HB1  ALA  70           HB1      ALA  70  22.458   3.028   0.936
  476    HB2  ALA  70           HB2      ALA  70  22.108   1.518   0.090
  477    HB3  ALA  70           HB3      ALA  70  22.291   1.527   1.845
  478    H    ASN  71           HN       ASN  71  19.308   1.452  -0.954
  479    HA   ASN  71           HA       ASN  71  19.558   3.854  -2.533
  480    HB2  ASN  71           HB2      ASN  71  17.789   1.612  -3.411
  481    HB3  ASN  71           HB1      ASN  71  18.897   2.593  -4.361
  482   HD21  ASN  71          HD21      ASN  71  21.105   2.049  -2.405
  483   HD22  ASN  71          HD22      ASN  71  21.576   0.414  -2.688
  484    H    ALA  72           HN       ALA  72  17.058   2.126  -0.833
  485    HA   ALA  72           HA       ALA  72  14.919   3.837  -1.663
  486    HB1  ALA  72           HB1      ALA  72  15.182   1.780   0.504
  487    HB2  ALA  72           HB2      ALA  72  14.381   1.608  -1.056
  488    HB3  ALA  72           HB3      ALA  72  13.694   2.665   0.179
  489    H    LYS  73           HN       LYS  73  17.176   3.692   1.016
  490    HA   LYS  73           HA       LYS  73  16.025   5.761   2.560
  491    HB2  LYS  73           HB2      LYS  73  18.936   4.955   2.336
  492    HB3  LYS  73           HB1      LYS  73  18.264   5.988   3.587
  493    HG2  LYS  73           HG2      LYS  73  17.641   3.084   3.125
  494    HG3  LYS  73           HG1      LYS  73  18.565   3.776   4.459
  495    HD2  LYS  73           HD2      LYS  73  15.698   4.495   3.900
  496    HD3  LYS  73           HD1      LYS  73  16.161   3.162   4.961
  497    HE2  LYS  73           HE2      LYS  73  17.038   6.026   5.331
  498    HE3  LYS  73           HE1      LYS  73  15.677   5.275   6.174
  499    HZ1  LYS  73           HZ1      LYS  73  17.730   5.273   7.494
  500    HZ2  LYS  73           HZ2      LYS  73  18.491   4.326   6.312
  501    HZ3  LYS  73           HZ3      LYS  73  17.173   3.705   7.179
  502    H    LYS  74           HN       LYS  74  18.184   5.636  -0.162
  503    HA   LYS  74           HA       LYS  74  18.890   8.323  -0.395
  504    HB2  LYS  74           HB2      LYS  74  19.587   6.197  -1.766
  505    HB3  LYS  74           HB1      LYS  74  18.232   6.645  -2.796
  506    HG2  LYS  74           HG2      LYS  74  20.118   7.607  -3.785
  507    HG3  LYS  74           HG1      LYS  74  19.301   8.936  -2.951
  508    HD2  LYS  74           HD2      LYS  74  21.632   9.082  -2.492
  509    HD3  LYS  74           HD1      LYS  74  20.822   8.568  -1.019
  510    HE2  LYS  74           HE2      LYS  74  22.841   7.261  -1.328
  511    HE3  LYS  74           HE1      LYS  74  21.422   6.241  -1.529
  512    HZ1  LYS  74           HZ1      LYS  74  21.695   6.172  -3.833
  513    HZ2  LYS  74           HZ2      LYS  74  23.273   5.989  -3.226
  514    HZ3  LYS  74           HZ3      LYS  74  22.770   7.482  -3.844
  515    H    GLU  75           HN       GLU  75  16.174   6.533  -1.759
  516    HA   GLU  75           HA       GLU  75  14.846   8.611  -3.055
  517    HB2  GLU  75           HB2      GLU  75  13.885   6.059  -1.816
  518    HB3  GLU  75           HB1      GLU  75  12.742   7.183  -2.537
  519    HG2  GLU  75           HG2      GLU  75  15.053   5.855  -3.934
  520    HG3  GLU  75           HG1      GLU  75  13.349   5.428  -4.087
  521    H    MET  76           HN       MET  76  14.250   7.426   0.241
  522    HA   MET  76           HA       MET  76  12.310   9.445   0.737
  523    HB2  MET  76           HB2      MET  76  12.600   8.666   3.154
  524    HB3  MET  76           HB1      MET  76  12.008   7.497   1.983
  525    HG2  MET  76           HG2      MET  76  14.226   6.542   1.806
  526    HG3  MET  76           HG1      MET  76  14.839   7.721   2.958
  527    HE1  MET  76           HE1      MET  76  11.407   5.591   2.959
  528    HE2  MET  76           HE2      MET  76  11.986   4.210   3.890
  529    HE3  MET  76           HE3      MET  76  12.698   4.573   2.319
  530    H    VAL  77           HN       VAL  77  15.774   9.293   1.095
  531    HA   VAL  77           HA       VAL  77  16.062  11.617   2.699
  532    HB   VAL  77           HB       VAL  77  17.883  10.078   0.888
  533   HG11  VAL  77          HG11      VAL  77  18.559  12.795   2.020
  534   HG12  VAL  77          HG12      VAL  77  18.408  12.386   0.309
  535   HG13  VAL  77          HG13      VAL  77  19.703  11.678   1.276
  536   HG21  VAL  77          HG21      VAL  77  18.069  10.992   3.758
  537   HG22  VAL  77          HG22      VAL  77  19.222   9.944   2.931
  538   HG23  VAL  77          HG23      VAL  77  17.569   9.393   3.207
  539    H    LYS  78           HN       LYS  78  15.953  11.136  -0.834
  540    HA   LYS  78           HA       LYS  78  16.493  13.888  -1.401
  541    HB2  LYS  78           HB2      LYS  78  16.076  13.311  -3.718
  542    HB3  LYS  78           HB1      LYS  78  17.067  12.066  -2.965
  543    HG2  LYS  78           HG2      LYS  78  15.098  10.655  -2.695
  544    HG3  LYS  78           HG1      LYS  78  14.101  11.900  -3.446
  545    HD2  LYS  78           HD2      LYS  78  14.591  10.256  -5.095
  546    HD3  LYS  78           HD1      LYS  78  15.524  11.703  -5.471
  547    HE2  LYS  78           HE2      LYS  78  17.529  10.735  -4.702
  548    HE3  LYS  78           HE1      LYS  78  16.672   9.416  -3.903
  549    HZ1  LYS  78           HZ1      LYS  78  17.754   8.782  -6.023
  550    HZ2  LYS  78           HZ2      LYS  78  16.708   9.833  -6.840
  551    HZ3  LYS  78           HZ3      LYS  78  16.081   8.494  -6.007
  552    H    SER  79           HN       SER  79  13.671  12.160  -0.565
  553    HA   SER  79           HA       SER  79  11.732  13.683  -1.934
  554    HG   SER  79           HG       SER  79  12.302  11.709   1.062
  555    HB2  SER  79           HB2      SER  79  10.102  12.651  -0.473
  556    HB3  SER  79           HB1      SER  79  11.300  11.451  -0.964
  557    H    LYS  80           HN       LYS  80  13.816  14.801   0.338
  558    HA   LYS  80           HA       LYS  80  14.023  16.909   1.192
  559    HB2  LYS  80           HB2      LYS  80  11.190  17.367   0.218
  560    HB3  LYS  80           HB1      LYS  80  12.308  18.608   0.788
  561    HG2  LYS  80           HG2      LYS  80  13.777  18.189  -1.085
  562    HG3  LYS  80           HG1      LYS  80  12.738  16.875  -1.637
  563    HD2  LYS  80           HD2      LYS  80  10.911  18.465  -1.988
  564    HD3  LYS  80           HD1      LYS  80  11.940  19.781  -1.417
  565    HE2  LYS  80           HE2      LYS  80  12.462  18.057  -3.837
  566    HE3  LYS  80           HE1      LYS  80  11.831  19.702  -3.865
  567    HZ1  LYS  80           HZ1      LYS  80  14.193  19.690  -4.306
  568    HZ2  LYS  80           HZ2      LYS  80  14.497  18.868  -2.853
  569    HZ3  LYS  80           HZ3      LYS  80  13.895  20.451  -2.819
  570    H    LEU  81           HN       LEU  81  13.013  14.610   2.642
  571    HA   LEU  81           HA       LEU  81  11.315  15.905   4.660
  572    HG   LEU  81           HG       LEU  81  10.521  13.863   2.329
  573    HB2  LEU  81           HB2      LEU  81  11.818  12.966   4.241
  574    HB3  LEU  81           HB1      LEU  81  10.663  13.684   5.345
  575   HD11  LEU  81          HD11      LEU  81   8.859  12.249   4.251
  576   HD12  LEU  81          HD12      LEU  81  10.103  11.603   3.181
  577   HD13  LEU  81          HD13      LEU  81   8.652  12.344   2.503
  578   HD21  LEU  81          HD21      LEU  81   8.266  14.750   2.741
  579   HD22  LEU  81          HD22      LEU  81   9.532  15.801   3.380
  580   HD23  LEU  81          HD23      LEU  81   8.608  14.765   4.469
  581    HA   PRO  82           HA       PRO  82  14.576  15.318   7.651
  582    HB2  PRO  82           HB2      PRO  82  13.183  15.182   9.947
  583    HB3  PRO  82           HB1      PRO  82  13.273  16.691   9.001
  584    HG2  PRO  82           HG2      PRO  82  11.069  14.682   9.170
  585    HG3  PRO  82           HG1      PRO  82  10.976  16.447   9.084
  586    HD2  PRO  82           HD2      PRO  82  10.616  14.725   6.957
  587    HD3  PRO  82           HD1      PRO  82  11.046  16.440   6.812
  588    H    ASN  83           HN       ASN  83  15.574  13.762   8.872
  589    HA   ASN  83           HA       ASN  83  15.332  11.141   8.088
  590    HB2  ASN  83           HB2      ASN  83  16.593  12.279  10.586
  591    HB3  ASN  83           HB1      ASN  83  16.794  10.610  10.070
  592   HD21  ASN  83          HD21      ASN  83  18.119  10.140   8.364
  593   HD22  ASN  83          HD22      ASN  83  19.157  11.307   7.629
  594    H    THR  84           HN       THR  84  13.680  12.717  10.740
  595    HA   THR  84           HA       THR  84  12.930  10.431  12.199
  596    HB   THR  84           HB       THR  84  11.124  12.814  11.981
  597    HG1  THR  84           HG1      THR  84  13.214  13.128  13.742
  598   HG21  THR  84          HG21      THR  84  12.146  11.212  14.329
  599   HG22  THR  84          HG22      THR  84  10.579  11.000  13.548
  600   HG23  THR  84          HG23      THR  84  10.948  12.505  14.392
  601    H    VAL  85           HN       VAL  85  11.233  12.257   9.672
  602    HA   VAL  85           HA       VAL  85   8.948  10.609   9.532
  603    HB   VAL  85           HB       VAL  85  10.122  12.385   7.389
  604   HG11  VAL  85          HG11      VAL  85   8.564  10.810   6.424
  605   HG12  VAL  85          HG12      VAL  85   7.826  12.411   6.482
  606   HG13  VAL  85          HG13      VAL  85   7.368  11.182   7.662
  607   HG21  VAL  85          HG21      VAL  85   9.626  13.597   9.446
  608   HG22  VAL  85          HG22      VAL  85   7.992  12.931   9.466
  609   HG23  VAL  85          HG23      VAL  85   8.485  14.033   8.178
  610    H    LEU  86           HN       LEU  86  12.025  10.587   7.763
  611    HA   LEU  86           HA       LEU  86  11.319   8.530   5.964
  612    HG   LEU  86           HG       LEU  86  13.892   9.729   4.222
  613    HB2  LEU  86           HB2      LEU  86  14.011   9.420   6.995
  614    HB3  LEU  86           HB1      LEU  86  13.813   8.154   5.778
  615   HD11  LEU  86          HD11      LEU  86  11.470   9.571   4.284
  616   HD12  LEU  86          HD12      LEU  86  11.991  11.203   3.861
  617   HD13  LEU  86          HD13      LEU  86  11.407  10.855   5.490
  618   HD21  LEU  86          HD21      LEU  86  15.140  11.111   5.753
  619   HD22  LEU  86          HD22      LEU  86  13.641  11.746   6.438
  620   HD23  LEU  86          HD23      LEU  86  14.072  12.110   4.767
  621    H    GLY  87           HN       GLY  87  12.777   8.491   9.167
  622    HA2  GLY  87           HA2      GLY  87  13.399   5.781   9.335
  623    HA3  GLY  87           HA1      GLY  87  12.979   6.800  10.705
  624    H    LYS  88           HN       LYS  88  10.326   7.435  10.108
  625    HA   LYS  88           HA       LYS  88   9.158   4.891  10.799
  626    HB2  LYS  88           HB2      LYS  88   7.076   6.107  11.208
  627    HB3  LYS  88           HB1      LYS  88   8.430   6.778  12.095
  628    HG2  LYS  88           HG2      LYS  88   8.525   8.673  10.730
  629    HG3  LYS  88           HG1      LYS  88   7.498   7.930   9.500
  630    HD2  LYS  88           HD2      LYS  88   5.595   7.991  10.984
  631    HD3  LYS  88           HD1      LYS  88   6.602   8.575  12.310
  632    HE2  LYS  88           HE2      LYS  88   6.913  10.675  11.273
  633    HE3  LYS  88           HE1      LYS  88   6.269  10.097   9.735
  634    HZ1  LYS  88           HZ1      LYS  88   4.095   9.898  10.748
  635    HZ2  LYS  88           HZ2      LYS  88   4.672  11.482  10.931
  636    HZ3  LYS  88           HZ3      LYS  88   4.697  10.407  12.250
  637    H    ILE  89           HN       ILE  89   9.169   6.975   7.955
  638    HA   ILE  89           HA       ILE  89   7.169   5.642   6.508
  639    HB   ILE  89           HB       ILE  89   9.729   6.912   5.523
  640   HG12  ILE  89          HG12      ILE  89   6.847   7.833   5.469
  641   HG13  ILE  89          HG11      ILE  89   8.106   8.460   6.525
  642   HG21  ILE  89          HG21      ILE  89   8.999   5.202   3.926
  643   HG22  ILE  89          HG22      ILE  89   8.778   6.824   3.268
  644   HG23  ILE  89          HG23      ILE  89   7.390   5.928   3.884
  645   HD11  ILE  89          HD11      ILE  89   8.075   8.669   3.525
  646   HD12  ILE  89          HD12      ILE  89   9.311   9.320   4.602
  647   HD13  ILE  89          HD13      ILE  89   7.666   9.952   4.663
  648    H    TRP  90           HN       TRP  90  10.630   4.985   6.848
  649    HA   TRP  90           HA       TRP  90  10.808   2.761   5.202
  650    HD1  TRP  90           HD1      TRP  90  12.909   0.880   8.523
  651    HE1  TRP  90           HE1      TRP  90  14.197  -1.072   7.412
  652    HE3  TRP  90           HE3      TRP  90  13.254   2.719   3.767
  653    HZ2  TRP  90           HZ2      TRP  90  15.223  -1.739   4.860
  654    HZ3  TRP  90           HZ3      TRP  90  14.397   1.366   2.069
  655    HH2  TRP  90           HH2      TRP  90  15.359  -0.806   2.599
  656    HB2  TRP  90           HB2      TRP  90  12.800   3.812   6.125
  657    HB3  TRP  90           HB1      TRP  90  12.328   3.328   7.752
  658    H    LYS  91           HN       LYS  91  10.300   2.820   8.733
  659    HA   LYS  91           HA       LYS  91  10.049  -0.006   8.863
  660    HB2  LYS  91           HB2      LYS  91   9.560   0.294  11.197
  661    HB3  LYS  91           HB1      LYS  91  10.857   1.384  10.731
  662    HG2  LYS  91           HG2      LYS  91   9.423   3.258  10.785
  663    HG3  LYS  91           HG1      LYS  91   7.990   2.237  10.968
  664    HD2  LYS  91           HD2      LYS  91   8.552   3.136  13.113
  665    HD3  LYS  91           HD1      LYS  91   8.967   1.419  13.100
  666    HE2  LYS  91           HE2      LYS  91  10.704   2.755  14.154
  667    HE3  LYS  91           HE1      LYS  91  11.293   1.946  12.711
  668    HZ1  LYS  91           HZ1      LYS  91  10.514   4.803  12.958
  669    HZ2  LYS  91           HZ2      LYS  91  10.956   4.050  11.507
  670    HZ3  LYS  91           HZ3      LYS  91  12.085   4.194  12.763
  671    H    LEU  92           HN       LEU  92   7.887   2.363   7.873
  672    HA   LEU  92           HA       LEU  92   5.533   0.771   8.514
  673    HG   LEU  92           HG       LEU  92   3.413   2.008   7.091
  674    HB2  LEU  92           HB2      LEU  92   5.668   3.343   8.589
  675    HB3  LEU  92           HB1      LEU  92   5.578   3.265   6.832
  676   HD11  LEU  92          HD11      LEU  92   2.258   2.133   9.225
  677   HD12  LEU  92          HD12      LEU  92   3.651   2.925   9.956
  678   HD13  LEU  92          HD13      LEU  92   3.774   1.250   9.411
  679   HD21  LEU  92          HD21      LEU  92   3.498   4.764   8.308
  680   HD22  LEU  92          HD22      LEU  92   2.108   3.998   7.540
  681   HD23  LEU  92          HD23      LEU  92   3.528   4.417   6.581
  682    H    ALA  93           HN       ALA  93   7.618   1.599   5.792
  683    HA   ALA  93           HA       ALA  93   5.849   0.315   3.880
  684    HB1  ALA  93           HB1      ALA  93   8.598   1.492   3.497
  685    HB2  ALA  93           HB2      ALA  93   7.067   2.334   3.246
  686    HB3  ALA  93           HB3      ALA  93   7.505   0.969   2.217
  687    H    ASP  94           HN       ASP  94   9.040  -0.328   5.334
  688    HA   ASP  94           HA       ASP  94   9.253  -2.835   3.875
  689    HB2  ASP  94           HB2      ASP  94  11.286  -1.481   4.307
  690    HB3  ASP  94           HB1      ASP  94  11.054  -1.712   6.030
  691    H    VAL  95           HN       VAL  95   7.804  -4.265   4.538
  692    HA   VAL  95           HA       VAL  95   6.848  -4.389   7.212
  693    HB   VAL  95           HB       VAL  95   6.431  -6.404   5.002
  694   HG11  VAL  95          HG11      VAL  95   4.781  -5.837   7.463
  695   HG12  VAL  95          HG12      VAL  95   5.853  -7.220   7.246
  696   HG13  VAL  95          HG13      VAL  95   4.426  -7.041   6.222
  697   HG21  VAL  95          HG21      VAL  95   5.753  -4.185   4.266
  698   HG22  VAL  95          HG22      VAL  95   4.781  -3.989   5.724
  699   HG23  VAL  95          HG23      VAL  95   4.342  -5.210   4.529
  700    H    ASP  96           HN       ASP  96   9.296  -6.079   5.429
  701    HA   ASP  96           HA       ASP  96   9.558  -8.203   7.379
  702    HB2  ASP  96           HB2      ASP  96  11.855  -7.527   5.692
  703    HB3  ASP  96           HB1      ASP  96  11.108  -9.106   5.964
  704    H    LYS  97           HN       LYS  97  10.777  -5.031   6.758
  705    HA   LYS  97           HA       LYS  97  12.338  -3.693   7.720
  706    HB2  LYS  97           HB2      LYS  97  11.953  -5.542  10.091
  707    HB3  LYS  97           HB1      LYS  97  12.668  -3.931  10.138
  708    HG2  LYS  97           HG2      LYS  97  10.618  -2.926   9.475
  709    HG3  LYS  97           HG1      LYS  97   9.879  -4.492   9.189
  710    HD2  LYS  97           HD2      LYS  97  10.153  -5.012  11.605
  711    HD3  LYS  97           HD1      LYS  97  10.750  -3.367  11.849
  712    HE2  LYS  97           HE2      LYS  97   8.649  -2.451  11.076
  713    HE3  LYS  97           HE1      LYS  97   8.051  -4.066  10.702
  714    HZ1  LYS  97           HZ1      LYS  97   8.208  -4.601  13.071
  715    HZ2  LYS  97           HZ2      LYS  97   7.150  -3.309  12.785
  716    HZ3  LYS  97           HZ3      LYS  97   8.702  -3.015  13.402
  717    H    ASP  98           HN       ASP  98  13.275  -5.369   5.990
  718    HA   ASP  98           HA       ASP  98  15.425  -6.957   7.187
  719    HB2  ASP  98           HB2      ASP  98  15.379  -8.282   5.092
  720    HB3  ASP  98           HB1      ASP  98  13.851  -8.317   5.975
  721    H    GLY  99           HN       GLY  99  15.102  -4.022   5.920
  722    HA2  GLY  99           HA2      GLY  99  16.864  -2.554   5.496
  723    HA3  GLY  99           HA1      GLY  99  17.950  -3.932   5.423
  724    H    LEU 100           HN       LEU 100  15.152  -4.175   3.509
  725    HA   LEU 100           HA       LEU 100  16.248  -2.798   1.237
  726    HG   LEU 100           HG       LEU 100  15.677  -6.281   2.295
  727    HB2  LEU 100           HB2      LEU 100  16.151  -4.781  -0.244
  728    HB3  LEU 100           HB1      LEU 100  17.424  -4.864   0.956
  729   HD11  LEU 100          HD11      LEU 100  14.683  -6.536  -0.529
  730   HD12  LEU 100          HD12      LEU 100  13.773  -5.976   0.878
  731   HD13  LEU 100          HD13      LEU 100  14.294  -7.658   0.777
  732   HD21  LEU 100          HD21      LEU 100  17.832  -7.042   1.488
  733   HD22  LEU 100          HD22      LEU 100  17.139  -7.327  -0.111
  734   HD23  LEU 100          HD23      LEU 100  16.599  -8.284   1.271
  735    H    LEU 101           HN       LEU 101  14.684  -3.437  -0.746
  736    HA   LEU 101           HA       LEU 101  11.941  -3.536   0.150
  737    HG   LEU 101           HG       LEU 101  13.069  -1.004   1.481
  738    HB2  LEU 101           HB2      LEU 101  13.202  -1.030  -0.971
  739    HB3  LEU 101           HB1      LEU 101  11.479  -1.335  -1.077
  740   HD11  LEU 101          HD11      LEU 101  12.721   1.062   0.204
  741   HD12  LEU 101          HD12      LEU 101  11.808   1.056   1.712
  742   HD13  LEU 101          HD13      LEU 101  10.989   0.744   0.180
  743   HD21  LEU 101          HD21      LEU 101  10.120  -1.416   1.041
  744   HD22  LEU 101          HD22      LEU 101  10.886  -1.032   2.581
  745   HD23  LEU 101          HD23      LEU 101  11.229  -2.569   1.782
  746    H    ASP 102           HN       ASP 102  11.168  -4.929  -1.355
  747    HA   ASP 102           HA       ASP 102  12.433  -5.226  -3.904
  748    HB2  ASP 102           HB2      ASP 102  11.092  -7.071  -4.211
  749    HB3  ASP 102           HB1      ASP 102  11.318  -7.030  -2.467
  750    H    ASP 103           HN       ASP 103  10.394  -5.609  -5.748
  751    HA   ASP 103           HA       ASP 103  10.048  -3.021  -6.763
  752    HB2  ASP 103           HB2      ASP 103   8.243  -5.389  -7.330
  753    HB3  ASP 103           HB1      ASP 103   8.575  -4.018  -8.396
  754    H    GLU 104           HN       GLU 104   7.905  -4.982  -4.725
  755    HA   GLU 104           HA       GLU 104   5.833  -2.938  -4.888
  756    HB2  GLU 104           HB2      GLU 104   5.892  -5.744  -4.103
  757    HB3  GLU 104           HB1      GLU 104   4.917  -4.738  -3.041
  758    HG2  GLU 104           HG2      GLU 104   3.315  -5.156  -4.540
  759    HG3  GLU 104           HG1      GLU 104   4.090  -3.827  -5.424
  760    H    GLU 105           HN       GLU 105   8.269  -4.037  -2.668
  761    HA   GLU 105           HA       GLU 105   7.281  -2.601  -0.423
  762    HB2  GLU 105           HB2      GLU 105   9.585  -4.188  -1.107
  763    HB3  GLU 105           HB1      GLU 105  10.053  -2.767  -0.190
  764    HG2  GLU 105           HG2      GLU 105   8.755  -3.398   1.660
  765    HG3  GLU 105           HG1      GLU 105   7.837  -4.564   0.712
  766    H    PHE 106           HN       PHE 106   9.448  -1.829  -3.094
  767    HA   PHE 106           HA       PHE 106   9.990   0.848  -2.334
  768    HD1  PHE 106           HD1      PHE 106   9.307   2.678  -3.990
  769    HD2  PHE 106           HD2      PHE 106  12.620   0.743  -5.804
  770    HE1  PHE 106           HE1      PHE 106  10.163   4.851  -4.740
  771    HE2  PHE 106           HE2      PHE 106  13.482   2.917  -6.557
  772    HZ   PHE 106           HZ       PHE 106  12.377   4.907  -6.063
  773    HB2  PHE 106           HB2      PHE 106  11.177  -0.434  -4.189
  774    HB3  PHE 106           HB1      PHE 106   9.745  -0.192  -5.175
  775    H    ALA 107           HN       ALA 107   7.461  -0.760  -4.218
  776    HA   ALA 107           HA       ALA 107   6.047   1.452  -5.097
  777    HB1  ALA 107           HB1      ALA 107   4.152  -0.016  -5.283
  778    HB2  ALA 107           HB2      ALA 107   4.869  -1.151  -4.139
  779    HB3  ALA 107           HB3      ALA 107   5.609  -0.904  -5.720
  780    H    LEU 108           HN       LEU 108   5.910  -0.197  -1.975
  781    HA   LEU 108           HA       LEU 108   3.872   1.488  -0.909
  782    HG   LEU 108           HG       LEU 108   2.776  -0.022   0.755
  783    HB2  LEU 108           HB2      LEU 108   4.848  -0.886  -0.178
  784    HB3  LEU 108           HB1      LEU 108   5.784   0.137   0.904
  785   HD11  LEU 108          HD11      LEU 108   3.005  -0.962   2.993
  786   HD12  LEU 108          HD12      LEU 108   4.759  -0.894   2.825
  787   HD13  LEU 108          HD13      LEU 108   3.813  -1.945   1.772
  788   HD21  LEU 108          HD21      LEU 108   3.501   2.250   1.332
  789   HD22  LEU 108          HD22      LEU 108   4.516   1.593   2.617
  790   HD23  LEU 108          HD23      LEU 108   2.762   1.433   2.711
  791    H    ALA 109           HN       ALA 109   7.397   1.327  -0.434
  792    HA   ALA 109           HA       ALA 109   7.721   3.350   1.414
  793    HB1  ALA 109           HB1      ALA 109   9.535   2.696  -0.904
  794    HB2  ALA 109           HB2      ALA 109   9.536   1.899   0.670
  795    HB3  ALA 109           HB3      ALA 109   9.992   3.597   0.539
  796    H    ASN 110           HN       ASN 110   7.766   3.664  -2.128
  797    HA   ASN 110           HA       ASN 110   8.068   6.486  -2.098
  798    HB2  ASN 110           HB2      ASN 110   8.684   4.827  -3.980
  799    HB3  ASN 110           HB1      ASN 110   6.989   4.933  -4.435
  800   HD21  ASN 110          HD21      ASN 110  10.023   6.553  -4.296
  801   HD22  ASN 110          HD22      ASN 110   9.581   7.942  -5.223
  802    H    HIS 111           HN       HIS 111   5.378   4.250  -1.986
  803    HA   HIS 111           HA       HIS 111   3.402   6.123  -2.842
  804    HD1  HIS 111           HD1      HIS 111   1.210   4.968  -4.176
  805    HD2  HIS 111           HD2      HIS 111   0.420   4.495  -0.117
  806    HE1  HIS 111           HE1      HIS 111  -1.227   5.513  -3.891
  807    HE2  HIS 111           HE2      HIS 111  -1.564   5.577  -1.395
  808    HB2  HIS 111           HB2      HIS 111   3.057   3.598  -2.733
  809    HB3  HIS 111           HB1      HIS 111   2.906   3.791  -0.984
  810    H    LEU 112           HN       LEU 112   4.742   5.178   0.273
  811    HA   LEU 112           HA       LEU 112   2.980   6.761   1.837
  812    HG   LEU 112           HG       LEU 112   3.689   3.952   2.389
  813    HB2  LEU 112           HB2      LEU 112   5.648   5.476   2.348
  814    HB3  LEU 112           HB1      LEU 112   4.871   6.496   3.562
  815   HD11  LEU 112          HD11      LEU 112   4.109   3.044   4.631
  816   HD12  LEU 112          HD12      LEU 112   4.909   4.547   5.090
  817   HD13  LEU 112          HD13      LEU 112   5.607   3.526   3.835
  818   HD21  LEU 112          HD21      LEU 112   1.989   5.613   3.027
  819   HD22  LEU 112          HD22      LEU 112   2.719   5.744   4.626
  820   HD23  LEU 112          HD23      LEU 112   1.984   4.224   4.116
  821    H    ILE 113           HN       ILE 113   6.130   7.343   0.358
  822    HA   ILE 113           HA       ILE 113   6.635   9.878   1.438
  823    HB   ILE 113           HB       ILE 113   7.337   8.751  -1.285
  824   HG12  ILE 113          HG12      ILE 113   9.092   9.219   1.125
  825   HG13  ILE 113          HG11      ILE 113   8.263   7.690   0.824
  826   HG21  ILE 113          HG21      ILE 113   7.338  11.191  -1.394
  827   HG22  ILE 113          HG22      ILE 113   8.983  10.551  -1.456
  828   HG23  ILE 113          HG23      ILE 113   8.367  11.256   0.038
  829   HD11  ILE 113          HD11      ILE 113  10.569   7.587   0.087
  830   HD12  ILE 113          HD12      ILE 113  10.322   8.990  -0.952
  831   HD13  ILE 113          HD13      ILE 113   9.484   7.477  -1.299
  832    H    LYS 114           HN       LYS 114   4.945   9.013  -1.610
  833    HA   LYS 114           HA       LYS 114   4.143  11.732  -2.021
  834    HB2  LYS 114           HB2      LYS 114   2.770  10.898  -3.864
  835    HB3  LYS 114           HB1      LYS 114   4.399  10.251  -3.934
  836    HG2  LYS 114           HG2      LYS 114   3.541   8.152  -2.932
  837    HG3  LYS 114           HG1      LYS 114   1.911   8.822  -3.050
  838    HD2  LYS 114           HD2      LYS 114   3.799   8.428  -5.371
  839    HD3  LYS 114           HD1      LYS 114   2.469   7.350  -4.947
  840    HE2  LYS 114           HE2      LYS 114   0.846   9.029  -5.403
  841    HE3  LYS 114           HE1      LYS 114   2.086  10.276  -5.548
  842    HZ1  LYS 114           HZ1      LYS 114   2.870   9.286  -7.557
  843    HZ2  LYS 114           HZ2      LYS 114   1.192   9.468  -7.692
  844    HZ3  LYS 114           HZ3      LYS 114   1.851   7.939  -7.371
  845    H    VAL 115           HN       VAL 115   2.823   9.082  -0.233
  846    HA   VAL 115           HA       VAL 115   0.203   9.998   0.153
  847    HB   VAL 115           HB       VAL 115   2.072   8.321   1.787
  848   HG11  VAL 115          HG11      VAL 115  -0.588   9.309   2.820
  849   HG12  VAL 115          HG12      VAL 115   0.990   9.769   3.455
  850   HG13  VAL 115          HG13      VAL 115   0.444   8.098   3.585
  851   HG21  VAL 115          HG21      VAL 115  -0.729   7.908   0.753
  852   HG22  VAL 115          HG22      VAL 115   0.261   6.696   1.567
  853   HG23  VAL 115          HG23      VAL 115   0.753   7.326  -0.006
  854    H    LYS 116           HN       LYS 116   3.217  10.828   1.927
  855    HA   LYS 116           HA       LYS 116   1.746  12.838   3.396
  856    HB2  LYS 116           HB2      LYS 116   3.805  13.299   4.555
  857    HB3  LYS 116           HB1      LYS 116   3.446  11.578   4.565
  858    HG2  LYS 116           HG2      LYS 116   5.183  11.076   3.155
  859    HG3  LYS 116           HG1      LYS 116   5.252  12.715   2.490
  860    HD2  LYS 116           HD2      LYS 116   5.994  11.905   5.291
  861    HD3  LYS 116           HD1      LYS 116   7.119  12.296   3.996
  862    HE2  LYS 116           HE2      LYS 116   5.187  14.115   5.409
  863    HE3  LYS 116           HE1      LYS 116   6.936  14.254   5.298
  864    HZ1  LYS 116           HZ1      LYS 116   6.510  14.515   2.794
  865    HZ2  LYS 116           HZ2      LYS 116   6.170  15.831   3.806
  866    HZ3  LYS 116           HZ3      LYS 116   4.908  14.849   3.241
  867    H    LEU 117           HN       LEU 117   2.957  12.656   0.386
  868    HA   LEU 117           HA       LEU 117   3.565  15.488   0.159
  869    HG   LEU 117           HG       LEU 117   2.889  15.732  -2.843
  870    HB2  LEU 117           HB2      LEU 117   4.686  13.844  -1.309
  871    HB3  LEU 117           HB1      LEU 117   3.118  13.395  -1.982
  872   HD11  LEU 117          HD11      LEU 117   4.400  16.834  -1.270
  873   HD12  LEU 117          HD12      LEU 117   4.879  17.142  -2.940
  874   HD13  LEU 117          HD13      LEU 117   5.767  15.966  -1.972
  875   HD21  LEU 117          HD21      LEU 117   3.645  13.947  -4.300
  876   HD22  LEU 117          HD22      LEU 117   5.306  14.175  -3.754
  877   HD23  LEU 117          HD23      LEU 117   4.502  15.444  -4.676
  878    H    GLU 118           HN       GLU 118   0.860  13.377   0.072
  879    HA   GLU 118           HA       GLU 118  -0.962  14.943  -1.425
  880    HB2  GLU 118           HB2      GLU 118  -1.437  12.944   0.797
  881    HB3  GLU 118           HB1      GLU 118  -2.714  13.648  -0.178
  882    HG2  GLU 118           HG2      GLU 118  -1.750  12.630  -2.180
  883    HG3  GLU 118           HG1      GLU 118  -0.471  11.911  -1.191
  884    H    GLY 119           HN       GLY 119   0.438  15.354   1.641
  885    HA2  GLY 119           HA2      GLY 119   0.161  17.585   2.643
  886    HA3  GLY 119           HA1      GLY 119  -1.557  17.425   2.305
  887    H    HIS 120           HN       HIS 120  -1.352  14.524   3.106
  888    HA   HIS 120           HA       HIS 120  -1.310  14.943   6.019
  889    HD1  HIS 120           HD1      HIS 120  -2.404  11.248   6.956
  890    HD2  HIS 120           HD2      HIS 120  -2.581  11.650   2.815
  891    HE1  HIS 120           HE1      HIS 120  -2.138   8.934   6.050
  892    HE2  HIS 120           HE2      HIS 120  -2.556   9.174   3.566
  893    HB2  HIS 120           HB2      HIS 120  -3.103  13.568   6.200
  894    HB3  HIS 120           HB1      HIS 120  -3.326  13.858   4.484
  895    H    GLU 121           HN       GLU 121   0.163  13.727   7.241
  896    HA   GLU 121           HA       GLU 121   2.078  12.247   5.614
  897    HB2  GLU 121           HB2      GLU 121   3.607  12.385   7.451
  898    HB3  GLU 121           HB1      GLU 121   2.903  13.973   7.193
  899    HG2  GLU 121           HG2      GLU 121   1.471  13.720   9.086
  900    HG3  GLU 121           HG1      GLU 121   1.954  12.032   9.280
  901    H    LEU 122           HN       LEU 122   2.987  10.220   6.459
  902    HA   LEU 122           HA       LEU 122   0.989   8.328   6.960
  903    HG   LEU 122           HG       LEU 122   5.119   7.414   6.519
  904    HB2  LEU 122           HB2      LEU 122   3.139   6.899   7.668
  905    HB3  LEU 122           HB1      LEU 122   2.680   7.192   5.996
  906   HD11  LEU 122          HD11      LEU 122   5.460   9.444   5.205
  907   HD12  LEU 122          HD12      LEU 122   3.761   9.865   5.419
  908   HD13  LEU 122          HD13      LEU 122   4.206   8.414   4.518
  909   HD21  LEU 122          HD21      LEU 122   4.126   9.774   8.078
  910   HD22  LEU 122          HD22      LEU 122   5.804   9.589   7.550
  911   HD23  LEU 122          HD23      LEU 122   5.088   8.412   8.653
  912    HA   PRO 123           HA       PRO 123   0.734   8.879  11.331
  913    HB2  PRO 123           HB2      PRO 123  -1.551   7.574  11.665
  914    HB3  PRO 123           HB1      PRO 123  -1.489   9.055  10.702
  915    HG2  PRO 123           HG2      PRO 123  -1.738   6.224   9.809
  916    HG3  PRO 123           HG1      PRO 123  -2.334   7.720   9.057
  917    HD2  PRO 123           HD2      PRO 123   0.031   6.275   8.414
  918    HD3  PRO 123           HD1      PRO 123  -0.549   7.805   7.719
  919    H    ALA 124           HN       ALA 124   2.005   6.324   9.993
  920    HA   ALA 124           HA       ALA 124   2.980   4.419  10.696
  921    HB1  ALA 124           HB1      ALA 124   3.416   4.099  13.083
  922    HB2  ALA 124           HB2      ALA 124   2.282   5.397  13.464
  923    HB3  ALA 124           HB3      ALA 124   3.769   5.755  12.586
  924    H    ASP 125           HN       ASP 125   0.204   4.451   9.963
  925    HA   ASP 125           HA       ASP 125  -0.469   1.941  11.319
  926    HB2  ASP 125           HB2      ASP 125  -2.696   2.253  11.004
  927    HB3  ASP 125           HB1      ASP 125  -2.200   3.909  11.286
  928    H    LEU 126           HN       LEU 126  -0.875   0.186  10.130
  929    HA   LEU 126           HA       LEU 126  -0.313   0.365   7.266
  930    HG   LEU 126           HG       LEU 126   0.517  -2.511   6.675
  931    HB2  LEU 126           HB2      LEU 126   1.634  -0.496   8.632
  932    HB3  LEU 126           HB1      LEU 126   0.640  -1.886   9.025
  933   HD11  LEU 126          HD11      LEU 126   0.580  -0.265   5.725
  934   HD12  LEU 126          HD12      LEU 126   1.790  -1.316   4.984
  935   HD13  LEU 126          HD13      LEU 126   2.277  -0.114   6.181
  936   HD21  LEU 126          HD21      LEU 126   2.877  -3.091   6.332
  937   HD22  LEU 126          HD22      LEU 126   2.351  -3.393   7.988
  938   HD23  LEU 126          HD23      LEU 126   3.329  -1.973   7.619
  939    HA   PRO 127           HA       PRO 127  -4.315  -1.716   7.678
  940    HB2  PRO 127           HB2      PRO 127  -4.774  -0.793   4.959
  941    HB3  PRO 127           HB1      PRO 127  -5.616  -0.340   6.444
  942    HG2  PRO 127           HG2      PRO 127  -3.999   1.336   5.041
  943    HG3  PRO 127           HG1      PRO 127  -4.289   1.484   6.790
  944    HD2  PRO 127           HD2      PRO 127  -1.946   0.342   5.337
  945    HD3  PRO 127           HD1      PRO 127  -1.990   1.296   6.831
  946    HA   PRO 128           HA       PRO 128  -3.308  -5.492   5.590
  947    HB2  PRO 128           HB2      PRO 128  -5.849  -6.408   5.074
  948    HB3  PRO 128           HB1      PRO 128  -5.028  -6.555   6.635
  949    HG2  PRO 128           HG2      PRO 128  -7.047  -4.533   5.734
  950    HG3  PRO 128           HG1      PRO 128  -6.914  -5.365   7.293
  951    HD2  PRO 128           HD2      PRO 128  -6.089  -2.834   6.980
  952    HD3  PRO 128           HD1      PRO 128  -5.221  -3.968   8.038
  953    H    HIS 129           HN       HIS 129  -5.183  -3.013   4.132
  954    HA   HIS 129           HA       HIS 129  -4.986  -4.265   1.497
  955    HD1  HIS 129           HD1      HIS 129  -7.846  -2.021   4.088
  956    HD2  HIS 129           HD2      HIS 129  -5.643   0.199   1.354
  957    HE1  HIS 129           HE1      HIS 129  -7.942   0.350   4.902
  958    HE2  HIS 129           HE2      HIS 129  -6.902   1.690   3.041
  959    HB2  HIS 129           HB2      HIS 129  -6.454  -2.459   0.694
  960    HB3  HIS 129           HB1      HIS 129  -7.185  -3.351   2.014
  961    H    LEU 130           HN       LEU 130  -2.778  -2.968   3.148
  962    HA   LEU 130           HA       LEU 130  -1.635  -1.540   0.842
  963    HG   LEU 130           HG       LEU 130  -1.137   0.740   0.919
  964    HB2  LEU 130           HB2      LEU 130  -2.142  -0.494   3.438
  965    HB3  LEU 130           HB1      LEU 130  -0.422  -0.438   3.118
  966   HD11  LEU 130          HD11      LEU 130  -3.180   2.029   1.062
  967   HD12  LEU 130          HD12      LEU 130  -3.569   1.280   2.611
  968   HD13  LEU 130          HD13      LEU 130  -3.539   0.305   1.144
  969   HD21  LEU 130          HD21      LEU 130  -1.084   2.901   2.045
  970   HD22  LEU 130          HD22      LEU 130   0.115   1.793   2.710
  971   HD23  LEU 130          HD23      LEU 130  -1.383   2.105   3.589
  972    H    VAL 131           HN       VAL 131  -1.457  -4.233   2.449
  973    HA   VAL 131           HA       VAL 131   1.404  -4.202   2.968
  974    HB   VAL 131           HB       VAL 131   1.115  -6.557   3.711
  975   HG11  VAL 131          HG11      VAL 131  -0.070  -6.018   5.776
  976   HG12  VAL 131          HG12      VAL 131  -0.720  -4.562   5.023
  977   HG13  VAL 131          HG13      VAL 131   1.015  -4.711   5.298
  978   HG21  VAL 131          HG21      VAL 131  -1.830  -6.032   3.319
  979   HG22  VAL 131          HG22      VAL 131  -1.111  -7.467   4.049
  980   HG23  VAL 131          HG23      VAL 131  -0.848  -7.123   2.339
  981    HA   PRO 132           HA       PRO 132   2.369  -5.260  -1.196
  982    HB2  PRO 132           HB2      PRO 132   4.657  -6.635   0.138
  983    HB3  PRO 132           HB1      PRO 132   4.668  -5.478  -1.197
  984    HG2  PRO 132           HG2      PRO 132   5.365  -4.764   1.292
  985    HG3  PRO 132           HG1      PRO 132   4.502  -3.655   0.213
  986    HD2  PRO 132           HD2      PRO 132   3.521  -5.158   2.572
  987    HD3  PRO 132           HD1      PRO 132   2.976  -3.598   1.908
  988    HA   PRO 133           HA       PRO 133   0.542  -9.166  -2.004
  989    HB2  PRO 133           HB2      PRO 133   2.936  -9.558  -3.761
  990    HB3  PRO 133           HB1      PRO 133   1.220  -9.851  -4.109
  991    HG2  PRO 133           HG2      PRO 133   2.403  -7.650  -4.995
  992    HG3  PRO 133           HG1      PRO 133   0.747  -7.593  -4.348
  993    HD2  PRO 133           HD2      PRO 133   3.290  -6.623  -3.133
  994    HD3  PRO 133           HD1      PRO 133   1.629  -6.024  -2.930
  995    H    SER 134           HN       SER 134   3.962  -9.233  -1.082
  996    HA   SER 134           HA       SER 134   3.895 -12.121  -0.751
  997    HG   SER 134           HG       SER 134   6.095 -11.819  -2.407
  998    HB2  SER 134           HB2      SER 134   6.141 -10.190  -0.141
  999    HB3  SER 134           HB1      SER 134   6.263 -11.947  -0.277
 1000    H    LYS 135           HN       LYS 135   3.097  -9.474   1.204
 1001    HA   LYS 135           HA       LYS 135   3.638 -11.104   3.596
 1002    HB2  LYS 135           HB2      LYS 135   3.469  -8.677   4.728
 1003    HB3  LYS 135           HB1      LYS 135   4.975  -9.385   4.171
 1004    HG2  LYS 135           HG2      LYS 135   3.371  -7.646   2.335
 1005    HG3  LYS 135           HG1      LYS 135   4.399  -6.930   3.585
 1006    HD2  LYS 135           HD2      LYS 135   5.353  -8.912   1.513
 1007    HD3  LYS 135           HD1      LYS 135   5.507  -7.162   1.354
 1008    HE2  LYS 135           HE2      LYS 135   6.878  -7.085   3.368
 1009    HE3  LYS 135           HE1      LYS 135   6.674  -8.822   3.584
 1010    HZ1  LYS 135           HZ1      LYS 135   7.843  -9.157   1.472
 1011    HZ2  LYS 135           HZ2      LYS 135   8.804  -8.348   2.605
 1012    HZ3  LYS 135           HZ3      LYS 135   8.096  -7.486   1.330
 1013    H    ARG 136           HN       ARG 136   1.200 -10.379   1.714
 1014    HA   ARG 136           HA       ARG 136  -0.781  -9.754   3.734
 1015    HE   ARG 136           HE       ARG 136  -3.187 -12.208  -0.056
 1016    HB2  ARG 136           HB2      ARG 136  -2.343 -10.442   1.722
 1017    HB3  ARG 136           HB1      ARG 136  -1.510  -8.891   1.729
 1018    HG2  ARG 136           HG2      ARG 136  -0.260  -9.416  -0.041
 1019    HG3  ARG 136           HG1      ARG 136   0.039 -11.056   0.533
 1020    HD2  ARG 136           HD2      ARG 136  -2.542 -10.150  -0.742
 1021    HD3  ARG 136           HD1      ARG 136  -1.219 -10.913  -1.621
 1022   HH11  ARG 136          HH11      ARG 136   0.250 -12.394  -0.786
 1023   HH12  ARG 136          HH12      ARG 136   0.342 -14.104  -0.519
 1024   HH21  ARG 136          HH21      ARG 136  -3.053 -14.479   0.266
 1025   HH22  ARG 136          HH22      ARG 136  -1.545 -15.293   0.043
 1026    H    ARG 137           HN       ARG 137  -0.810 -11.389   5.230
 1027    HA   ARG 137           HA       ARG 137  -2.185 -13.775   4.543
 1028    HE   ARG 137           HE       ARG 137   1.980 -14.927   7.108
 1029    HB2  ARG 137           HB2      ARG 137  -0.241 -15.251   5.478
 1030    HB3  ARG 137           HB1      ARG 137  -0.268 -14.809   3.779
 1031    HG2  ARG 137           HG2      ARG 137   1.442 -13.223   4.049
 1032    HG3  ARG 137           HG1      ARG 137   1.269 -13.221   5.805
 1033    HD2  ARG 137           HD2      ARG 137   2.047 -15.703   4.326
 1034    HD3  ARG 137           HD1      ARG 137   3.248 -14.486   4.762
 1035   HH11  ARG 137          HH11      ARG 137   3.390 -17.128   4.777
 1036   HH12  ARG 137          HH12      ARG 137   3.764 -18.341   5.970
 1037   HH21  ARG 137          HH21      ARG 137   2.466 -16.510   8.681
 1038   HH22  ARG 137          HH22      ARG 137   3.240 -17.987   8.173
 1039    H    HIS 138           HN       HIS 138  -3.146 -14.626   6.289
 1040    HA   HIS 138           HA       HIS 138  -2.701 -13.233   8.808
 1041    HD1  HIS 138           HD1      HIS 138  -5.708 -12.227  10.032
 1042    HD2  HIS 138           HD2      HIS 138  -5.360 -12.856   5.930
 1043    HE1  HIS 138           HE1      HIS 138  -6.848 -10.268   8.942
 1044    HE2  HIS 138           HE2      HIS 138  -6.742 -10.728   6.473
 1045    HB2  HIS 138           HB2      HIS 138  -4.898 -15.020   7.775
 1046    HB3  HIS 138           HB1      HIS 138  -4.815 -14.528   9.463
 1047    H    GLU 139           HN       GLU 139  -0.947 -14.104   9.678
 1048    HA   GLU 139           HA       GLU 139  -0.949 -16.161  11.412
 1049    HB2  GLU 139           HB2      GLU 139  -0.215 -17.171   8.697
 1050    HB3  GLU 139           HB1      GLU 139   0.759 -17.709  10.053
 1051    HG2  GLU 139           HG2      GLU 139  -2.171 -18.162   9.582
 1052    HG3  GLU 139           HG1      GLU 139  -0.883 -19.359   9.695
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1 -14.099  11.090  42.458
    2    H2   GLY   1           HT2      GLY   1 -13.405  10.855  40.932
    3    H3   GLY   1           HT3      GLY   1 -12.747  12.002  41.994
    4    HA2  GLY   1           HA1      GLY   1 -12.160  10.217  43.546
    5    HA3  GLY   1           HA2      GLY   1 -12.771   9.061  42.371
    6    HA   PRO   2           HA       PRO   2  -8.196  10.415  41.625
    7    HB2  PRO   2           HB2      PRO   2  -7.524   7.861  42.946
    8    HB3  PRO   2           HB1      PRO   2  -6.768   9.447  43.118
    9    HG2  PRO   2           HG2      PRO   2  -8.285   8.420  45.062
   10    HG3  PRO   2           HG1      PRO   2  -8.305  10.153  44.693
   11    HD2  PRO   2           HD2      PRO   2 -10.290   8.037  43.941
   12    HD3  PRO   2           HD1      PRO   2 -10.571   9.700  44.501
   13    H    LEU   3           HN       LEU   3  -7.484   9.827  39.682
   14    HA   LEU   3           HA       LEU   3  -8.677   7.644  38.288
   15    HG   LEU   3           HG       LEU   3  -9.340   9.511  36.823
   16    HB2  LEU   3           HB2      LEU   3  -6.410   9.477  37.509
   17    HB3  LEU   3           HB1      LEU   3  -7.103   8.270  36.446
   18   HD11  LEU   3          HD11      LEU   3  -9.151  11.871  37.352
   19   HD12  LEU   3          HD12      LEU   3  -7.419  11.692  37.628
   20   HD13  LEU   3          HD13      LEU   3  -8.568  10.894  38.702
   21   HD21  LEU   3          HD21      LEU   3  -8.097   9.470  34.715
   22   HD22  LEU   3          HD22      LEU   3  -7.118  10.830  35.268
   23   HD23  LEU   3          HD23      LEU   3  -8.847  11.041  34.999
   24    H    GLY   4           HN       GLY   4  -7.678   5.759  37.511
   25    HA2  GLY   4           HA2      GLY   4  -5.704   4.294  37.531
   26    HA3  GLY   4           HA1      GLY   4  -5.315   4.976  39.105
   27    H    SER   5           HN       SER   5  -8.444   4.838  39.403
   28    HA   SER   5           HA       SER   5  -8.507   2.193  40.580
   29    HG   SER   5           HG       SER   5  -8.445   4.350  41.775
   30    HB2  SER   5           HB2      SER   5 -10.676   4.310  40.427
   31    HB3  SER   5           HB1      SER   5 -10.707   2.861  41.435
   32    H    GLU   6           HN       GLU   6 -10.162   0.625  40.000
   33    HA   GLU   6           HA       GLU   6 -10.154   0.254  37.194
   34    HB2  GLU   6           HB2      GLU   6 -11.659  -1.299  39.298
   35    HB3  GLU   6           HB1      GLU   6 -11.398  -1.811  37.636
   36    HG2  GLU   6           HG2      GLU   6  -9.426  -1.593  39.873
   37    HG3  GLU   6           HG1      GLU   6  -9.800  -2.979  38.853
   38    H    SER   7           HN       SER   7 -11.527   0.803  35.700
   39    HA   SER   7           HA       SER   7 -13.947   2.221  36.371
   40    HG   SER   7           HG       SER   7 -11.836   3.083  35.395
   41    HB2  SER   7           HB2      SER   7 -12.972   1.400  33.629
   42    HB3  SER   7           HB1      SER   7 -14.086   2.708  34.026
   43    H    LEU   8           HN       LEU   8 -16.007   1.471  36.225
   44    HA   LEU   8           HA       LEU   8 -16.260  -1.411  35.754
   45    HG   LEU   8           HG       LEU   8 -16.072   0.114  38.539
   46    HB2  LEU   8           HB2      LEU   8 -18.101   0.464  37.240
   47    HB3  LEU   8           HB1      LEU   8 -18.320  -1.271  37.076
   48   HD11  LEU   8          HD11      LEU   8 -17.039  -0.896  40.519
   49   HD12  LEU   8          HD12      LEU   8 -18.331  -1.604  39.552
   50   HD13  LEU   8          HD13      LEU   8 -18.215   0.149  39.722
   51   HD21  LEU   8          HD21      LEU   8 -15.350  -2.114  39.193
   52   HD22  LEU   8          HD22      LEU   8 -15.294  -1.928  37.439
   53   HD23  LEU   8          HD23      LEU   8 -16.611  -2.833  38.186
   54    H    MET   9           HN       MET   9 -18.308  -2.174  34.835
   55    HA   MET   9           HA       MET   9 -19.106  -0.451  32.589
   56    HB2  MET   9           HB2      MET   9 -19.309  -3.457  32.853
   57    HB3  MET   9           HB1      MET   9 -19.744  -2.518  31.437
   58    HG2  MET   9           HG2      MET   9 -17.428  -1.849  31.149
   59    HG3  MET   9           HG1      MET   9 -16.977  -2.755  32.591
   60    HE1  MET   9           HE1      MET   9 -15.510  -3.132  29.833
   61    HE2  MET   9           HE2      MET   9 -15.400  -4.889  29.728
   62    HE3  MET   9           HE3      MET   9 -15.114  -4.078  31.268
   63    HA   PRO  10           HA       PRO  10 -23.195  -0.118  34.260
   64    HB2  PRO  10           HB2      PRO  10 -24.630  -0.027  31.906
   65    HB3  PRO  10           HB1      PRO  10 -23.791   1.354  32.620
   66    HG2  PRO  10           HG2      PRO  10 -22.922  -0.462  30.418
   67    HG3  PRO  10           HG1      PRO  10 -22.735   1.297  30.566
   68    HD2  PRO  10           HD2      PRO  10 -20.692  -0.396  31.048
   69    HD3  PRO  10           HD1      PRO  10 -20.898   1.107  31.968
   70    H    SER  11           HN       SER  11 -22.673  -2.455  31.645
   71    HA   SER  11           HA       SER  11 -24.854  -4.117  32.582
   72    HG   SER  11           HG       SER  11 -24.686  -2.881  30.390
   73    HB2  SER  11           HB2      SER  11 -22.796  -4.656  30.426
   74    HB3  SER  11           HB1      SER  11 -24.273  -5.576  30.709
   75    H    GLN  12           HN       GLN  12 -24.167  -4.654  34.670
   76    HA   GLN  12           HA       GLN  12 -21.712  -6.220  34.905
   77    HB2  GLN  12           HB2      GLN  12 -22.109  -4.508  36.606
   78    HB3  GLN  12           HB1      GLN  12 -23.652  -5.242  37.014
   79    HG2  GLN  12           HG2      GLN  12 -22.556  -7.199  37.874
   80    HG3  GLN  12           HG1      GLN  12 -20.987  -6.602  37.335
   81   HE21  GLN  12          HE21      GLN  12 -19.985  -4.954  38.488
   82   HE22  GLN  12          HE22      GLN  12 -20.507  -4.475  40.063
   83    H    VAL  13           HN       VAL  13 -22.178  -8.130  33.937
   84    HA   VAL  13           HA       VAL  13 -24.459  -9.641  34.994
   85    HB   VAL  13           HB       VAL  13 -24.262 -11.036  32.919
   86   HG11  VAL  13          HG11      VAL  13 -25.969  -9.321  33.133
   87   HG12  VAL  13          HG12      VAL  13 -25.386  -9.423  31.473
   88   HG13  VAL  13          HG13      VAL  13 -24.851  -8.105  32.515
   89   HG21  VAL  13          HG21      VAL  13 -21.959 -10.471  32.335
   90   HG22  VAL  13          HG22      VAL  13 -22.444  -8.807  32.004
   91   HG23  VAL  13          HG23      VAL  13 -23.062 -10.124  31.005
   92    H    VAL  14           HN       VAL  14 -24.106 -11.432  36.100
   93    HA   VAL  14           HA       VAL  14 -21.419 -12.638  35.984
   94    HB   VAL  14           HB       VAL  14 -21.662 -11.617  38.155
   95   HG11  VAL  14          HG11      VAL  14 -24.072 -11.411  38.272
   96   HG12  VAL  14          HG12      VAL  14 -23.459 -12.222  39.713
   97   HG13  VAL  14          HG13      VAL  14 -24.236 -13.158  38.435
   98   HG21  VAL  14          HG21      VAL  14 -22.045 -14.605  38.324
   99   HG22  VAL  14          HG22      VAL  14 -21.434 -13.581  39.622
  100   HG23  VAL  14          HG23      VAL  14 -20.515 -13.747  38.125
  101    H    LYS  15           HN       LYS  15 -21.354 -14.668  35.322
  102    HA   LYS  15           HA       LYS  15 -23.864 -16.199  35.284
  103    HB2  LYS  15           HB2      LYS  15 -21.507 -16.342  33.399
  104    HB3  LYS  15           HB1      LYS  15 -22.879 -17.433  33.351
  105    HG2  LYS  15           HG2      LYS  15 -23.041 -14.452  32.966
  106    HG3  LYS  15           HG1      LYS  15 -22.989 -15.640  31.661
  107    HD2  LYS  15           HD2      LYS  15 -25.115 -15.458  33.799
  108    HD3  LYS  15           HD1      LYS  15 -25.282 -14.891  32.134
  109    HE2  LYS  15           HE2      LYS  15 -24.813 -17.740  33.014
  110    HE3  LYS  15           HE1      LYS  15 -26.337 -17.071  32.435
  111    HZ1  LYS  15           HZ1      LYS  15 -23.834 -17.368  30.875
  112    HZ2  LYS  15           HZ2      LYS  15 -25.230 -16.602  30.302
  113    HZ3  LYS  15           HZ3      LYS  15 -25.259 -18.259  30.671
  114    H    GLY  16           HN       GLY  16 -23.809 -17.514  36.990
  115    HA2  GLY  16           HA2      GLY  16 -21.441 -18.604  38.108
  116    HA3  GLY  16           HA1      GLY  16 -23.086 -19.107  38.473
  117    H    GLY  17           HN       GLY  17 -20.250 -20.272  37.444
  118    HA2  GLY  17           HA2      GLY  17 -19.863 -22.454  36.693
  119    HA3  GLY  17           HA1      GLY  17 -21.540 -22.553  36.186
  120    H    ALA  18           HN       ALA  18 -19.699 -19.796  35.227
  121    HA   ALA  18           HA       ALA  18 -19.493 -20.921  32.513
  122    HB1  ALA  18           HB1      ALA  18 -19.809 -18.023  33.286
  123    HB2  ALA  18           HB2      ALA  18 -21.103 -19.064  32.690
  124    HB3  ALA  18           HB3      ALA  18 -19.736 -18.665  31.647
  125    H    PHE  19           HN       PHE  19 -17.541 -20.946  31.568
  126    HA   PHE  19           HA       PHE  19 -15.253 -20.155  33.122
  127    HD1  PHE  19           HD1      PHE  19 -17.313 -22.581  30.695
  128    HD2  PHE  19           HD2      PHE  19 -13.921 -20.674  28.965
  129    HE1  PHE  19           HE1      PHE  19 -18.215 -23.015  28.445
  130    HE2  PHE  19           HE2      PHE  19 -14.815 -21.109  26.722
  131    HZ   PHE  19           HZ       PHE  19 -16.964 -22.278  26.450
  132    HB2  PHE  19           HB2      PHE  19 -13.939 -21.118  31.230
  133    HB3  PHE  19           HB1      PHE  19 -15.097 -22.238  31.931
  134    H    ASP  20           HN       ASP  20 -14.370 -18.245  33.095
  135    HA   ASP  20           HA       ASP  20 -14.374 -16.661  30.643
  136    HB2  ASP  20           HB2      ASP  20 -16.392 -15.924  31.813
  137    HB3  ASP  20           HB1      ASP  20 -15.462 -15.650  33.284
  138    H    GLY  21           HN       GLY  21 -12.528 -15.548  30.366
  139    HA2  GLY  21           HA2      GLY  21 -10.802 -15.153  32.723
  140    HA3  GLY  21           HA1      GLY  21 -10.148 -15.860  31.251
  141    H    THR  22           HN       THR  22 -11.952 -13.007  32.359
  142    HA   THR  22           HA       THR  22 -10.673 -11.456  30.219
  143    HB   THR  22           HB       THR  22 -12.504  -9.774  30.734
  144    HG1  THR  22           HG1      THR  22 -13.873 -11.960  31.927
  145   HG21  THR  22          HG21      THR  22 -14.191 -10.988  29.441
  146   HG22  THR  22          HG22      THR  22 -13.352 -12.504  29.768
  147   HG23  THR  22          HG23      THR  22 -12.576 -11.261  28.788
  148    H    MET  23           HN       MET  23  -9.633  -9.529  30.667
  149    HA   MET  23           HA       MET  23  -9.492  -8.571  33.404
  150    HB2  MET  23           HB2      MET  23  -7.035  -8.554  33.447
  151    HB3  MET  23           HB1      MET  23  -7.655 -10.194  33.312
  152    HG2  MET  23           HG2      MET  23  -7.172 -10.185  30.918
  153    HG3  MET  23           HG1      MET  23  -6.553  -8.540  31.047
  154    HE1  MET  23           HE1      MET  23  -6.117 -11.570  33.537
  155    HE2  MET  23           HE2      MET  23  -4.581 -12.236  32.985
  156    HE3  MET  23           HE3      MET  23  -5.999 -12.312  31.941
  157    H    ASN  24           HN       ASN  24  -9.088  -6.391  33.519
  158    HA   ASN  24           HA       ASN  24  -9.172  -5.010  30.934
  159    HB2  ASN  24           HB2      ASN  24  -9.967  -4.066  33.696
  160    HB3  ASN  24           HB1      ASN  24 -10.044  -3.082  32.238
  161   HD21  ASN  24          HD21      ASN  24 -12.180  -3.958  34.063
  162   HD22  ASN  24          HD22      ASN  24 -13.327  -4.779  33.069
  163    H    GLY  25           HN       GLY  25  -7.832  -3.272  30.471
  164    HA2  GLY  25           HA2      GLY  25  -6.250  -1.598  31.379
  165    HA3  GLY  25           HA1      GLY  25  -5.563  -2.905  32.320
  166    HA   PRO  26           HA       PRO  26  -2.968  -4.302  28.829
  167    HB2  PRO  26           HB2      PRO  26  -4.428  -5.895  27.055
  168    HB3  PRO  26           HB1      PRO  26  -3.476  -6.477  28.425
  169    HG2  PRO  26           HG2      PRO  26  -6.407  -5.961  28.228
  170    HG3  PRO  26           HG1      PRO  26  -5.550  -7.256  29.086
  171    HD2  PRO  26           HD2      PRO  26  -6.577  -5.194  30.417
  172    HD3  PRO  26           HD1      PRO  26  -4.998  -5.867  30.879
  173    H    PHE  27           HN       PHE  27  -6.232  -3.644  27.616
  174    HA   PHE  27           HA       PHE  27  -5.044  -1.801  25.661
  175    HD1  PHE  27           HD2      PHE  27  -6.537  -5.652  25.708
  176    HD2  PHE  27           HD1      PHE  27  -9.189  -2.434  24.870
  177    HE1  PHE  27           HE2      PHE  27  -8.447  -7.063  26.356
  178    HE2  PHE  27           HE1      PHE  27 -11.101  -3.834  25.521
  179    HZ   PHE  27           HZ       PHE  27 -10.730  -6.156  26.266
  180    HB2  PHE  27           HB2      PHE  27  -6.902  -2.389  24.101
  181    HB3  PHE  27           HB1      PHE  27  -5.808  -3.730  24.417
  182    H    GLY  28           HN       GLY  28  -6.554  -0.069  24.981
  183    HA2  GLY  28           HA2      GLY  28  -7.891   1.063  27.263
  184    HA3  GLY  28           HA1      GLY  28  -7.781   1.767  25.656
  185    H    HIS  29           HN       HIS  29 -10.126   1.724  27.324
  186    HA   HIS  29           HA       HIS  29 -11.807  -0.388  26.321
  187    HD1  HIS  29           HD1      HIS  29 -13.183   3.452  26.614
  188    HD2  HIS  29           HD2      HIS  29 -11.907   2.269  30.385
  189    HE1  HIS  29           HE1      HIS  29 -13.057   5.559  27.977
  190    HE2  HIS  29           HE2      HIS  29 -12.586   4.760  30.315
  191    HB2  HIS  29           HB2      HIS  29 -13.635   0.710  27.600
  192    HB3  HIS  29           HB1      HIS  29 -12.238   0.308  28.580
  193    H    GLY  30           HN       GLY  30 -12.977  -0.386  24.548
  194    HA2  GLY  30           HA2      GLY  30 -13.408   2.165  23.147
  195    HA3  GLY  30           HA1      GLY  30 -13.463   0.573  22.404
  196    H    TYR  31           HN       TYR  31 -15.519   1.803  21.644
  197    HA   TYR  31           HA       TYR  31 -17.682   1.182  23.546
  198    HD1  TYR  31           HD1      TYR  31 -18.861   3.019  24.759
  199    HD2  TYR  31           HD2      TYR  31 -16.452   5.010  21.870
  200    HE1  TYR  31           HE1      TYR  31 -18.342   4.763  26.411
  201    HE2  TYR  31           HE2      TYR  31 -15.921   6.761  23.514
  202    HH   TYR  31           HH       TYR  31 -16.508   6.447  26.809
  203    HB2  TYR  31           HB2      TYR  31 -17.628   3.136  21.236
  204    HB3  TYR  31           HB1      TYR  31 -19.080   2.718  22.139
  205    H    GLY  32           HN       GLY  32 -19.767   0.508  22.419
  206    HA2  GLY  32           HA2      GLY  32 -19.238  -1.767  20.772
  207    HA3  GLY  32           HA1      GLY  32 -20.824  -1.175  21.249
  208    H    GLU  33           HN       GLU  33 -18.383  -1.172  18.826
  209    HA   GLU  33           HA       GLU  33 -20.163   0.353  17.039
  210    HB2  GLU  33           HB2      GLU  33 -17.155   0.571  17.265
  211    HB3  GLU  33           HB1      GLU  33 -18.093   1.267  15.954
  212    HG2  GLU  33           HG2      GLU  33 -19.177   2.779  17.448
  213    HG3  GLU  33           HG1      GLU  33 -18.475   1.974  18.851
  214    H    GLY  34           HN       GLY  34 -20.068  -0.254  14.836
  215    HA2  GLY  34           HA2      GLY  34 -19.211  -2.958  14.325
  216    HA3  GLY  34           HA1      GLY  34 -19.965  -1.862  13.170
  217    H    ALA  35           HN       ALA  35 -17.032  -3.153  14.367
  218    HA   ALA  35           HA       ALA  35 -15.354  -1.148  13.124
  219    HB1  ALA  35           HB1      ALA  35 -14.683  -2.132  15.250
  220    HB2  ALA  35           HB2      ALA  35 -13.495  -2.464  13.991
  221    HB3  ALA  35           HB3      ALA  35 -14.620  -3.727  14.498
  222    H    GLY  36           HN       GLY  36 -13.625  -1.787  11.619
  223    HA2  GLY  36           HA2      GLY  36 -14.646  -3.768   9.701
  224    HA3  GLY  36           HA1      GLY  36 -13.765  -2.313   9.242
  225    H    GLU  37           HN       GLU  37 -13.569  -5.545  10.233
  226    HA   GLU  37           HA       GLU  37 -10.791  -5.581  10.918
  227    HB2  GLU  37           HB2      GLU  37 -12.846  -7.691  10.335
  228    HB3  GLU  37           HB1      GLU  37 -11.168  -8.099  10.670
  229    HG2  GLU  37           HG2      GLU  37 -11.421  -6.875  12.848
  230    HG3  GLU  37           HG1      GLU  37 -13.143  -6.750  12.491
  231    H    GLY  38           HN       GLY  38  -9.632  -7.580   9.611
  232    HA2  GLY  38           HA2      GLY  38  -9.190  -6.494   6.987
  233    HA3  GLY  38           HA1      GLY  38  -8.349  -7.873   7.687
  234    H    ILE  39           HN       ILE  39 -11.386  -6.813   6.414
  235    HA   ILE  39           HA       ILE  39 -12.547  -9.332   5.954
  236    HB   ILE  39           HB       ILE  39 -13.099  -6.923   4.226
  237   HG12  ILE  39          HG12      ILE  39 -14.228  -7.385   6.987
  238   HG13  ILE  39          HG11      ILE  39 -12.978  -6.209   6.632
  239   HG21  ILE  39          HG21      ILE  39 -14.833  -9.099   5.378
  240   HG22  ILE  39          HG22      ILE  39 -14.231  -9.023   3.723
  241   HG23  ILE  39          HG23      ILE  39 -15.378  -7.812   4.297
  242   HD11  ILE  39          HD11      ILE  39 -15.745  -6.193   5.471
  243   HD12  ILE  39          HD12      ILE  39 -14.472  -5.005   5.177
  244   HD13  ILE  39          HD13      ILE  39 -15.163  -5.175   6.790
  245    H    ASP  40           HN       ASP  40 -12.770 -10.433   3.855
  246    HA   ASP  40           HA       ASP  40 -10.333 -10.395   2.351
  247    HB2  ASP  40           HB2      ASP  40 -12.941 -11.868   2.012
  248    HB3  ASP  40           HB1      ASP  40 -11.674 -11.954   0.791
  249    H    ASP  41           HN       ASP  41 -10.687  -8.030   2.103
  250    HA   ASP  41           HA       ASP  41 -11.499  -7.660  -0.697
  251    HB2  ASP  41           HB2      ASP  41 -13.335  -6.676   0.588
  252    HB3  ASP  41           HB1      ASP  41 -12.193  -5.757   1.567
  253    H    VAL  42           HN       VAL  42  -9.543  -7.368  -1.589
  254    HA   VAL  42           HA       VAL  42  -7.736  -5.494  -0.219
  255    HB   VAL  42           HB       VAL  42  -6.897  -7.783  -2.012
  256   HG11  VAL  42          HG11      VAL  42  -5.270  -5.872  -0.343
  257   HG12  VAL  42          HG12      VAL  42  -5.372  -5.892  -2.104
  258   HG13  VAL  42          HG13      VAL  42  -4.634  -7.246  -1.249
  259   HG21  VAL  42          HG21      VAL  42  -7.755  -8.640   0.092
  260   HG22  VAL  42          HG22      VAL  42  -6.729  -7.518   0.988
  261   HG23  VAL  42          HG23      VAL  42  -6.000  -8.807   0.034
  262    H    GLU  43           HN       GLU  43  -8.557  -3.719  -1.301
  263    HA   GLU  43           HA       GLU  43  -7.680  -3.578  -4.105
  264    HB2  GLU  43           HB2      GLU  43 -10.092  -3.263  -3.963
  265    HB3  GLU  43           HB1      GLU  43  -9.882  -2.008  -2.745
  266    HG2  GLU  43           HG2      GLU  43  -8.718  -0.619  -4.394
  267    HG3  GLU  43           HG1      GLU  43  -8.936  -1.888  -5.602
  268    H    TRP  44           HN       TRP  44  -5.604  -3.034  -3.559
  269    HA   TRP  44           HA       TRP  44  -5.201  -0.594  -2.016
  270    HD1  TRP  44           HD1      TRP  44  -3.384   0.929  -1.826
  271    HE1  TRP  44           HE1      TRP  44  -1.064   1.722  -1.047
  272    HE3  TRP  44           HE3      TRP  44  -1.033  -3.533  -1.660
  273    HZ2  TRP  44           HZ2      TRP  44   1.446   0.563  -0.438
  274    HZ3  TRP  44           HZ3      TRP  44   1.317  -3.624  -1.013
  275    HH2  TRP  44           HH2      TRP  44   2.537  -1.613  -0.380
  276    HB2  TRP  44           HB2      TRP  44  -3.829  -2.597  -1.485
  277    HB3  TRP  44           HB1      TRP  44  -3.164  -2.533  -3.122
  278    H    VAL  45           HN       VAL  45  -4.434   1.190  -2.844
  279    HA   VAL  45           HA       VAL  45  -4.812   1.742  -5.601
  280    HB   VAL  45           HB       VAL  45  -3.439   3.513  -3.596
  281   HG11  VAL  45          HG11      VAL  45  -4.520   5.325  -4.845
  282   HG12  VAL  45          HG12      VAL  45  -5.255   4.137  -5.923
  283   HG13  VAL  45          HG13      VAL  45  -3.503   4.333  -5.891
  284   HG21  VAL  45          HG21      VAL  45  -5.748   4.348  -3.007
  285   HG22  VAL  45          HG22      VAL  45  -5.358   2.734  -2.410
  286   HG23  VAL  45          HG23      VAL  45  -6.390   2.925  -3.828
  287    H    VAL  46           HN       VAL  46  -2.262   0.222  -4.120
  288    HA   VAL  46           HA       VAL  46  -0.214   1.438  -5.779
  289    HB   VAL  46           HB       VAL  46  -0.175  -0.551  -3.538
  290   HG11  VAL  46          HG11      VAL  46   2.048  -0.396  -5.573
  291   HG12  VAL  46          HG12      VAL  46   1.012  -1.792  -5.278
  292   HG13  VAL  46          HG13      VAL  46   2.111  -1.234  -4.019
  293   HG21  VAL  46          HG21      VAL  46   1.717   0.857  -2.866
  294   HG22  VAL  46          HG22      VAL  46   0.258   1.802  -3.164
  295   HG23  VAL  46          HG23      VAL  46   1.553   1.778  -4.360
  296    H    GLY  47           HN       GLY  47  -2.484  -1.082  -6.033
  297    HA2  GLY  47           HA2      GLY  47  -1.104  -2.827  -7.780
  298    HA3  GLY  47           HA1      GLY  47  -2.857  -2.655  -7.668
  299    H    LYS  48           HN       LYS  48  -2.266   0.344  -8.230
  300    HA   LYS  48           HA       LYS  48  -2.401   0.058 -11.134
  301    HB2  LYS  48           HB2      LYS  48  -3.213   2.463 -10.993
  302    HB3  LYS  48           HB1      LYS  48  -4.281   1.232 -10.350
  303    HG2  LYS  48           HG2      LYS  48  -3.600   1.802  -8.102
  304    HG3  LYS  48           HG1      LYS  48  -2.448   2.981  -8.733
  305    HD2  LYS  48           HD2      LYS  48  -5.423   3.095  -9.215
  306    HD3  LYS  48           HD1      LYS  48  -4.606   3.953  -7.914
  307    HE2  LYS  48           HE2      LYS  48  -3.912   4.293 -10.821
  308    HE3  LYS  48           HE1      LYS  48  -5.077   5.307  -9.977
  309    HZ1  LYS  48           HZ1      LYS  48  -3.000   6.420  -9.956
  310    HZ2  LYS  48           HZ2      LYS  48  -2.168   5.054  -9.413
  311    HZ3  LYS  48           HZ3      LYS  48  -3.253   5.851  -8.385
  312    H    ASP  49           HN       ASP  49  -0.414   1.414  -8.627
  313    HA   ASP  49           HA       ASP  49   1.061   2.990 -10.619
  314    HB2  ASP  49           HB2      ASP  49   1.031   3.287  -7.607
  315    HB3  ASP  49           HB1      ASP  49   1.893   4.326  -8.738
  316    H    LYS  50           HN       LYS  50   1.206   0.090  -9.171
  317    HA   LYS  50           HA       LYS  50   3.707  -0.270  -8.107
  318    HB2  LYS  50           HB2      LYS  50   1.876  -1.958  -8.211
  319    HB3  LYS  50           HB1      LYS  50   2.266  -2.218  -9.904
  320    HG2  LYS  50           HG2      LYS  50   4.556  -2.910  -9.197
  321    HG3  LYS  50           HG1      LYS  50   4.011  -2.804  -7.524
  322    HD2  LYS  50           HD2      LYS  50   2.352  -4.498  -7.890
  323    HD3  LYS  50           HD1      LYS  50   2.696  -4.524  -9.618
  324    HE2  LYS  50           HE2      LYS  50   3.771  -6.420  -8.688
  325    HE3  LYS  50           HE1      LYS  50   5.037  -5.248  -9.029
  326    HZ1  LYS  50           HZ1      LYS  50   4.922  -4.602  -6.654
  327    HZ2  LYS  50           HZ2      LYS  50   5.427  -6.195  -6.899
  328    HZ3  LYS  50           HZ3      LYS  50   3.845  -5.882  -6.379
  329    HA   PRO  51           HA       PRO  51   5.481  -1.131 -12.584
  330    HB2  PRO  51           HB2      PRO  51   4.232   0.301 -14.574
  331    HB3  PRO  51           HB1      PRO  51   3.914  -1.408 -14.224
  332    HG2  PRO  51           HG2      PRO  51   2.374   1.020 -13.390
  333    HG3  PRO  51           HG1      PRO  51   1.776  -0.552 -13.959
  334    HD2  PRO  51           HD2      PRO  51   1.784   0.101 -11.349
  335    HD3  PRO  51           HD1      PRO  51   2.099  -1.562 -11.898
  336    H    THR  52           HN       THR  52   4.001   1.914 -11.659
  337    HA   THR  52           HA       THR  52   6.017   3.570 -12.825
  338    HB   THR  52           HB       THR  52   3.947   4.172 -10.704
  339    HG1  THR  52           HG1      THR  52   3.988   4.236 -13.526
  340   HG21  THR  52          HG21      THR  52   4.318   6.533 -11.269
  341   HG22  THR  52          HG22      THR  52   5.624   6.063 -12.359
  342   HG23  THR  52          HG23      THR  52   5.781   5.788 -10.624
  343    H    TYR  53           HN       TYR  53   5.389   2.196  -9.658
  344    HA   TYR  53           HA       TYR  53   7.605   3.476  -8.385
  345    HD1  TYR  53           HD2      TYR  53   6.408   4.664  -7.099
  346    HD2  TYR  53           HD1      TYR  53   4.000   1.196  -6.605
  347    HE1  TYR  53           HE2      TYR  53   4.550   6.070  -6.318
  348    HE2  TYR  53           HE1      TYR  53   2.130   2.594  -5.844
  349    HH   TYR  53           HH       TYR  53   2.051   5.923  -6.214
  350    HB2  TYR  53           HB2      TYR  53   6.074   0.989  -7.643
  351    HB3  TYR  53           HB1      TYR  53   7.183   1.838  -6.576
  352    H    ASP  54           HN       ASP  54   7.126   0.631 -10.281
  353    HA   ASP  54           HA       ASP  54   9.631  -0.632  -9.559
  354    HB2  ASP  54           HB2      ASP  54   7.747  -1.999 -10.236
  355    HB3  ASP  54           HB1      ASP  54   7.625  -1.169 -11.779
  356    H    GLU  55           HN       GLU  55   8.479   1.492 -12.156
  357    HA   GLU  55           HA       GLU  55  10.863   1.290 -13.706
  358    HB2  GLU  55           HB2      GLU  55  10.049   3.176 -14.953
  359    HB3  GLU  55           HB1      GLU  55   8.712   2.091 -14.630
  360    HG2  GLU  55           HG2      GLU  55   7.968   3.545 -12.811
  361    HG3  GLU  55           HG1      GLU  55   9.307   4.650 -13.174
  362    H    ILE  56           HN       ILE  56   9.755   3.589 -11.246
  363    HA   ILE  56           HA       ILE  56  12.102   5.165 -11.235
  364    HB   ILE  56           HB       ILE  56  10.213   4.568  -8.942
  365   HG12  ILE  56          HG12      ILE  56  10.253   6.944 -10.817
  366   HG13  ILE  56          HG11      ILE  56   9.195   5.543 -11.036
  367   HG21  ILE  56          HG21      ILE  56  12.184   6.820  -9.309
  368   HG22  ILE  56          HG22      ILE  56  12.335   5.485  -8.166
  369   HG23  ILE  56          HG23      ILE  56  11.035   6.663  -7.980
  370   HD11  ILE  56          HD11      ILE  56   8.153   6.011  -8.876
  371   HD12  ILE  56          HD12      ILE  56   8.007   7.365  -9.997
  372   HD13  ILE  56          HD13      ILE  56   9.192   7.425  -8.691
  373    H    PHE  57           HN       PHE  57  11.228   2.131  -9.852
  374    HA   PHE  57           HA       PHE  57  13.367   1.717  -8.082
  375    HD1  PHE  57           HD2      PHE  57  14.639  -0.153  -8.074
  376    HD2  PHE  57           HD1      PHE  57  10.936  -2.208  -7.883
  377    HE1  PHE  57           HE2      PHE  57  15.731  -2.017  -6.922
  378    HE2  PHE  57           HE1      PHE  57  12.040  -4.080  -6.745
  379    HZ   PHE  57           HZ       PHE  57  14.283  -4.145  -6.416
  380    HB2  PHE  57           HB2      PHE  57  11.266   0.459  -8.072
  381    HB3  PHE  57           HB1      PHE  57  11.649  -0.218  -9.644
  382    H    TYR  58           HN       TYR  58  12.913   0.430 -11.414
  383    HA   TYR  58           HA       TYR  58  15.524  -0.595 -11.642
  384    HD1  TYR  58           HD1      TYR  58  12.152  -1.640 -12.273
  385    HD2  TYR  58           HD2      TYR  58  15.798  -2.524 -14.265
  386    HE1  TYR  58           HE1      TYR  58  11.660  -4.039 -12.097
  387    HE2  TYR  58           HE2      TYR  58  15.318  -4.927 -14.091
  388    HH   TYR  58           HH       TYR  58  13.986  -6.431 -12.663
  389    HB2  TYR  58           HB2      TYR  58  13.379   0.071 -13.609
  390    HB3  TYR  58           HB1      TYR  58  15.003  -0.292 -14.201
  391    H    THR  59           HN       THR  59  14.256   2.569 -12.008
  392    HA   THR  59           HA       THR  59  16.425   3.742 -13.382
  393    HB   THR  59           HB       THR  59  14.276   4.838 -11.572
  394    HG1  THR  59           HG1      THR  59  13.995   5.714 -14.012
  395   HG21  THR  59          HG21      THR  59  16.254   6.382 -13.243
  396   HG22  THR  59          HG22      THR  59  16.140   6.388 -11.481
  397   HG23  THR  59          HG23      THR  59  14.828   7.054 -12.457
  398    H    LEU  60           HN       LEU  60  15.970   2.747 -10.082
  399    HA   LEU  60           HA       LEU  60  18.447   4.079  -9.265
  400    HG   LEU  60           HG       LEU  60  15.611   4.707  -8.090
  401    HB2  LEU  60           HB2      LEU  60  16.431   2.461  -7.696
  402    HB3  LEU  60           HB1      LEU  60  17.920   3.097  -7.010
  403   HD11  LEU  60          HD11      LEU  60  15.368   5.438  -5.790
  404   HD12  LEU  60          HD12      LEU  60  16.735   4.435  -5.305
  405   HD13  LEU  60          HD13      LEU  60  15.251   3.681  -5.889
  406   HD21  LEU  60          HD21      LEU  60  16.851   6.670  -7.393
  407   HD22  LEU  60          HD22      LEU  60  17.775   5.767  -8.595
  408   HD23  LEU  60          HD23      LEU  60  18.208   5.663  -6.887
  409    H    SER  61           HN       SER  61  17.458   1.247 -10.662
  410    HA   SER  61           HA       SER  61  18.528  -0.625 -11.316
  411    HG   SER  61           HG       SER  61  22.011  -1.103 -11.024
  412    HB2  SER  61           HB2      SER  61  20.525   0.896 -11.522
  413    HB3  SER  61           HB1      SER  61  21.000   0.390  -9.901
  414    HA   PRO  62           HA       PRO  62  17.514  -2.803  -7.425
  415    HB2  PRO  62           HB2      PRO  62  16.714  -5.026  -8.878
  416    HB3  PRO  62           HB1      PRO  62  15.657  -3.735  -8.287
  417    HG2  PRO  62           HG2      PRO  62  16.760  -4.179 -11.014
  418    HG3  PRO  62           HG1      PRO  62  15.221  -3.459 -10.522
  419    HD2  PRO  62           HD2      PRO  62  17.336  -2.008 -11.413
  420    HD3  PRO  62           HD1      PRO  62  16.136  -1.386 -10.262
  421    H    VAL  63           HN       VAL  63  18.294  -4.735  -6.501
  422    HA   VAL  63           HA       VAL  63  20.544  -6.038  -7.888
  423    HB   VAL  63           HB       VAL  63  20.426  -5.294  -4.954
  424   HG11  VAL  63          HG11      VAL  63  22.697  -6.168  -4.816
  425   HG12  VAL  63          HG12      VAL  63  22.612  -6.669  -6.504
  426   HG13  VAL  63          HG13      VAL  63  21.556  -7.423  -5.306
  427   HG21  VAL  63          HG21      VAL  63  22.292  -3.802  -5.420
  428   HG22  VAL  63          HG22      VAL  63  20.881  -3.361  -6.381
  429   HG23  VAL  63          HG23      VAL  63  22.218  -4.230  -7.131
  430    H    ASN  64           HN       ASN  64  19.599  -7.942  -8.390
  431    HA   ASN  64           HA       ASN  64  18.861 -10.069  -8.138
  432    HB2  ASN  64           HB2      ASN  64  19.517  -9.545  -5.235
  433    HB3  ASN  64           HB1      ASN  64  18.935 -11.106  -5.825
  434   HD21  ASN  64          HD21      ASN  64  21.571  -8.917  -5.663
  435   HD22  ASN  64          HD22      ASN  64  22.763  -9.941  -6.385
  436    H    GLY  65           HN       GLY  65  17.032  -7.741  -7.935
  437    HA2  GLY  65           HA2      GLY  65  14.705  -7.944  -8.267
  438    HA3  GLY  65           HA1      GLY  65  14.711  -9.381  -7.260
  439    H    LYS  66           HN       LYS  66  16.396  -6.656  -6.052
  440    HA   LYS  66           HA       LYS  66  14.223  -5.204  -4.963
  441    HB2  LYS  66           HB2      LYS  66  14.410  -5.704  -2.629
  442    HB3  LYS  66           HB1      LYS  66  14.167  -7.226  -3.465
  443    HG2  LYS  66           HG2      LYS  66  16.797  -6.182  -2.448
  444    HG3  LYS  66           HG1      LYS  66  15.803  -7.406  -1.666
  445    HD2  LYS  66           HD2      LYS  66  16.696  -7.792  -4.481
  446    HD3  LYS  66           HD1      LYS  66  17.818  -8.094  -3.167
  447    HE2  LYS  66           HE2      LYS  66  16.708 -10.143  -3.880
  448    HE3  LYS  66           HE1      LYS  66  16.323  -9.735  -2.225
  449    HZ1  LYS  66           HZ1      LYS  66  14.543  -9.158  -4.526
  450    HZ2  LYS  66           HZ2      LYS  66  14.171  -8.978  -2.886
  451    HZ3  LYS  66           HZ3      LYS  66  14.405 -10.526  -3.534
  452    H    ILE  67           HN       ILE  67  15.001  -3.250  -3.931
  453    HA   ILE  67           HA       ILE  67  17.840  -2.801  -4.492
  454    HB   ILE  67           HB       ILE  67  17.184  -0.463  -3.447
  455   HG12  ILE  67          HG12      ILE  67  14.548  -1.510  -4.495
  456   HG13  ILE  67          HG11      ILE  67  14.910  -1.077  -2.829
  457   HG21  ILE  67          HG21      ILE  67  16.489  -1.325  -6.253
  458   HG22  ILE  67          HG22      ILE  67  18.066  -0.784  -5.674
  459   HG23  ILE  67          HG23      ILE  67  16.709   0.342  -5.721
  460   HD11  ILE  67          HD11      ILE  67  14.843   0.792  -5.181
  461   HD12  ILE  67          HD12      ILE  67  15.243   1.246  -3.522
  462   HD13  ILE  67          HD13      ILE  67  13.626   0.653  -3.912
  463    H    THR  68           HN       THR  68  19.377  -2.610  -2.984
  464    HA   THR  68           HA       THR  68  18.957  -3.233  -0.297
  465    HB   THR  68           HB       THR  68  21.202  -2.094   0.061
  466    HG1  THR  68           HG1      THR  68  22.328  -1.489  -1.824
  467   HG21  THR  68          HG21      THR  68  22.432  -3.830  -1.167
  468   HG22  THR  68          HG22      THR  68  20.976  -4.188  -2.097
  469   HG23  THR  68          HG23      THR  68  21.006  -4.480  -0.358
  470    H    GLY  69           HN       GLY  69  18.716  -1.915   1.523
  471    HA2  GLY  69           HA2      GLY  69  16.632  -0.185   1.088
  472    HA3  GLY  69           HA1      GLY  69  17.502  -0.315   2.604
  473    H    ALA  70           HN       ALA  70  20.012   0.687   1.499
  474    HA   ALA  70           HA       ALA  70  19.727   3.379   2.102
  475    HB1  ALA  70           HB1      ALA  70  21.878   2.099   0.433
  476    HB2  ALA  70           HB2      ALA  70  21.855   2.221   2.191
  477    HB3  ALA  70           HB3      ALA  70  21.976   3.681   1.204
  478    H    ASN  71           HN       ASN  71  19.062   1.818  -0.908
  479    HA   ASN  71           HA       ASN  71  19.352   4.186  -2.536
  480    HB2  ASN  71           HB2      ASN  71  17.876   1.650  -3.257
  481    HB3  ASN  71           HB1      ASN  71  18.639   2.805  -4.352
  482   HD21  ASN  71          HD21      ASN  71  18.965  -0.127  -3.809
  483   HD22  ASN  71          HD22      ASN  71  20.653  -0.355  -3.531
  484    H    ALA  72           HN       ALA  72  16.741   2.310  -1.094
  485    HA   ALA  72           HA       ALA  72  14.645   4.014  -2.046
  486    HB1  ALA  72           HB1      ALA  72  13.247   2.780  -0.447
  487    HB2  ALA  72           HB2      ALA  72  14.692   1.994   0.187
  488    HB3  ALA  72           HB3      ALA  72  14.192   1.706  -1.480
  489    H    LYS  73           HN       LYS  73  16.682   3.813   0.772
  490    HA   LYS  73           HA       LYS  73  15.425   5.804   2.333
  491    HB2  LYS  73           HB2      LYS  73  18.350   5.025   2.210
  492    HB3  LYS  73           HB1      LYS  73  17.616   6.029   3.456
  493    HG2  LYS  73           HG2      LYS  73  16.942   3.150   2.878
  494    HG3  LYS  73           HG1      LYS  73  17.923   3.738   4.221
  495    HD2  LYS  73           HD2      LYS  73  15.111   4.684   3.782
  496    HD3  LYS  73           HD1      LYS  73  15.459   3.208   4.685
  497    HE2  LYS  73           HE2      LYS  73  16.543   5.947   5.331
  498    HE3  LYS  73           HE1      LYS  73  15.177   5.168   6.149
  499    HZ1  LYS  73           HZ1      LYS  73  17.189   4.889   7.420
  500    HZ2  LYS  73           HZ2      LYS  73  17.982   4.177   6.101
  501    HZ3  LYS  73           HZ3      LYS  73  16.678   3.381   6.833
  502    H    LYS  74           HN       LYS  74  17.744   5.840  -0.265
  503    HA   LYS  74           HA       LYS  74  18.425   8.544  -0.306
  504    HB2  LYS  74           HB2      LYS  74  19.282   6.528  -1.712
  505    HB3  LYS  74           HB1      LYS  74  17.972   6.939  -2.807
  506    HG2  LYS  74           HG2      LYS  74  20.036   7.938  -3.547
  507    HG3  LYS  74           HG1      LYS  74  18.892   9.191  -3.057
  508    HD2  LYS  74           HD2      LYS  74  21.161   9.612  -2.244
  509    HD3  LYS  74           HD1      LYS  74  20.013   9.435  -0.929
  510    HE2  LYS  74           HE2      LYS  74  22.134   8.255  -0.484
  511    HE3  LYS  74           HE1      LYS  74  20.752   7.166  -0.538
  512    HZ1  LYS  74           HZ1      LYS  74  21.370   6.516  -2.763
  513    HZ2  LYS  74           HZ2      LYS  74  22.672   6.271  -1.719
  514    HZ3  LYS  74           HZ3      LYS  74  22.667   7.603  -2.775
  515    H    GLU  75           HN       GLU  75  15.777   6.803  -1.832
  516    HA   GLU  75           HA       GLU  75  14.531   8.968  -3.114
  517    HB2  GLU  75           HB2      GLU  75  13.452   6.377  -2.054
  518    HB3  GLU  75           HB1      GLU  75  12.393   7.561  -2.798
  519    HG2  GLU  75           HG2      GLU  75  14.686   6.107  -4.077
  520    HG3  GLU  75           HG1      GLU  75  12.963   5.937  -4.409
  521    H    MET  76           HN       MET  76  13.780   7.567   0.066
  522    HA   MET  76           HA       MET  76  11.841   9.569   0.651
  523    HB2  MET  76           HB2      MET  76  12.067   8.592   3.028
  524    HB3  MET  76           HB1      MET  76  11.451   7.558   1.750
  525    HG2  MET  76           HG2      MET  76  13.630   6.527   1.518
  526    HG3  MET  76           HG1      MET  76  14.278   7.583   2.765
  527    HE1  MET  76           HE1      MET  76  10.888   5.491   2.439
  528    HE2  MET  76           HE2      MET  76  11.357   4.074   3.378
  529    HE3  MET  76           HE3      MET  76  12.212   4.463   1.885
  530    H    VAL  77           HN       VAL  77  15.260   9.426   0.937
  531    HA   VAL  77           HA       VAL  77  15.550  11.618   2.758
  532    HB   VAL  77           HB       VAL  77  17.396  10.152   0.923
  533   HG11  VAL  77          HG11      VAL  77  18.062  12.828   2.151
  534   HG12  VAL  77          HG12      VAL  77  17.930  12.475   0.426
  535   HG13  VAL  77          HG13      VAL  77  19.214  11.733   1.383
  536   HG21  VAL  77          HG21      VAL  77  17.559  10.974   3.822
  537   HG22  VAL  77          HG22      VAL  77  18.717   9.945   2.974
  538   HG23  VAL  77          HG23      VAL  77  17.058   9.395   3.219
  539    H    LYS  78           HN       LYS  78  15.605  11.349  -0.815
  540    HA   LYS  78           HA       LYS  78  16.081  14.134  -1.216
  541    HB2  LYS  78           HB2      LYS  78  15.639  13.698  -3.566
  542    HB3  LYS  78           HB1      LYS  78  16.680  12.444  -2.904
  543    HG2  LYS  78           HG2      LYS  78  14.752  10.960  -2.705
  544    HG3  LYS  78           HG1      LYS  78  13.720  12.220  -3.381
  545    HD2  LYS  78           HD2      LYS  78  14.291  10.661  -5.111
  546    HD3  LYS  78           HD1      LYS  78  15.110  12.192  -5.414
  547    HE2  LYS  78           HE2      LYS  78  17.189  11.335  -4.701
  548    HE3  LYS  78           HE1      LYS  78  16.436   9.916  -3.978
  549    HZ1  LYS  78           HZ1      LYS  78  17.545   9.457  -6.105
  550    HZ2  LYS  78           HZ2      LYS  78  16.467  10.491  -6.893
  551    HZ3  LYS  78           HZ3      LYS  78  15.896   9.080  -6.136
  552    H    SER  79           HN       SER  79  13.304  12.302  -0.460
  553    HA   SER  79           HA       SER  79  11.312  14.106  -1.293
  554    HG   SER  79           HG       SER  79   9.701  14.141   0.773
  555    HB2  SER  79           HB2      SER  79  10.731  11.871  -0.498
  556    HB3  SER  79           HB1      SER  79  11.333  12.271   1.115
  557    H    LYS  80           HN       LYS  80  13.832  14.512   0.833
  558    HA   LYS  80           HA       LYS  80  14.555  16.250   2.067
  559    HB2  LYS  80           HB2      LYS  80  12.014  17.638   1.188
  560    HB3  LYS  80           HB1      LYS  80  13.418  18.408   1.920
  561    HG2  LYS  80           HG2      LYS  80  14.766  17.926   0.008
  562    HG3  LYS  80           HG1      LYS  80  13.495  16.921  -0.695
  563    HD2  LYS  80           HD2      LYS  80  12.038  18.919  -0.815
  564    HD3  LYS  80           HD1      LYS  80  13.378  19.901  -0.218
  565    HE2  LYS  80           HE2      LYS  80  14.707  19.290  -2.165
  566    HE3  LYS  80           HE1      LYS  80  13.391  18.276  -2.759
  567    HZ1  LYS  80           HZ1      LYS  80  11.994  20.256  -2.905
  568    HZ2  LYS  80           HZ2      LYS  80  13.386  20.418  -3.861
  569    HZ3  LYS  80           HZ3      LYS  80  13.280  21.220  -2.375
  570    H    LEU  81           HN       LEU  81  14.015  14.587   3.734
  571    HA   LEU  81           HA       LEU  81  12.027  15.642   5.629
  572    HG   LEU  81           HG       LEU  81  11.303  13.831   3.198
  573    HB2  LEU  81           HB2      LEU  81  12.518  12.718   5.125
  574    HB3  LEU  81           HB1      LEU  81  11.309  13.420   6.183
  575   HD11  LEU  81          HD11      LEU  81  11.098  11.440   3.688
  576   HD12  LEU  81          HD12      LEU  81   9.581  12.103   3.080
  577   HD13  LEU  81          HD13      LEU  81   9.778  11.782   4.804
  578   HD21  LEU  81          HD21      LEU  81   8.993  14.494   3.570
  579   HD22  LEU  81          HD22      LEU  81  10.084  15.483   4.541
  580   HD23  LEU  81          HD23      LEU  81   9.165  14.181   5.297
  581    HA   PRO  82           HA       PRO  82  15.197  14.754   8.680
  582    HB2  PRO  82           HB2      PRO  82  13.660  14.447  10.877
  583    HB3  PRO  82           HB1      PRO  82  13.956  16.035  10.150
  584    HG2  PRO  82           HG2      PRO  82  11.564  14.256   9.915
  585    HG3  PRO  82           HG1      PRO  82  11.639  16.015  10.086
  586    HD2  PRO  82           HD2      PRO  82  11.226  14.712   7.721
  587    HD3  PRO  82           HD1      PRO  82  11.941  16.337   7.851
  588    H    ASN  83           HN       ASN  83  15.794  13.005  10.193
  589    HA   ASN  83           HA       ASN  83  15.529  10.524   8.920
  590    HB2  ASN  83           HB2      ASN  83  16.724  11.385  11.517
  591    HB3  ASN  83           HB1      ASN  83  16.590   9.670  11.138
  592   HD21  ASN  83          HD21      ASN  83  17.070  12.004   8.596
  593   HD22  ASN  83          HD22      ASN  83  18.715  11.599   8.267
  594    H    THR  84           HN       THR  84  13.645  11.959  11.445
  595    HA   THR  84           HA       THR  84  12.479   9.672  12.565
  596    HB   THR  84           HB       THR  84  11.013  12.282  12.181
  597    HG1  THR  84           HG1      THR  84  12.169  12.818  14.232
  598   HG21  THR  84          HG21      THR  84   9.804  10.440  13.257
  599   HG22  THR  84          HG22      THR  84  10.124  11.742  14.405
  600   HG23  THR  84          HG23      THR  84  11.102  10.275  14.439
  601    H    VAL  85           HN       VAL  85  11.409  11.738   9.870
  602    HA   VAL  85           HA       VAL  85   9.088  10.205   9.261
  603    HB   VAL  85           HB       VAL  85  10.617  12.004   7.368
  604   HG11  VAL  85          HG11      VAL  85   7.714  11.198   7.475
  605   HG12  VAL  85          HG12      VAL  85   8.910  10.586   6.334
  606   HG13  VAL  85          HG13      VAL  85   8.443  12.288   6.296
  607   HG21  VAL  85          HG21      VAL  85   8.462  12.724   9.350
  608   HG22  VAL  85          HG22      VAL  85   9.115  13.797   8.111
  609   HG23  VAL  85          HG23      VAL  85  10.151  13.224   9.418
  610    H    LEU  86           HN       LEU  86  12.354  10.355   7.909
  611    HA   LEU  86           HA       LEU  86  12.388   8.411   6.005
  612    HG   LEU  86           HG       LEU  86  15.758   9.895   6.327
  613    HB2  LEU  86           HB2      LEU  86  14.324   9.280   8.087
  614    HB3  LEU  86           HB1      LEU  86  14.685   7.798   7.204
  615   HD11  LEU  86          HD11      LEU  86  13.970   8.342   4.487
  616   HD12  LEU  86          HD12      LEU  86  15.582   7.865   5.022
  617   HD13  LEU  86          HD13      LEU  86  15.375   9.289   4.000
  618   HD21  LEU  86          HD21      LEU  86  13.870  11.422   6.578
  619   HD22  LEU  86          HD22      LEU  86  12.959  10.489   5.389
  620   HD23  LEU  86          HD23      LEU  86  14.420  11.348   4.904
  621    H    GLY  87           HN       GLY  87  12.928   7.874   9.469
  622    HA2  GLY  87           HA2      GLY  87  13.212   5.097   9.314
  623    HA3  GLY  87           HA1      GLY  87  12.833   6.003  10.768
  624    H    LYS  88           HN       LYS  88  10.271   7.042   9.913
  625    HA   LYS  88           HA       LYS  88   8.847   4.582  10.452
  626    HB2  LYS  88           HB2      LYS  88   6.922   5.896  10.987
  627    HB3  LYS  88           HB1      LYS  88   8.332   6.519  11.822
  628    HG2  LYS  88           HG2      LYS  88   8.452   8.394  10.371
  629    HG3  LYS  88           HG1      LYS  88   7.221   7.703   9.301
  630    HD2  LYS  88           HD2      LYS  88   5.544   7.900  10.981
  631    HD3  LYS  88           HD1      LYS  88   6.739   8.321  12.202
  632    HE2  LYS  88           HE2      LYS  88   7.196  10.414  10.978
  633    HE3  LYS  88           HE1      LYS  88   5.917   9.991   9.837
  634    HZ1  LYS  88           HZ1      LYS  88   4.313  10.050  11.597
  635    HZ2  LYS  88           HZ2      LYS  88   5.172  11.513  11.616
  636    HZ3  LYS  88           HZ3      LYS  88   5.521  10.304  12.760
  637    H    ILE  89           HN       ILE  89   9.214   6.762   7.756
  638    HA   ILE  89           HA       ILE  89   7.129   5.661   6.178
  639    HB   ILE  89           HB       ILE  89   9.781   6.876   5.371
  640   HG12  ILE  89          HG12      ILE  89   6.939   7.900   5.361
  641   HG13  ILE  89          HG11      ILE  89   8.295   8.505   6.307
  642   HG21  ILE  89          HG21      ILE  89   7.519   6.039   3.560
  643   HG22  ILE  89          HG22      ILE  89   9.119   5.302   3.649
  644   HG23  ILE  89          HG23      ILE  89   8.944   6.959   3.078
  645   HD11  ILE  89          HD11      ILE  89   7.860  10.015   4.511
  646   HD12  ILE  89          HD12      ILE  89   7.938   8.708   3.330
  647   HD13  ILE  89          HD13      ILE  89   9.392   9.197   4.203
  648    H    TRP  90           HN       TRP  90  10.507   4.838   6.703
  649    HA   TRP  90           HA       TRP  90  10.695   2.644   4.989
  650    HD1  TRP  90           HD1      TRP  90  12.812   0.756   8.331
  651    HE1  TRP  90           HE1      TRP  90  14.162  -1.132   7.207
  652    HE3  TRP  90           HE3      TRP  90  13.072   2.671   3.604
  653    HZ2  TRP  90           HZ2      TRP  90  15.188  -1.725   4.647
  654    HZ3  TRP  90           HZ3      TRP  90  14.255   1.374   1.882
  655    HH2  TRP  90           HH2      TRP  90  15.288  -0.773   2.391
  656    HB2  TRP  90           HB2      TRP  90  12.637   3.704   6.028
  657    HB3  TRP  90           HB1      TRP  90  12.111   3.145   7.613
  658    H    LYS  91           HN       LYS  91   9.927   2.714   8.472
  659    HA   LYS  91           HA       LYS  91   9.652  -0.125   8.584
  660    HB2  LYS  91           HB2      LYS  91   9.091   0.158  10.877
  661    HB3  LYS  91           HB1      LYS  91  10.343   1.330  10.503
  662    HG2  LYS  91           HG2      LYS  91   8.681   3.096  10.356
  663    HG3  LYS  91           HG1      LYS  91   7.403   1.930  10.686
  664    HD2  LYS  91           HD2      LYS  91   7.721   2.775  12.797
  665    HD3  LYS  91           HD1      LYS  91   8.860   1.430  12.822
  666    HE2  LYS  91           HE2      LYS  91   9.568   4.305  12.210
  667    HE3  LYS  91           HE1      LYS  91   9.830   3.493  13.755
  668    HZ1  LYS  91           HZ1      LYS  91  11.295   1.923  12.624
  669    HZ2  LYS  91           HZ2      LYS  91  11.846   3.517  12.452
  670    HZ3  LYS  91           HZ3      LYS  91  11.066   2.751  11.160
  671    H    LEU  92           HN       LEU  92   7.561   2.332   7.542
  672    HA   LEU  92           HA       LEU  92   5.155   0.784   8.082
  673    HG   LEU  92           HG       LEU  92   3.106   2.110   6.578
  674    HB2  LEU  92           HB2      LEU  92   5.348   3.339   8.189
  675    HB3  LEU  92           HB1      LEU  92   5.346   3.290   6.423
  676   HD11  LEU  92          HD11      LEU  92   1.857   2.354   8.653
  677   HD12  LEU  92          HD12      LEU  92   3.281   3.029   9.445
  678   HD13  LEU  92          HD13      LEU  92   3.288   1.351   8.893
  679   HD21  LEU  92          HD21      LEU  92   1.867   4.168   6.982
  680   HD22  LEU  92          HD22      LEU  92   3.315   4.484   6.022
  681   HD23  LEU  92          HD23      LEU  92   3.287   4.889   7.739
  682    H    ALA  93           HN       ALA  93   7.456   1.392   5.528
  683    HA   ALA  93           HA       ALA  93   5.757   0.119   3.529
  684    HB1  ALA  93           HB1      ALA  93   8.552   1.213   3.268
  685    HB2  ALA  93           HB2      ALA  93   7.068   2.094   2.912
  686    HB3  ALA  93           HB3      ALA  93   7.509   0.684   1.945
  687    H    ASP  94           HN       ASP  94   8.823  -0.495   5.219
  688    HA   ASP  94           HA       ASP  94   9.062  -3.086   3.911
  689    HB2  ASP  94           HB2      ASP  94  11.079  -1.710   4.247
  690    HB3  ASP  94           HB1      ASP  94  10.831  -1.769   5.975
  691    H    VAL  95           HN       VAL  95   7.474  -4.347   4.662
  692    HA   VAL  95           HA       VAL  95   6.477  -4.420   7.290
  693    HB   VAL  95           HB       VAL  95   6.265  -6.534   5.154
  694   HG11  VAL  95          HG11      VAL  95   5.654  -7.355   7.390
  695   HG12  VAL  95          HG12      VAL  95   4.259  -7.258   6.318
  696   HG13  VAL  95          HG13      VAL  95   4.508  -6.024   7.556
  697   HG21  VAL  95          HG21      VAL  95   4.157  -5.475   4.560
  698   HG22  VAL  95          HG22      VAL  95   5.488  -4.327   4.406
  699   HG23  VAL  95          HG23      VAL  95   4.410  -4.246   5.798
  700    H    ASP  96           HN       ASP  96   9.211  -5.853   5.846
  701    HA   ASP  96           HA       ASP  96   9.366  -8.032   7.792
  702    HB2  ASP  96           HB2      ASP  96  11.488  -7.461   5.802
  703    HB3  ASP  96           HB1      ASP  96  10.869  -9.030   6.356
  704    H    LYS  97           HN       LYS  97  10.772  -4.968   6.990
  705    HA   LYS  97           HA       LYS  97  12.390  -3.678   7.925
  706    HB2  LYS  97           HB2      LYS  97  11.984  -5.479  10.325
  707    HB3  LYS  97           HB1      LYS  97  12.682  -3.858  10.332
  708    HG2  LYS  97           HG2      LYS  97  10.629  -2.870   9.724
  709    HG3  LYS  97           HG1      LYS  97   9.906  -4.419   9.338
  710    HD2  LYS  97           HD2      LYS  97   9.064  -3.593  11.468
  711    HD3  LYS  97           HD1      LYS  97  10.008  -5.065  11.698
  712    HE2  LYS  97           HE2      LYS  97  11.945  -3.684  12.347
  713    HE3  LYS  97           HE1      LYS  97  10.941  -2.242  12.187
  714    HZ1  LYS  97           HZ1      LYS  97  11.083  -2.985  14.483
  715    HZ2  LYS  97           HZ2      LYS  97  10.427  -4.493  14.057
  716    HZ3  LYS  97           HZ3      LYS  97   9.489  -3.086  13.915
  717    H    ASP  98           HN       ASP  98  13.459  -5.005   6.227
  718    HA   ASP  98           HA       ASP  98  15.405  -6.951   7.268
  719    HB2  ASP  98           HB2      ASP  98  15.490  -7.601   4.760
  720    HB3  ASP  98           HB1      ASP  98  14.051  -8.045   5.685
  721    H    GLY  99           HN       GLY  99  15.088  -3.862   5.810
  722    HA2  GLY  99           HA2      GLY  99  16.897  -2.323   5.692
  723    HA3  GLY  99           HA1      GLY  99  18.009  -3.681   5.642
  724    H    LEU 100           HN       LEU 100  15.355  -4.103   3.597
  725    HA   LEU 100           HA       LEU 100  16.490  -2.644   1.354
  726    HG   LEU 100           HG       LEU 100  16.131  -6.110   2.539
  727    HB2  LEU 100           HB2      LEU 100  16.405  -4.694  -0.096
  728    HB3  LEU 100           HB1      LEU 100  17.699  -4.664   1.083
  729   HD11  LEU 100          HD11      LEU 100  14.841  -6.452  -0.162
  730   HD12  LEU 100          HD12      LEU 100  14.083  -5.879   1.325
  731   HD13  LEU 100          HD13      LEU 100  14.619  -7.553   1.198
  732   HD21  LEU 100          HD21      LEU 100  17.357  -7.206   0.014
  733   HD22  LEU 100          HD22      LEU 100  16.961  -8.137   1.459
  734   HD23  LEU 100          HD23      LEU 100  18.202  -6.885   1.527
  735    H    LEU 101           HN       LEU 101  14.945  -3.401  -0.696
  736    HA   LEU 101           HA       LEU 101  12.191  -3.544   0.155
  737    HG   LEU 101           HG       LEU 101  13.209  -0.792   1.329
  738    HB2  LEU 101           HB2      LEU 101  13.353  -1.030  -1.056
  739    HB3  LEU 101           HB1      LEU 101  11.650  -1.427  -1.180
  740   HD11  LEU 101          HD11      LEU 101  12.510   1.102  -0.062
  741   HD12  LEU 101          HD12      LEU 101  11.689   1.078   1.495
  742   HD13  LEU 101          HD13      LEU 101  10.840   0.550   0.039
  743   HD21  LEU 101          HD21      LEU 101  11.127  -1.070   2.551
  744   HD22  LEU 101          HD22      LEU 101  11.620  -2.590   1.805
  745   HD23  LEU 101          HD23      LEU 101  10.324  -1.634   1.089
  746    H    ASP 102           HN       ASP 102  11.487  -5.008  -1.318
  747    HA   ASP 102           HA       ASP 102  12.772  -5.227  -3.883
  748    HB2  ASP 102           HB2      ASP 102  11.519  -7.156  -4.212
  749    HB3  ASP 102           HB1      ASP 102  11.869  -7.149  -2.491
  750    H    ASP 103           HN       ASP 103  10.765  -5.723  -5.701
  751    HA   ASP 103           HA       ASP 103  10.233  -3.109  -6.568
  752    HB2  ASP 103           HB2      ASP 103   8.922  -4.119  -8.335
  753    HB3  ASP 103           HB1      ASP 103  10.414  -5.028  -8.075
  754    H    GLU 104           HN       GLU 104   8.261  -5.330  -4.716
  755    HA   GLU 104           HA       GLU 104   5.926  -3.624  -4.921
  756    HB2  GLU 104           HB2      GLU 104   5.889  -6.155  -4.825
  757    HB3  GLU 104           HB1      GLU 104   6.320  -6.015  -3.124
  758    HG2  GLU 104           HG2      GLU 104   4.285  -5.120  -2.537
  759    HG3  GLU 104           HG1      GLU 104   3.961  -4.530  -4.182
  760    H    GLU 105           HN       GLU 105   8.554  -4.222  -2.753
  761    HA   GLU 105           HA       GLU 105   7.456  -2.789  -0.535
  762    HB2  GLU 105           HB2      GLU 105   9.880  -4.234  -1.195
  763    HB3  GLU 105           HB1      GLU 105  10.225  -2.772  -0.282
  764    HG2  GLU 105           HG2      GLU 105   8.843  -3.480   1.519
  765    HG3  GLU 105           HG1      GLU 105   8.176  -4.808   0.559
  766    H    PHE 106           HN       PHE 106   9.494  -1.998  -3.284
  767    HA   PHE 106           HA       PHE 106   9.978   0.702  -2.596
  768    HD1  PHE 106           HD2      PHE 106   8.986   2.392  -4.821
  769    HD2  PHE 106           HD1      PHE 106  12.758   0.608  -5.610
  770    HE1  PHE 106           HE2      PHE 106   9.810   4.533  -5.697
  771    HE2  PHE 106           HE1      PHE 106  13.587   2.744  -6.487
  772    HZ   PHE 106           HZ       PHE 106  12.125   4.711  -6.526
  773    HB2  PHE 106           HB2      PHE 106  11.216  -0.571  -4.371
  774    HB3  PHE 106           HB1      PHE 106   9.783  -0.490  -5.379
  775    H    ALA 107           HN       ALA 107   7.478  -1.017  -4.369
  776    HA   ALA 107           HA       ALA 107   5.900   1.071  -5.234
  777    HB1  ALA 107           HB1      ALA 107   5.484  -1.253  -5.823
  778    HB2  ALA 107           HB2      ALA 107   4.030  -0.506  -5.163
  779    HB3  ALA 107           HB3      ALA 107   4.990  -1.598  -4.166
  780    H    LEU 108           HN       LEU 108   5.773  -0.588  -2.076
  781    HA   LEU 108           HA       LEU 108   3.756   1.069  -0.983
  782    HG   LEU 108           HG       LEU 108   2.797  -0.317   0.835
  783    HB2  LEU 108           HB2      LEU 108   4.866  -1.219  -0.161
  784    HB3  LEU 108           HB1      LEU 108   5.815  -0.109   0.814
  785   HD11  LEU 108          HD11      LEU 108   4.826  -1.153   2.889
  786   HD12  LEU 108          HD12      LEU 108   3.920  -2.242   1.841
  787   HD13  LEU 108          HD13      LEU 108   3.074  -1.263   3.041
  788   HD21  LEU 108          HD21      LEU 108   4.636   1.285   2.596
  789   HD22  LEU 108          HD22      LEU 108   2.881   1.173   2.737
  790   HD23  LEU 108          HD23      LEU 108   3.605   1.945   1.327
  791    H    ALA 109           HN       ALA 109   7.300   1.095  -0.552
  792    HA   ALA 109           HA       ALA 109   7.594   3.259   1.120
  793    HB1  ALA 109           HB1      ALA 109   9.405   2.598  -1.189
  794    HB2  ALA 109           HB2      ALA 109   9.418   1.800   0.383
  795    HB3  ALA 109           HB3      ALA 109   9.832   3.512   0.260
  796    H    ASN 110           HN       ASN 110   7.549   3.421  -2.440
  797    HA   ASN 110           HA       ASN 110   7.911   6.242  -2.505
  798    HB2  ASN 110           HB2      ASN 110   8.490   4.549  -4.340
  799    HB3  ASN 110           HB1      ASN 110   6.780   4.591  -4.758
  800   HD21  ASN 110          HD21      ASN 110   9.772   6.341  -4.747
  801   HD22  ASN 110          HD22      ASN 110   9.251   7.657  -5.743
  802    H    HIS 111           HN       HIS 111   5.155   4.088  -2.514
  803    HA   HIS 111           HA       HIS 111   3.196   6.002  -3.227
  804    HD1  HIS 111           HD1      HIS 111   0.914   5.055  -4.394
  805    HD2  HIS 111           HD2      HIS 111   0.379   4.011  -0.401
  806    HE1  HIS 111           HE1      HIS 111  -1.522   5.432  -3.923
  807    HE2  HIS 111           HE2      HIS 111  -1.763   5.024  -1.448
  808    HB2  HIS 111           HB2      HIS 111   2.839   3.522  -3.240
  809    HB3  HIS 111           HB1      HIS 111   2.825   3.573  -1.473
  810    H    LEU 112           HN       LEU 112   4.692   5.031  -0.211
  811    HA   LEU 112           HA       LEU 112   3.011   6.584   1.467
  812    HG   LEU 112           HG       LEU 112   3.836   3.768   2.054
  813    HB2  LEU 112           HB2      LEU 112   5.718   5.326   1.814
  814    HB3  LEU 112           HB1      LEU 112   5.042   6.369   3.057
  815   HD11  LEU 112          HD11      LEU 112   4.301   3.004   4.336
  816   HD12  LEU 112          HD12      LEU 112   5.095   4.542   4.685
  817   HD13  LEU 112          HD13      LEU 112   5.776   3.452   3.477
  818   HD21  LEU 112          HD21      LEU 112   2.180   4.107   3.837
  819   HD22  LEU 112          HD22      LEU 112   2.084   5.361   2.600
  820   HD23  LEU 112          HD23      LEU 112   2.851   5.708   4.150
  821    H    ILE 113           HN       ILE 113   6.091   7.233  -0.187
  822    HA   ILE 113           HA       ILE 113   6.519   9.826   0.768
  823    HB   ILE 113           HB       ILE 113   7.084   8.780  -2.008
  824   HG12  ILE 113          HG12      ILE 113   8.173   7.481  -0.234
  825   HG13  ILE 113          HG11      ILE 113   9.340   8.391  -1.185
  826   HG21  ILE 113          HG21      ILE 113   7.110  11.217  -1.968
  827   HG22  ILE 113          HG22      ILE 113   8.748  10.581  -2.142
  828   HG23  ILE 113          HG23      ILE 113   8.203  11.193  -0.581
  829   HD11  ILE 113          HD11      ILE 113   9.533  10.039   0.567
  830   HD12  ILE 113          HD12      ILE 113   9.887   8.419   1.172
  831   HD13  ILE 113          HD13      ILE 113   8.333   9.174   1.529
  832    H    LYS 114           HN       LYS 114   4.572   8.658  -1.958
  833    HA   LYS 114           HA       LYS 114   3.487  11.077  -2.827
  834    HB2  LYS 114           HB2      LYS 114   3.142   8.427  -3.454
  835    HB3  LYS 114           HB1      LYS 114   1.602   8.806  -2.702
  836    HG2  LYS 114           HG2      LYS 114   2.703  10.516  -4.894
  837    HG3  LYS 114           HG1      LYS 114   1.845   9.025  -5.249
  838    HD2  LYS 114           HD2      LYS 114   0.170  10.610  -5.379
  839    HD3  LYS 114           HD1      LYS 114  -0.006  10.025  -3.727
  840    HE2  LYS 114           HE2      LYS 114   1.286  11.957  -2.929
  841    HE3  LYS 114           HE1      LYS 114   1.437  12.532  -4.589
  842    HZ1  LYS 114           HZ1      LYS 114  -0.331  13.658  -3.368
  843    HZ2  LYS 114           HZ2      LYS 114  -1.135  12.186  -3.132
  844    HZ3  LYS 114           HZ3      LYS 114  -0.946  12.811  -4.694
  845    H    VAL 115           HN       VAL 115   2.370   8.875  -0.289
  846    HA   VAL 115           HA       VAL 115   0.017  10.252   0.406
  847    HB   VAL 115           HB       VAL 115   1.754   8.371   2.012
  848   HG11  VAL 115          HG11      VAL 115  -0.148   8.079   3.516
  849   HG12  VAL 115          HG12      VAL 115  -1.031   9.338   2.652
  850   HG13  VAL 115          HG13      VAL 115   0.436   9.742   3.543
  851   HG21  VAL 115          HG21      VAL 115  -0.838   7.929   0.545
  852   HG22  VAL 115          HG22      VAL 115   0.047   6.719   1.477
  853   HG23  VAL 115          HG23      VAL 115   0.760   7.403   0.015
  854    H    LYS 116           HN       LYS 116   3.316  10.507   1.718
  855    HA   LYS 116           HA       LYS 116   2.544  12.472   3.654
  856    HB2  LYS 116           HB2      LYS 116   5.050  12.825   3.868
  857    HB3  LYS 116           HB1      LYS 116   4.470  11.196   4.197
  858    HG2  LYS 116           HG2      LYS 116   5.560  10.330   2.440
  859    HG3  LYS 116           HG1      LYS 116   5.267  11.746   1.425
  860    HD2  LYS 116           HD2      LYS 116   7.328  11.509   3.622
  861    HD3  LYS 116           HD1      LYS 116   7.620  11.514   1.891
  862    HE2  LYS 116           HE2      LYS 116   6.316  13.789   3.352
  863    HE3  LYS 116           HE1      LYS 116   8.044  13.707   3.006
  864    HZ1  LYS 116           HZ1      LYS 116   7.582  13.701   0.669
  865    HZ2  LYS 116           HZ2      LYS 116   6.765  15.016   1.371
  866    HZ3  LYS 116           HZ3      LYS 116   5.914  13.615   0.937
  867    H    LEU 117           HN       LEU 117   3.345  12.570   0.314
  868    HA   LEU 117           HA       LEU 117   4.179  15.333   0.278
  869    HG   LEU 117           HG       LEU 117   3.414  15.915  -2.650
  870    HB2  LEU 117           HB2      LEU 117   5.000  13.678  -1.372
  871    HB3  LEU 117           HB1      LEU 117   3.355  13.522  -1.997
  872   HD11  LEU 117          HD11      LEU 117   5.089  16.647  -1.007
  873   HD12  LEU 117          HD12      LEU 117   5.496  17.135  -2.652
  874   HD13  LEU 117          HD13      LEU 117   6.329  15.771  -1.907
  875   HD21  LEU 117          HD21      LEU 117   3.959  14.148  -4.261
  876   HD22  LEU 117          HD22      LEU 117   5.657  14.245  -3.796
  877   HD23  LEU 117          HD23      LEU 117   4.874  15.621  -4.573
  878    H    GLU 118           HN       GLU 118   1.209  13.618   0.211
  879    HA   GLU 118           HA       GLU 118  -0.434  15.442  -1.164
  880    HB2  GLU 118           HB2      GLU 118  -1.251  13.708   1.180
  881    HB3  GLU 118           HB1      GLU 118  -2.300  14.347  -0.079
  882    HG2  GLU 118           HG2      GLU 118  -1.004  12.981  -1.728
  883    HG3  GLU 118           HG1      GLU 118  -0.175  12.239  -0.353
  884    H    GLY 119           HN       GLY 119   1.134  15.642   1.848
  885    HA2  GLY 119           HA2      GLY 119   1.335  17.881   2.772
  886    HA3  GLY 119           HA1      GLY 119  -0.377  18.102   2.435
  887    H    HIS 120           HN       HIS 120   0.108  15.002   3.475
  888    HA   HIS 120           HA       HIS 120  -0.322  15.769   6.268
  889    HD1  HIS 120           HD1      HIS 120  -1.687  12.002   6.975
  890    HD2  HIS 120           HD2      HIS 120  -2.084  12.889   2.926
  891    HE1  HIS 120           HE1      HIS 120  -1.858   9.793   5.819
  892    HE2  HIS 120           HE2      HIS 120  -2.253  10.356   3.384
  893    HB2  HIS 120           HB2      HIS 120  -2.188  14.448   6.523
  894    HB3  HIS 120           HB1      HIS 120  -2.399  14.964   4.857
  895    H    GLU 121           HN       GLU 121   0.623  14.569   7.765
  896    HA   GLU 121           HA       GLU 121   2.849  12.954   7.046
  897    HB2  GLU 121           HB2      GLU 121   3.296  14.063   8.985
  898    HB3  GLU 121           HB1      GLU 121   1.631  14.007   9.531
  899    HG2  GLU 121           HG2      GLU 121   1.904  11.687  10.186
  900    HG3  GLU 121           HG1      GLU 121   3.566  11.713   9.598
  901    H    LEU 122           HN       LEU 122   3.222  10.765   7.555
  902    HA   LEU 122           HA       LEU 122   1.068   9.000   7.032
  903    HG   LEU 122           HG       LEU 122   4.262   9.433   6.161
  904    HB2  LEU 122           HB2      LEU 122   3.753   8.304   8.225
  905    HB3  LEU 122           HB1      LEU 122   2.649   7.205   7.402
  906   HD11  LEU 122          HD11      LEU 122   4.298   6.438   5.829
  907   HD12  LEU 122          HD12      LEU 122   5.529   7.424   6.620
  908   HD13  LEU 122          HD13      LEU 122   5.253   7.581   4.884
  909   HD21  LEU 122          HD21      LEU 122   2.021   9.338   5.172
  910   HD22  LEU 122          HD22      LEU 122   2.241   7.617   4.861
  911   HD23  LEU 122          HD23      LEU 122   3.264   8.799   4.043
  912    HA   PRO 123           HA       PRO 123  -0.419   8.593  11.129
  913    HB2  PRO 123           HB2      PRO 123  -2.259   6.698  10.706
  914    HB3  PRO 123           HB1      PRO 123  -2.398   8.307   9.993
  915    HG2  PRO 123           HG2      PRO 123  -1.627   5.738   8.730
  916    HG3  PRO 123           HG1      PRO 123  -2.461   7.132   8.024
  917    HD2  PRO 123           HD2      PRO 123   0.284   6.489   7.788
  918    HD3  PRO 123           HD1      PRO 123  -0.505   7.994   7.282
  919    H    ALA 124           HN       ALA 124   1.670   6.391   9.905
  920    HA   ALA 124           HA       ALA 124   2.809   4.598  10.705
  921    HB1  ALA 124           HB1      ALA 124   1.749   5.560  13.360
  922    HB2  ALA 124           HB2      ALA 124   3.255   6.061  12.589
  923    HB3  ALA 124           HB3      ALA 124   3.054   4.396  13.140
  924    H    ASP 125           HN       ASP 125  -0.128   4.452  10.065
  925    HA   ASP 125           HA       ASP 125  -0.739   1.920  11.426
  926    HB2  ASP 125           HB2      ASP 125  -2.383   3.838  11.711
  927    HB3  ASP 125           HB1      ASP 125  -2.690   3.718   9.979
  928    H    LEU 126           HN       LEU 126  -1.063   0.138  10.167
  929    HA   LEU 126           HA       LEU 126  -0.644   0.534   7.289
  930    HG   LEU 126           HG       LEU 126   1.827  -0.206   6.860
  931    HB2  LEU 126           HB2      LEU 126   1.017  -0.786   9.029
  932    HB3  LEU 126           HB1      LEU 126   0.045  -2.100   8.384
  933   HD11  LEU 126          HD11      LEU 126   2.980  -2.062   7.909
  934   HD12  LEU 126          HD12      LEU 126   2.926  -2.289   6.159
  935   HD13  LEU 126          HD13      LEU 126   1.833  -3.200   7.197
  936   HD21  LEU 126          HD21      LEU 126  -0.039  -2.283   5.727
  937   HD22  LEU 126          HD22      LEU 126   1.102  -1.290   4.817
  938   HD23  LEU 126          HD23      LEU 126  -0.276  -0.538   5.629
  939    HA   PRO 127           HA       PRO 127  -4.742  -1.322   7.543
  940    HB2  PRO 127           HB2      PRO 127  -5.283  -0.263   4.940
  941    HB3  PRO 127           HB1      PRO 127  -5.858   0.328   6.502
  942    HG2  PRO 127           HG2      PRO 127  -4.105   1.655   4.831
  943    HG3  PRO 127           HG1      PRO 127  -4.305   1.981   6.561
  944    HD2  PRO 127           HD2      PRO 127  -2.190   0.418   5.153
  945    HD3  PRO 127           HD1      PRO 127  -2.065   1.444   6.600
  946    HA   PRO 128           HA       PRO 128  -4.335  -5.078   5.261
  947    HB2  PRO 128           HB2      PRO 128  -7.102  -4.825   4.294
  948    HB3  PRO 128           HB1      PRO 128  -6.366  -6.085   5.296
  949    HG2  PRO 128           HG2      PRO 128  -8.082  -4.185   6.226
  950    HG3  PRO 128           HG1      PRO 128  -6.897  -5.026   7.232
  951    HD2  PRO 128           HD2      PRO 128  -6.932  -2.246   6.269
  952    HD3  PRO 128           HD1      PRO 128  -6.054  -2.955   7.635
  953    H    HIS 129           HN       HIS 129  -6.127  -2.508   3.636
  954    HA   HIS 129           HA       HIS 129  -5.432  -3.480   1.013
  955    HD1  HIS 129           HD1      HIS 129  -8.038  -1.299   3.671
  956    HD2  HIS 129           HD2      HIS 129  -6.091   1.104   0.885
  957    HE1  HIS 129           HE1      HIS 129  -8.129   1.041   4.596
  958    HE2  HIS 129           HE2      HIS 129  -7.155   2.494   2.782
  959    HB2  HIS 129           HB2      HIS 129  -6.635  -1.494   0.177
  960    HB3  HIS 129           HB1      HIS 129  -7.604  -2.411   1.310
  961    H    LEU 130           HN       LEU 130  -3.245  -2.657   2.861
  962    HA   LEU 130           HA       LEU 130  -1.810  -1.203   0.756
  963    HG   LEU 130           HG       LEU 130  -1.256   0.983   0.815
  964    HB2  LEU 130           HB2      LEU 130  -2.402  -0.102   3.332
  965    HB3  LEU 130           HB1      LEU 130  -0.671  -0.183   3.084
  966   HD11  LEU 130          HD11      LEU 130  -3.653   0.887   0.998
  967   HD12  LEU 130          HD12      LEU 130  -3.112   2.564   1.035
  968   HD13  LEU 130          HD13      LEU 130  -3.600   1.760   2.528
  969   HD21  LEU 130          HD21      LEU 130  -1.254   2.396   3.468
  970   HD22  LEU 130          HD22      LEU 130  -0.949   3.157   1.906
  971   HD23  LEU 130          HD23      LEU 130   0.159   1.928   2.521
  972    H    VAL 131           HN       VAL 131  -1.921  -3.921   2.445
  973    HA   VAL 131           HA       VAL 131   0.958  -4.022   2.924
  974    HB   VAL 131           HB       VAL 131  -1.275  -5.791   3.849
  975   HG11  VAL 131          HG11      VAL 131   1.656  -6.531   3.834
  976   HG12  VAL 131          HG12      VAL 131   0.405  -7.304   2.861
  977   HG13  VAL 131          HG13      VAL 131   0.361  -7.434   4.620
  978   HG21  VAL 131          HG21      VAL 131  -0.195  -5.406   5.993
  979   HG22  VAL 131          HG22      VAL 131  -0.495  -3.869   5.178
  980   HG23  VAL 131          HG23      VAL 131   1.131  -4.561   5.186
  981    HA   PRO 132           HA       PRO 132   1.640  -5.486  -1.190
  982    HB2  PRO 132           HB2      PRO 132   4.101  -6.389   0.274
  983    HB3  PRO 132           HB1      PRO 132   3.978  -5.556  -1.278
  984    HG2  PRO 132           HG2      PRO 132   4.666  -4.200   0.872
  985    HG3  PRO 132           HG1      PRO 132   3.519  -3.505  -0.288
  986    HD2  PRO 132           HD2      PRO 132   3.005  -4.689   2.404
  987    HD3  PRO 132           HD1      PRO 132   2.213  -3.314   1.592
  988    HA   PRO 133           HA       PRO 133   0.192  -9.781  -0.696
  989    HB2  PRO 133           HB2      PRO 133   1.520  -9.817  -3.379
  990    HB3  PRO 133           HB1      PRO 133  -0.026 -10.518  -2.881
  991    HG2  PRO 133           HG2      PRO 133   0.053  -8.229  -4.234
  992    HG3  PRO 133           HG1      PRO 133  -1.121  -8.473  -2.914
  993    HD2  PRO 133           HD2      PRO 133   1.351  -6.816  -2.985
  994    HD3  PRO 133           HD1      PRO 133  -0.144  -6.587  -2.044
  995    H    SER 134           HN       SER 134   3.411  -8.808  -1.721
  996    HA   SER 134           HA       SER 134   4.660 -11.324  -1.480
  997    HG   SER 134           HG       SER 134   5.027  -7.792  -2.187
  998    HB2  SER 134           HB2      SER 134   6.761  -9.827  -1.304
  999    HB3  SER 134           HB1      SER 134   5.792  -9.735  -2.778
 1000    H    LYS 135           HN       LYS 135   3.607  -9.164   1.019
 1001    HA   LYS 135           HA       LYS 135   5.820  -9.811   2.767
 1002    HB2  LYS 135           HB2      LYS 135   3.388  -8.395   3.804
 1003    HB3  LYS 135           HB1      LYS 135   5.063  -8.227   4.266
 1004    HG2  LYS 135           HG2      LYS 135   3.719  -7.153   1.813
 1005    HG3  LYS 135           HG1      LYS 135   4.485  -6.254   3.131
 1006    HD2  LYS 135           HD2      LYS 135   5.849  -8.009   1.087
 1007    HD3  LYS 135           HD1      LYS 135   5.938  -6.250   1.198
 1008    HE2  LYS 135           HE2      LYS 135   7.158  -6.333   3.192
 1009    HE3  LYS 135           HE1      LYS 135   6.795  -8.040   3.441
 1010    HZ1  LYS 135           HZ1      LYS 135   8.115  -8.564   1.469
 1011    HZ2  LYS 135           HZ2      LYS 135   9.039  -7.801   2.662
 1012    HZ3  LYS 135           HZ3      LYS 135   8.540  -6.933   1.294
 1013    H    ARG 136           HN       ARG 136   3.109 -11.438   1.924
 1014    HA   ARG 136           HA       ARG 136   3.079 -12.884   4.484
 1015    HE   ARG 136           HE       ARG 136  -1.854 -11.803   3.432
 1016    HB2  ARG 136           HB2      ARG 136   0.917 -13.862   3.664
 1017    HB3  ARG 136           HB1      ARG 136   0.860 -12.129   3.938
 1018    HG2  ARG 136           HG2      ARG 136   1.203 -11.789   1.505
 1019    HG3  ARG 136           HG1      ARG 136   1.097 -13.538   1.291
 1020    HD2  ARG 136           HD2      ARG 136  -1.021 -12.397   0.813
 1021    HD3  ARG 136           HD1      ARG 136  -1.160 -13.538   2.147
 1022   HH11  ARG 136          HH11      ARG 136   0.270 -10.481   0.965
 1023   HH12  ARG 136          HH12      ARG 136   0.015  -8.832   1.442
 1024   HH21  ARG 136          HH21      ARG 136  -2.230  -9.630   4.033
 1025   HH22  ARG 136          HH22      ARG 136  -1.419  -8.351   3.186
 1026    H    ARG 137           HN       ARG 137   5.188 -13.683   3.628
 1027    HA   ARG 137           HA       ARG 137   4.837 -16.176   2.208
 1028    HE   ARG 137           HE       ARG 137   7.325 -13.969  -1.351
 1029    HB2  ARG 137           HB2      ARG 137   6.112 -13.788   0.974
 1030    HB3  ARG 137           HB1      ARG 137   6.874 -15.351   0.695
 1031    HG2  ARG 137           HG2      ARG 137   4.944 -16.201  -0.364
 1032    HG3  ARG 137           HG1      ARG 137   3.957 -14.846   0.173
 1033    HD2  ARG 137           HD2      ARG 137   4.654 -14.800  -2.237
 1034    HD3  ARG 137           HD1      ARG 137   5.045 -13.363  -1.297
 1035   HH11  ARG 137          HH11      ARG 137   5.304 -16.222  -3.142
 1036   HH12  ARG 137          HH12      ARG 137   6.625 -16.832  -4.098
 1037   HH21  ARG 137          HH21      ARG 137   9.027 -14.732  -2.600
 1038   HH22  ARG 137          HH22      ARG 137   8.761 -15.976  -3.789
 1039    H    HIS 138           HN       HIS 138   5.944 -17.579   3.352
 1040    HA   HIS 138           HA       HIS 138   8.715 -16.884   4.046
 1041    HD1  HIS 138           HD1      HIS 138   8.985 -20.267   6.240
 1042    HD2  HIS 138           HD2      HIS 138   9.724 -16.258   7.080
 1043    HE1  HIS 138           HE1      HIS 138  11.128 -20.230   7.555
 1044    HE2  HIS 138           HE2      HIS 138  11.658 -17.780   7.881
 1045    HB2  HIS 138           HB2      HIS 138   7.205 -16.973   6.086
 1046    HB3  HIS 138           HB1      HIS 138   6.983 -18.689   5.754
 1047    H    GLU 139           HN       GLU 139   9.847 -17.981   2.621
 1048    HA   GLU 139           HA       GLU 139   9.043 -20.568   1.649
 1049    HB2  GLU 139           HB2      GLU 139  10.141 -19.036   0.120
 1050    HB3  GLU 139           HB1      GLU 139  11.534 -18.921   1.185
 1051    HG2  GLU 139           HG2      GLU 139  11.929 -21.358   0.813
 1052    HG3  GLU 139           HG1      GLU 139  10.633 -21.322  -0.382
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1 -29.966  38.269  -0.604
    2    H2   GLY   1           HT2      GLY   1 -29.592  36.716  -0.045
    3    H3   GLY   1           HT3      GLY   1 -30.232  36.926  -1.600
    4    HA2  GLY   1           HA1      GLY   1 -28.263  38.057  -2.334
    5    HA3  GLY   1           HA2      GLY   1 -27.602  37.964  -0.705
    6    HA   PRO   2           HA       PRO   2 -26.563  34.116  -3.366
    7    HB2  PRO   2           HB2      PRO   2 -23.911  34.650  -3.757
    8    HB3  PRO   2           HB1      PRO   2 -25.178  35.082  -4.914
    9    HG2  PRO   2           HG2      PRO   2 -23.824  36.789  -2.858
   10    HG3  PRO   2           HG1      PRO   2 -24.254  37.182  -4.531
   11    HD2  PRO   2           HD2      PRO   2 -25.734  38.019  -2.439
   12    HD3  PRO   2           HD1      PRO   2 -26.462  37.597  -4.003
   13    H    LEU   3           HN       LEU   3 -24.992  35.920  -0.820
   14    HA   LEU   3           HA       LEU   3 -24.135  33.389   0.420
   15    HG   LEU   3           HG       LEU   3 -20.936  34.828   1.579
   16    HB2  LEU   3           HB2      LEU   3 -22.384  35.151  -0.246
   17    HB3  LEU   3           HB1      LEU   3 -23.036  36.124   1.053
   18   HD11  LEU   3          HD11      LEU   3 -22.333  35.726   3.354
   19   HD12  LEU   3          HD12      LEU   3 -21.660  34.160   3.813
   20   HD13  LEU   3          HD13      LEU   3 -23.345  34.281   3.305
   21   HD21  LEU   3          HD21      LEU   3 -21.493  32.767   0.417
   22   HD22  LEU   3          HD22      LEU   3 -22.836  32.490   1.527
   23   HD23  LEU   3          HD23      LEU   3 -21.176  32.458   2.124
   24    H    GLY   4           HN       GLY   4 -25.159  32.842   2.241
   25    HA2  GLY   4           HA2      GLY   4 -26.003  33.314   4.421
   26    HA3  GLY   4           HA1      GLY   4 -26.360  34.956   3.900
   27    H    SER   5           HN       SER   5 -27.631  34.153   1.429
   28    HA   SER   5           HA       SER   5 -30.126  33.025   2.503
   29    HG   SER   5           HG       SER   5 -29.579  35.529   2.312
   30    HB2  SER   5           HB2      SER   5 -29.811  34.413  -0.161
   31    HB3  SER   5           HB1      SER   5 -31.277  34.192   0.793
   32    H    GLU   6           HN       GLU   6 -30.115  30.854   2.208
   33    HA   GLU   6           HA       GLU   6 -28.573  29.729   0.028
   34    HB2  GLU   6           HB2      GLU   6 -29.096  27.550   1.064
   35    HB3  GLU   6           HB1      GLU   6 -28.345  28.674   2.180
   36    HG2  GLU   6           HG2      GLU   6 -31.317  28.233   2.078
   37    HG3  GLU   6           HG1      GLU   6 -30.240  27.268   3.082
   38    H    SER   7           HN       SER   7 -29.322  28.474  -1.622
   39    HA   SER   7           HA       SER   7 -32.194  28.676  -2.191
   40    HG   SER   7           HG       SER   7 -31.394  28.157  -5.663
   41    HB2  SER   7           HB2      SER   7 -30.630  29.613  -3.882
   42    HB3  SER   7           HB1      SER   7 -29.901  28.019  -4.065
   43    H    LEU   8           HN       LEU   8 -33.408  26.901  -2.012
   44    HA   LEU   8           HA       LEU   8 -32.068  24.403  -1.409
   45    HG   LEU   8           HG       LEU   8 -34.684  24.553   1.180
   46    HB2  LEU   8           HB2      LEU   8 -34.930  25.286  -1.201
   47    HB3  LEU   8           HB1      LEU   8 -34.464  23.610  -0.999
   48   HD11  LEU   8          HD11      LEU   8 -31.755  24.414   0.486
   49   HD12  LEU   8          HD12      LEU   8 -32.793  23.046   0.895
   50   HD13  LEU   8          HD13      LEU   8 -32.443  24.281   2.104
   51   HD21  LEU   8          HD21      LEU   8 -33.423  26.528   1.911
   52   HD22  LEU   8          HD22      LEU   8 -34.550  26.905   0.609
   53   HD23  LEU   8          HD23      LEU   8 -32.829  26.743   0.262
   54    H    MET   9           HN       MET   9 -31.273  23.719  -3.341
   55    HA   MET   9           HA       MET   9 -33.268  22.969  -5.373
   56    HB2  MET   9           HB2      MET   9 -30.311  23.524  -5.600
   57    HB3  MET   9           HB1      MET   9 -31.206  22.682  -6.857
   58    HG2  MET   9           HG2      MET   9 -31.892  25.426  -5.843
   59    HG3  MET   9           HG1      MET   9 -30.902  25.105  -7.264
   60    HE1  MET   9           HE1      MET   9 -32.239  22.664  -8.640
   61    HE2  MET   9           HE2      MET   9 -31.801  24.127  -9.520
   62    HE3  MET   9           HE3      MET   9 -33.410  23.431  -9.713
   63    HA   PRO  10           HA       PRO  10 -32.479  18.839  -3.746
   64    HB2  PRO  10           HB2      PRO  10 -34.312  17.607  -5.350
   65    HB3  PRO  10           HB1      PRO  10 -34.747  18.465  -3.866
   66    HG2  PRO  10           HG2      PRO  10 -34.877  19.404  -6.706
   67    HG3  PRO  10           HG1      PRO  10 -36.067  19.607  -5.405
   68    HD2  PRO  10           HD2      PRO  10 -34.386  21.586  -6.120
   69    HD3  PRO  10           HD1      PRO  10 -34.896  21.353  -4.437
   70    H    SER  11           HN       SER  11 -32.013  20.140  -6.841
   71    HA   SER  11           HA       SER  11 -30.907  17.672  -7.927
   72    HG   SER  11           HG       SER  11 -31.081  17.661 -10.263
   73    HB2  SER  11           HB2      SER  11 -32.404  19.263  -9.277
   74    HB3  SER  11           HB1      SER  11 -31.012  20.346  -9.320
   75    H    GLN  12           HN       GLN  12 -29.067  17.411  -6.714
   76    HA   GLN  12           HA       GLN  12 -26.940  19.368  -7.257
   77    HB2  GLN  12           HB2      GLN  12 -27.680  19.417  -4.869
   78    HB3  GLN  12           HB1      GLN  12 -27.205  17.730  -4.730
   79    HG2  GLN  12           HG2      GLN  12 -24.892  18.386  -5.330
   80    HG3  GLN  12           HG1      GLN  12 -25.409  20.070  -5.319
   81   HE21  GLN  12          HE21      GLN  12 -26.591  17.660  -3.086
   82   HE22  GLN  12          HE22      GLN  12 -25.822  18.304  -1.675
   83    H    VAL  13           HN       VAL  13 -25.763  18.398  -8.791
   84    HA   VAL  13           HA       VAL  13 -25.276  15.525  -8.622
   85    HB   VAL  13           HB       VAL  13 -25.981  16.342 -10.792
   86   HG11  VAL  13          HG11      VAL  13 -23.532  18.097 -10.755
   87   HG12  VAL  13          HG12      VAL  13 -25.208  18.639 -10.630
   88   HG13  VAL  13          HG13      VAL  13 -24.635  17.882 -12.116
   89   HG21  VAL  13          HG21      VAL  13 -24.484  14.458 -10.804
   90   HG22  VAL  13          HG22      VAL  13 -23.081  15.526 -10.766
   91   HG23  VAL  13          HG23      VAL  13 -24.129  15.496 -12.186
   92    H    VAL  14           HN       VAL  14 -23.385  14.688  -7.983
   93    HA   VAL  14           HA       VAL  14 -21.221  16.563  -7.351
   94    HB   VAL  14           HB       VAL  14 -21.979  15.133  -5.500
   95   HG11  VAL  14          HG11      VAL  14 -21.545  12.719  -5.524
   96   HG12  VAL  14          HG12      VAL  14 -21.065  12.833  -7.216
   97   HG13  VAL  14          HG13      VAL  14 -22.725  13.191  -6.749
   98   HG21  VAL  14          HG21      VAL  14 -19.198  14.505  -6.482
   99   HG22  VAL  14          HG22      VAL  14 -19.778  14.224  -4.840
  100   HG23  VAL  14          HG23      VAL  14 -19.679  15.868  -5.470
  101    H    LYS  15           HN       LYS  15 -19.258  16.452  -8.287
  102    HA   LYS  15           HA       LYS  15 -18.894  14.377 -10.360
  103    HB2  LYS  15           HB2      LYS  15 -19.389  16.519 -11.416
  104    HB3  LYS  15           HB1      LYS  15 -18.130  17.305 -10.475
  105    HG2  LYS  15           HG2      LYS  15 -17.341  16.943 -12.707
  106    HG3  LYS  15           HG1      LYS  15 -16.451  15.888 -11.607
  107    HD2  LYS  15           HD2      LYS  15 -17.967  14.034 -12.229
  108    HD3  LYS  15           HD1      LYS  15 -18.757  15.105 -13.391
  109    HE2  LYS  15           HE2      LYS  15 -17.163  13.757 -14.571
  110    HE3  LYS  15           HE1      LYS  15 -16.557  15.411 -14.511
  111    HZ1  LYS  15           HZ1      LYS  15 -15.660  13.101 -12.872
  112    HZ2  LYS  15           HZ2      LYS  15 -15.197  14.698 -12.557
  113    HZ3  LYS  15           HZ3      LYS  15 -14.760  13.969 -14.018
  114    H    GLY  16           HN       GLY  16 -17.031  13.263 -10.278
  115    HA2  GLY  16           HA2      GLY  16 -15.194  13.646  -8.143
  116    HA3  GLY  16           HA1      GLY  16 -14.961  12.581  -9.527
  117    H    GLY  17           HN       GLY  17 -13.433  14.875  -7.982
  118    HA2  GLY  17           HA2      GLY  17 -11.500  15.972  -8.803
  119    HA3  GLY  17           HA1      GLY  17 -12.186  15.926 -10.420
  120    H    ALA  18           HN       ALA  18 -14.766  16.854  -8.883
  121    HA   ALA  18           HA       ALA  18 -14.106  19.715  -9.016
  122    HB1  ALA  18           HB1      ALA  18 -16.818  18.383  -9.045
  123    HB2  ALA  18           HB2      ALA  18 -15.953  18.972 -10.464
  124    HB3  ALA  18           HB3      ALA  18 -16.506  20.109  -9.232
  125    H    PHE  19           HN       PHE  19 -13.176  19.957  -7.001
  126    HA   PHE  19           HA       PHE  19 -14.773  19.136  -4.676
  127    HD1  PHE  19           HD2      PHE  19 -13.781  17.427  -2.817
  128    HD2  PHE  19           HD1      PHE  19 -11.386  20.942  -2.815
  129    HE1  PHE  19           HE2      PHE  19 -13.702  17.363  -0.363
  130    HE2  PHE  19           HE1      PHE  19 -11.306  20.887  -0.356
  131    HZ   PHE  19           HZ       PHE  19 -12.464  19.099   0.877
  132    HB2  PHE  19           HB2      PHE  19 -12.487  18.210  -4.832
  133    HB3  PHE  19           HB1      PHE  19 -11.831  19.840  -4.826
  134    H    ASP  20           HN       ASP  20 -16.119  20.792  -4.289
  135    HA   ASP  20           HA       ASP  20 -14.872  23.387  -3.681
  136    HB2  ASP  20           HB2      ASP  20 -17.702  22.814  -4.581
  137    HB3  ASP  20           HB1      ASP  20 -17.155  24.381  -3.996
  138    H    GLY  21           HN       GLY  21 -15.410  24.390  -1.746
  139    HA2  GLY  21           HA2      GLY  21 -16.001  22.550   0.377
  140    HA3  GLY  21           HA1      GLY  21 -15.614  24.257   0.554
  141    H    THR  22           HN       THR  22 -17.939  22.057   1.130
  142    HA   THR  22           HA       THR  22 -20.217  23.770   0.521
  143    HB   THR  22           HB       THR  22 -21.538  21.881   1.546
  144    HG1  THR  22           HG1      THR  22 -20.234  20.693   2.779
  145   HG21  THR  22          HG21      THR  22 -21.240  20.368  -0.361
  146   HG22  THR  22          HG22      THR  22 -19.705  21.154  -0.740
  147   HG23  THR  22          HG23      THR  22 -21.211  22.056  -0.873
  148    H    MET  23           HN       MET  23 -21.728  24.393   2.182
  149    HA   MET  23           HA       MET  23 -20.392  25.163   4.643
  150    HB2  MET  23           HB2      MET  23 -23.150  25.806   3.578
  151    HB3  MET  23           HB1      MET  23 -22.487  26.447   5.075
  152    HG2  MET  23           HG2      MET  23 -20.695  27.535   3.804
  153    HG3  MET  23           HG1      MET  23 -21.389  26.913   2.308
  154    HE1  MET  23           HE1      MET  23 -23.707  27.676   1.313
  155    HE2  MET  23           HE2      MET  23 -24.797  28.811   2.111
  156    HE3  MET  23           HE3      MET  23 -24.520  27.213   2.808
  157    H    ASN  24           HN       ASN  24 -20.277  23.580   6.093
  158    HA   ASN  24           HA       ASN  24 -22.645  21.902   6.533
  159    HB2  ASN  24           HB2      ASN  24 -19.715  21.369   7.010
  160    HB3  ASN  24           HB1      ASN  24 -20.980  20.366   7.713
  161   HD21  ASN  24          HD21      ASN  24 -18.897  19.689   5.760
  162   HD22  ASN  24          HD22      ASN  24 -19.749  19.068   4.382
  163    H    GLY  25           HN       GLY  25 -23.580  21.778   8.484
  164    HA2  GLY  25           HA2      GLY  25 -23.302  21.955  10.928
  165    HA3  GLY  25           HA1      GLY  25 -22.411  23.432  10.620
  166    HA   PRO  26           HA       PRO  26 -26.350  25.709  10.416
  167    HB2  PRO  26           HB2      PRO  26 -26.924  25.604   7.526
  168    HB3  PRO  26           HB1      PRO  26 -26.674  27.006   8.572
  169    HG2  PRO  26           HG2      PRO  26 -24.837  26.263   6.766
  170    HG3  PRO  26           HG1      PRO  26 -24.373  26.927   8.344
  171    HD2  PRO  26           HD2      PRO  26 -24.411  24.077   7.424
  172    HD3  PRO  26           HD1      PRO  26 -23.197  24.929   8.403
  173    H    PHE  27           HN       PHE  27 -26.729  23.346   7.761
  174    HA   PHE  27           HA       PHE  27 -29.390  22.677   8.703
  175    HD1  PHE  27           HD1      PHE  27 -31.356  22.471   6.714
  176    HD2  PHE  27           HD2      PHE  27 -28.558  19.280   6.366
  177    HE1  PHE  27           HE1      PHE  27 -33.201  20.899   6.320
  178    HE2  PHE  27           HE2      PHE  27 -30.405  17.701   5.977
  179    HZ   PHE  27           HZ       PHE  27 -32.734  18.514   5.948
  180    HB2  PHE  27           HB2      PHE  27 -28.920  22.854   6.269
  181    HB3  PHE  27           HB1      PHE  27 -27.800  21.506   6.404
  182    H    GLY  28           HN       GLY  28 -29.402  21.466  10.497
  183    HA2  GLY  28           HA2      GLY  28 -27.364  19.653  11.235
  184    HA3  GLY  28           HA1      GLY  28 -28.962  19.750  11.960
  185    H    HIS  29           HN       HIS  29 -26.910  17.734  10.465
  186    HA   HIS  29           HA       HIS  29 -29.095  15.976   9.634
  187    HD1  HIS  29           HD1      HIS  29 -26.582  18.838   7.713
  188    HD2  HIS  29           HD2      HIS  29 -25.039  14.980   7.585
  189    HE1  HIS  29           HE1      HIS  29 -24.146  19.105   7.156
  190    HE2  HIS  29           HE2      HIS  29 -23.190  16.770   7.312
  191    HB2  HIS  29           HB2      HIS  29 -27.805  15.282   7.618
  192    HB3  HIS  29           HB1      HIS  29 -28.389  16.938   7.547
  193    H    GLY  30           HN       GLY  30 -28.862  13.962  10.400
  194    HA2  GLY  30           HA2      GLY  30 -26.269  13.318  11.647
  195    HA3  GLY  30           HA1      GLY  30 -27.826  12.728  12.213
  196    H    TYR  31           HN       TYR  31 -25.104  11.745  10.828
  197    HA   TYR  31           HA       TYR  31 -26.470   9.607   9.322
  198    HD1  TYR  31           HD1      TYR  31 -25.068  13.010   7.972
  199    HD2  TYR  31           HD2      TYR  31 -25.907   9.178   6.324
  200    HE1  TYR  31           HE1      TYR  31 -26.224  14.079   6.084
  201    HE2  TYR  31           HE2      TYR  31 -27.069  10.238   4.436
  202    HH   TYR  31           HH       TYR  31 -28.152  12.312   3.858
  203    HB2  TYR  31           HB2      TYR  31 -23.862  11.002   8.714
  204    HB3  TYR  31           HB1      TYR  31 -24.260   9.424   8.048
  205    H    GLY  32           HN       GLY  32 -26.459   7.904  10.664
  206    HA2  GLY  32           HA2      GLY  32 -24.325   7.327  12.477
  207    HA3  GLY  32           HA1      GLY  32 -25.638   6.242  12.038
  208    H    GLU  33           HN       GLU  33 -22.390   6.597  11.965
  209    HA   GLU  33           HA       GLU  33 -21.956   5.444   9.334
  210    HB2  GLU  33           HB2      GLU  33 -20.573   7.327   9.982
  211    HB3  GLU  33           HB1      GLU  33 -20.068   6.500  11.450
  212    HG2  GLU  33           HG2      GLU  33 -18.909   4.853  10.162
  213    HG3  GLU  33           HG1      GLU  33 -19.472   5.574   8.656
  214    H    GLY  34           HN       GLY  34 -21.889   3.319   9.089
  215    HA2  GLY  34           HA2      GLY  34 -21.564   1.561  11.372
  216    HA3  GLY  34           HA1      GLY  34 -21.918   1.074   9.720
  217    H    ALA  35           HN       ALA  35 -19.872   0.249  11.817
  218    HA   ALA  35           HA       ALA  35 -17.313   1.002  10.902
  219    HB1  ALA  35           HB1      ALA  35 -16.481  -0.853  12.227
  220    HB2  ALA  35           HB2      ALA  35 -18.107  -1.525  12.340
  221    HB3  ALA  35           HB3      ALA  35 -17.732   0.018  13.113
  222    H    GLY  36           HN       GLY  36 -16.285   0.481   9.107
  223    HA2  GLY  36           HA2      GLY  36 -17.386  -1.476   7.300
  224    HA3  GLY  36           HA1      GLY  36 -16.016  -0.416   6.984
  225    H    GLU  37           HN       GLU  37 -16.947  -3.507   7.507
  226    HA   GLU  37           HA       GLU  37 -14.712  -4.469   9.000
  227    HB2  GLU  37           HB2      GLU  37 -15.638  -6.671   8.458
  228    HB3  GLU  37           HB1      GLU  37 -16.873  -5.568   9.063
  229    HG2  GLU  37           HG2      GLU  37 -17.783  -5.253   6.907
  230    HG3  GLU  37           HG1      GLU  37 -16.406  -6.035   6.132
  231    H    GLY  38           HN       GLY  38 -13.048  -5.827   8.201
  232    HA2  GLY  38           HA2      GLY  38 -12.075  -5.072   5.596
  233    HA3  GLY  38           HA1      GLY  38 -11.277  -6.148   6.728
  234    H    ILE  39           HN       ILE  39 -14.094  -5.986   4.630
  235    HA   ILE  39           HA       ILE  39 -14.414  -8.728   4.219
  236    HB   ILE  39           HB       ILE  39 -15.254  -7.831   1.849
  237   HG12  ILE  39          HG12      ILE  39 -16.214  -5.568   2.077
  238   HG13  ILE  39          HG11      ILE  39 -15.389  -5.364   3.613
  239   HG21  ILE  39          HG21      ILE  39 -17.446  -7.487   2.868
  240   HG22  ILE  39          HG22      ILE  39 -16.688  -7.376   4.457
  241   HG23  ILE  39          HG23      ILE  39 -16.623  -8.890   3.553
  242   HD11  ILE  39          HD11      ILE  39 -14.060  -5.709   0.934
  243   HD12  ILE  39          HD12      ILE  39 -13.241  -5.459   2.478
  244   HD13  ILE  39          HD13      ILE  39 -14.265  -4.190   1.806
  245    H    ASP  40           HN       ASP  40 -13.769 -10.042   2.327
  246    HA   ASP  40           HA       ASP  40 -10.974  -9.633   1.799
  247    HB2  ASP  40           HB2      ASP  40 -12.953 -11.765   1.110
  248    HB3  ASP  40           HB1      ASP  40 -11.462 -11.671   0.184
  249    H    ASP  41           HN       ASP  41 -11.550  -7.491   0.832
  250    HA   ASP  41           HA       ASP  41 -11.205  -7.846  -2.043
  251    HB2  ASP  41           HB2      ASP  41 -13.669  -7.292  -1.555
  252    HB3  ASP  41           HB1      ASP  41 -13.089  -5.701  -1.074
  253    H    VAL  42           HN       VAL  42  -9.022  -7.349  -1.462
  254    HA   VAL  42           HA       VAL  42  -8.566  -4.793  -0.185
  255    HB   VAL  42           HB       VAL  42  -7.143  -6.558   0.581
  256   HG11  VAL  42          HG11      VAL  42  -6.251  -6.912  -2.274
  257   HG12  VAL  42          HG12      VAL  42  -7.199  -8.053  -1.317
  258   HG13  VAL  42          HG13      VAL  42  -5.528  -7.705  -0.878
  259   HG21  VAL  42          HG21      VAL  42  -6.145  -4.332   0.476
  260   HG22  VAL  42          HG22      VAL  42  -5.549  -4.669  -1.149
  261   HG23  VAL  42          HG23      VAL  42  -4.934  -5.588   0.225
  262    H    GLU  43           HN       GLU  43  -9.259  -3.307  -1.636
  263    HA   GLU  43           HA       GLU  43  -7.905  -3.149  -4.211
  264    HB2  GLU  43           HB2      GLU  43 -10.331  -2.679  -4.143
  265    HB3  GLU  43           HB1      GLU  43 -10.031  -1.350  -3.029
  266    HG2  GLU  43           HG2      GLU  43  -8.680  -0.234  -4.756
  267    HG3  GLU  43           HG1      GLU  43  -9.055  -1.546  -5.872
  268    H    TRP  44           HN       TRP  44  -5.813  -2.709  -3.498
  269    HA   TRP  44           HA       TRP  44  -5.471  -0.151  -2.131
  270    HD1  TRP  44           HD1      TRP  44  -3.662   1.361  -1.896
  271    HE1  TRP  44           HE1      TRP  44  -1.321   2.238  -1.321
  272    HE3  TRP  44           HE3      TRP  44  -1.234  -3.058  -1.451
  273    HZ2  TRP  44           HZ2      TRP  44   1.236   1.178  -0.755
  274    HZ3  TRP  44           HZ3      TRP  44   1.150  -3.067  -0.919
  275    HH2  TRP  44           HH2      TRP  44   2.364  -0.986  -0.556
  276    HB2  TRP  44           HB2      TRP  44  -4.167  -2.000  -1.205
  277    HB3  TRP  44           HB1      TRP  44  -3.436  -2.285  -2.790
  278    H    VAL  45           HN       VAL  45  -4.582   1.506  -3.018
  279    HA   VAL  45           HA       VAL  45  -4.851   1.927  -5.788
  280    HB   VAL  45           HB       VAL  45  -3.434   3.690  -3.808
  281   HG11  VAL  45          HG11      VAL  45  -4.405   5.523  -5.147
  282   HG12  VAL  45          HG12      VAL  45  -5.080   4.325  -6.255
  283   HG13  VAL  45          HG13      VAL  45  -3.332   4.491  -6.092
  284   HG21  VAL  45          HG21      VAL  45  -6.397   3.256  -4.147
  285   HG22  VAL  45          HG22      VAL  45  -5.715   4.677  -3.364
  286   HG23  VAL  45          HG23      VAL  45  -5.440   3.077  -2.674
  287    H    VAL  46           HN       VAL  46  -2.441   0.235  -4.360
  288    HA   VAL  46           HA       VAL  46  -0.281   1.458  -5.894
  289    HB   VAL  46           HB       VAL  46  -0.347  -0.081  -3.417
  290   HG11  VAL  46          HG11      VAL  46   1.656  -1.409  -3.728
  291   HG12  VAL  46          HG12      VAL  46   1.656  -1.041  -5.454
  292   HG13  VAL  46          HG13      VAL  46   0.345  -1.991  -4.755
  293   HG21  VAL  46          HG21      VAL  46   1.751   0.987  -3.058
  294   HG22  VAL  46          HG22      VAL  46   0.692   2.148  -3.861
  295   HG23  VAL  46          HG23      VAL  46   1.947   1.312  -4.776
  296    H    GLY  47           HN       GLY  47  -2.428  -1.217  -6.058
  297    HA2  GLY  47           HA2      GLY  47  -0.879  -2.882  -7.750
  298    HA3  GLY  47           HA1      GLY  47  -2.651  -2.875  -7.644
  299    H    LYS  48           HN       LYS  48  -2.269   0.159  -8.279
  300    HA   LYS  48           HA       LYS  48  -2.322  -0.214 -11.181
  301    HB2  LYS  48           HB2      LYS  48  -3.424   2.058 -11.121
  302    HB3  LYS  48           HB1      LYS  48  -4.354   0.731 -10.445
  303    HG2  LYS  48           HG2      LYS  48  -3.758   1.461  -8.203
  304    HG3  LYS  48           HG1      LYS  48  -2.767   2.759  -8.877
  305    HD2  LYS  48           HD2      LYS  48  -4.919   3.628  -8.174
  306    HD3  LYS  48           HD1      LYS  48  -4.779   3.710  -9.931
  307    HE2  LYS  48           HE2      LYS  48  -6.080   1.640 -10.113
  308    HE3  LYS  48           HE1      LYS  48  -6.251   1.599  -8.357
  309    HZ1  LYS  48           HZ1      LYS  48  -7.311   3.672 -10.205
  310    HZ2  LYS  48           HZ2      LYS  48  -7.383   3.774  -8.515
  311    HZ3  LYS  48           HZ3      LYS  48  -8.215   2.536  -9.327
  312    H    ASP  49           HN       ASP  49  -0.602   1.404  -8.624
  313    HA   ASP  49           HA       ASP  49   0.671   3.195 -10.583
  314    HB2  ASP  49           HB2      ASP  49  -0.618   4.068  -8.509
  315    HB3  ASP  49           HB1      ASP  49   0.784   3.537  -7.592
  316    H    LYS  50           HN       LYS  50   1.159   0.340  -9.211
  317    HA   LYS  50           HA       LYS  50   3.637   0.297  -8.006
  318    HB2  LYS  50           HB2      LYS  50   2.016  -1.611  -8.099
  319    HB3  LYS  50           HB1      LYS  50   2.482  -1.862  -9.780
  320    HG2  LYS  50           HG2      LYS  50   4.815  -2.229  -9.026
  321    HG3  LYS  50           HG1      LYS  50   4.255  -2.120  -7.358
  322    HD2  LYS  50           HD2      LYS  50   2.777  -4.035  -7.743
  323    HD3  LYS  50           HD1      LYS  50   3.344  -4.133  -9.410
  324    HE2  LYS  50           HE2      LYS  50   5.005  -4.508  -6.925
  325    HE3  LYS  50           HE1      LYS  50   4.492  -5.764  -8.047
  326    HZ1  LYS  50           HZ1      LYS  50   6.798  -5.056  -8.396
  327    HZ2  LYS  50           HZ2      LYS  50   6.258  -3.493  -8.765
  328    HZ3  LYS  50           HZ3      LYS  50   5.833  -4.788  -9.765
  329    HA   PRO  51           HA       PRO  51   5.527  -0.553 -12.499
  330    HB2  PRO  51           HB2      PRO  51   4.227   1.039 -14.375
  331    HB3  PRO  51           HB1      PRO  51   4.077  -0.715 -14.220
  332    HG2  PRO  51           HG2      PRO  51   2.280   1.440 -13.206
  333    HG3  PRO  51           HG1      PRO  51   1.864  -0.146 -13.884
  334    HD2  PRO  51           HD2      PRO  51   1.766   0.308 -11.251
  335    HD3  PRO  51           HD1      PRO  51   2.316  -1.255 -11.896
  336    H    THR  52           HN       THR  52   4.076   2.433 -11.363
  337    HA   THR  52           HA       THR  52   5.981   4.192 -12.540
  338    HB   THR  52           HB       THR  52   4.392   4.709 -10.022
  339    HG1  THR  52           HG1      THR  52   2.625   5.063 -11.210
  340   HG21  THR  52          HG21      THR  52   4.448   7.035 -10.816
  341   HG22  THR  52          HG22      THR  52   5.419   6.534 -12.200
  342   HG23  THR  52          HG23      THR  52   6.069   6.390 -10.565
  343    H    TYR  53           HN       TYR  53   5.589   2.634  -9.412
  344    HA   TYR  53           HA       TYR  53   7.950   3.812  -8.273
  345    HD1  TYR  53           HD2      TYR  53   6.420   5.053  -6.756
  346    HD2  TYR  53           HD1      TYR  53   4.339   1.352  -6.731
  347    HE1  TYR  53           HE2      TYR  53   4.355   6.214  -6.072
  348    HE2  TYR  53           HE1      TYR  53   2.283   2.499  -6.069
  349    HH   TYR  53           HH       TYR  53   1.729   5.610  -6.387
  350    HB2  TYR  53           HB2      TYR  53   6.522   1.342  -7.340
  351    HB3  TYR  53           HB1      TYR  53   7.486   2.446  -6.378
  352    H    ASP  54           HN       ASP  54   7.122   1.016 -10.127
  353    HA   ASP  54           HA       ASP  54   9.507  -0.490  -9.517
  354    HB2  ASP  54           HB2      ASP  54   7.463  -1.630 -10.206
  355    HB3  ASP  54           HB1      ASP  54   7.446  -0.756 -11.730
  356    H    GLU  55           HN       GLU  55   8.497   1.663 -12.167
  357    HA   GLU  55           HA       GLU  55  10.868   1.261 -13.679
  358    HB2  GLU  55           HB2      GLU  55  10.228   3.282 -14.889
  359    HB3  GLU  55           HB1      GLU  55   8.888   2.169 -14.711
  360    HG2  GLU  55           HG2      GLU  55   8.089   3.560 -12.785
  361    HG3  GLU  55           HG1      GLU  55   9.331   4.748 -13.251
  362    H    ILE  56           HN       ILE  56   9.999   3.557 -11.140
  363    HA   ILE  56           HA       ILE  56  12.510   4.908 -11.214
  364    HB   ILE  56           HB       ILE  56  10.651   4.621  -8.844
  365   HG12  ILE  56          HG12      ILE  56  10.712   6.833 -10.902
  366   HG13  ILE  56          HG11      ILE  56   9.596   5.464 -11.001
  367   HG21  ILE  56          HG21      ILE  56  11.648   6.765  -8.149
  368   HG22  ILE  56          HG22      ILE  56  12.724   6.702  -9.546
  369   HG23  ILE  56          HG23      ILE  56  12.858   5.489  -8.275
  370   HD11  ILE  56          HD11      ILE  56   8.472   7.354 -10.048
  371   HD12  ILE  56          HD12      ILE  56   9.727   7.529  -8.819
  372   HD13  ILE  56          HD13      ILE  56   8.677   6.113  -8.812
  373    H    PHE  57           HN       PHE  57  11.338   1.972  -9.804
  374    HA   PHE  57           HA       PHE  57  13.343   1.424  -7.932
  375    HD1  PHE  57           HD2      PHE  57  13.080  -0.678  -6.208
  376    HD2  PHE  57           HD1      PHE  57  12.405  -2.392 -10.041
  377    HE1  PHE  57           HE2      PHE  57  14.093  -2.785  -5.445
  378    HE2  PHE  57           HE1      PHE  57  13.408  -4.504  -9.285
  379    HZ   PHE  57           HZ       PHE  57  14.257  -4.702  -6.985
  380    HB2  PHE  57           HB2      PHE  57  11.313   0.170  -7.909
  381    HB3  PHE  57           HB1      PHE  57  11.529  -0.338  -9.576
  382    H    TYR  58           HN       TYR  58  13.065   0.269 -11.312
  383    HA   TYR  58           HA       TYR  58  15.677  -0.851 -11.345
  384    HD1  TYR  58           HD1      TYR  58  12.239  -1.564 -12.013
  385    HD2  TYR  58           HD2      TYR  58  15.733  -3.043 -13.923
  386    HE1  TYR  58           HE1      TYR  58  11.411  -3.855 -11.730
  387    HE2  TYR  58           HE2      TYR  58  14.920  -5.348 -13.644
  388    HH   TYR  58           HH       TYR  58  11.702  -5.993 -12.264
  389    HB2  TYR  58           HB2      TYR  58  13.728  -0.126 -13.522
  390    HB3  TYR  58           HB1      TYR  58  15.341  -0.746 -13.894
  391    H    THR  59           HN       THR  59  14.462   2.314 -11.771
  392    HA   THR  59           HA       THR  59  16.683   3.406 -13.177
  393    HB   THR  59           HB       THR  59  14.466   4.679 -11.569
  394    HG1  THR  59           HG1      THR  59  13.582   3.980 -13.409
  395   HG21  THR  59          HG21      THR  59  16.501   6.038 -13.337
  396   HG22  THR  59          HG22      THR  59  16.400   6.187 -11.581
  397   HG23  THR  59          HG23      THR  59  15.093   6.801 -12.595
  398    H    LEU  60           HN       LEU  60  16.009   2.719  -9.826
  399    HA   LEU  60           HA       LEU  60  18.258   4.294  -8.886
  400    HG   LEU  60           HG       LEU  60  15.290   4.571  -7.849
  401    HB2  LEU  60           HB2      LEU  60  16.330   2.467  -7.466
  402    HB3  LEU  60           HB1      LEU  60  17.699   3.221  -6.664
  403   HD11  LEU  60          HD11      LEU  60  16.453   4.554  -5.073
  404   HD12  LEU  60          HD12      LEU  60  15.073   3.600  -5.610
  405   HD13  LEU  60          HD13      LEU  60  14.970   5.362  -5.584
  406   HD21  LEU  60          HD21      LEU  60  17.294   5.857  -8.446
  407   HD22  LEU  60          HD22      LEU  60  17.781   5.876  -6.750
  408   HD23  LEU  60          HD23      LEU  60  16.305   6.699  -7.252
  409    H    SER  61           HN       SER  61  18.024   1.461 -10.455
  410    HA   SER  61           HA       SER  61  19.437  -0.259 -10.859
  411    HG   SER  61           HG       SER  61  22.809  -0.264  -9.811
  412    HB2  SER  61           HB2      SER  61  21.197   1.532 -10.692
  413    HB3  SER  61           HB1      SER  61  21.409   1.086  -9.003
  414    HA   PRO  62           HA       PRO  62  18.245  -2.398  -7.013
  415    HB2  PRO  62           HB2      PRO  62  16.804  -4.337  -8.178
  416    HB3  PRO  62           HB1      PRO  62  16.145  -2.714  -7.904
  417    HG2  PRO  62           HG2      PRO  62  17.191  -3.933 -10.421
  418    HG3  PRO  62           HG1      PRO  62  15.806  -2.853 -10.184
  419    HD2  PRO  62           HD2      PRO  62  18.307  -2.060 -11.076
  420    HD3  PRO  62           HD1      PRO  62  17.100  -0.989 -10.334
  421    H    VAL  63           HN       VAL  63  18.821  -4.482  -6.216
  422    HA   VAL  63           HA       VAL  63  20.684  -6.014  -7.894
  423    HB   VAL  63           HB       VAL  63  21.059  -5.351  -4.961
  424   HG11  VAL  63          HG11      VAL  63  23.201  -6.535  -5.175
  425   HG12  VAL  63          HG12      VAL  63  22.766  -7.006  -6.819
  426   HG13  VAL  63          HG13      VAL  63  21.820  -7.596  -5.451
  427   HG21  VAL  63          HG21      VAL  63  21.601  -3.456  -6.401
  428   HG22  VAL  63          HG22      VAL  63  22.671  -4.477  -7.362
  429   HG23  VAL  63          HG23      VAL  63  23.057  -4.135  -5.677
  430    H    ASN  64           HN       ASN  64  19.958  -8.006  -8.126
  431    HA   ASN  64           HA       ASN  64  19.178 -10.088  -7.668
  432    HB2  ASN  64           HB2      ASN  64  19.400  -9.172  -4.795
  433    HB3  ASN  64           HB1      ASN  64  19.069 -10.834  -5.299
  434   HD21  ASN  64          HD21      ASN  64  21.306  -9.461  -3.853
  435   HD22  ASN  64          HD22      ASN  64  22.733 -10.011  -4.668
  436    H    GLY  65           HN       GLY  65  17.347  -7.634  -7.817
  437    HA2  GLY  65           HA2      GLY  65  15.044  -7.838  -8.324
  438    HA3  GLY  65           HA1      GLY  65  14.953  -9.215  -7.236
  439    H    LYS  66           HN       LYS  66  16.635  -6.434  -6.141
  440    HA   LYS  66           HA       LYS  66  14.401  -4.983  -5.149
  441    HB2  LYS  66           HB2      LYS  66  14.638  -5.350  -2.828
  442    HB3  LYS  66           HB1      LYS  66  14.465  -6.925  -3.564
  443    HG2  LYS  66           HG2      LYS  66  17.190  -5.854  -3.045
  444    HG3  LYS  66           HG1      LYS  66  16.243  -6.487  -1.703
  445    HD2  LYS  66           HD2      LYS  66  16.541  -8.077  -4.202
  446    HD3  LYS  66           HD1      LYS  66  17.834  -8.052  -3.014
  447    HE2  LYS  66           HE2      LYS  66  16.555  -9.903  -2.428
  448    HE3  LYS  66           HE1      LYS  66  16.060  -8.651  -1.303
  449    HZ1  LYS  66           HZ1      LYS  66  14.563  -9.760  -3.592
  450    HZ2  LYS  66           HZ2      LYS  66  14.195  -8.225  -2.985
  451    HZ3  LYS  66           HZ3      LYS  66  14.076  -9.577  -1.974
  452    H    ILE  67           HN       ILE  67  15.108  -3.027  -3.991
  453    HA   ILE  67           HA       ILE  67  17.863  -2.348  -4.654
  454    HB   ILE  67           HB       ILE  67  17.173  -0.103  -3.554
  455   HG12  ILE  67          HG12      ILE  67  14.491  -1.422  -4.009
  456   HG13  ILE  67          HG11      ILE  67  15.122  -0.770  -2.500
  457   HG21  ILE  67          HG21      ILE  67  17.602  -0.428  -5.937
  458   HG22  ILE  67          HG22      ILE  67  16.237   0.657  -5.686
  459   HG23  ILE  67          HG23      ILE  67  15.954  -1.016  -6.167
  460   HD11  ILE  67          HD11      ILE  67  14.336   0.795  -4.952
  461   HD12  ILE  67          HD12      ILE  67  15.029   1.487  -3.483
  462   HD13  ILE  67          HD13      ILE  67  13.452   0.700  -3.428
  463    H    THR  68           HN       THR  68  19.493  -2.349  -3.263
  464    HA   THR  68           HA       THR  68  19.269  -3.157  -0.596
  465    HB   THR  68           HB       THR  68  21.532  -1.813  -0.416
  466    HG1  THR  68           HG1      THR  68  22.237  -0.971  -2.231
  467   HG21  THR  68          HG21      THR  68  21.367  -4.246  -0.461
  468   HG22  THR  68          HG22      THR  68  22.717  -3.695  -1.450
  469   HG23  THR  68          HG23      THR  68  21.217  -4.217  -2.218
  470    H    GLY  69           HN       GLY  69  18.829  -2.035   1.253
  471    HA2  GLY  69           HA2      GLY  69  16.971  -0.049   0.924
  472    HA3  GLY  69           HA1      GLY  69  17.712  -0.451   2.465
  473    H    ALA  70           HN       ALA  70  20.394   0.386   1.424
  474    HA   ALA  70           HA       ALA  70  20.567   3.026   2.200
  475    HB1  ALA  70           HB1      ALA  70  22.504   1.575   1.806
  476    HB2  ALA  70           HB2      ALA  70  22.673   3.134   0.999
  477    HB3  ALA  70           HB3      ALA  70  22.238   1.699   0.068
  478    H    ASN  71           HN       ASN  71  19.783   1.760  -1.002
  479    HA   ASN  71           HA       ASN  71  19.805   4.344  -2.285
  480    HB2  ASN  71           HB2      ASN  71  18.363   2.034  -3.502
  481    HB3  ASN  71           HB1      ASN  71  19.403   3.234  -4.263
  482   HD21  ASN  71          HD21      ASN  71  19.293   0.261  -4.271
  483   HD22  ASN  71          HD22      ASN  71  20.882  -0.256  -3.848
  484    H    ALA  72           HN       ALA  72  17.477   2.249  -0.779
  485    HA   ALA  72           HA       ALA  72  15.154   3.583  -1.805
  486    HB1  ALA  72           HB1      ALA  72  13.975   2.250  -0.074
  487    HB2  ALA  72           HB2      ALA  72  15.544   1.648   0.467
  488    HB3  ALA  72           HB3      ALA  72  14.973   1.281  -1.162
  489    H    LYS  73           HN       LYS  73  17.111   3.717   1.099
  490    HA   LYS  73           HA       LYS  73  15.584   5.665   2.464
  491    HB2  LYS  73           HB2      LYS  73  18.566   5.150   2.625
  492    HB3  LYS  73           HB1      LYS  73  17.624   6.079   3.782
  493    HG2  LYS  73           HG2      LYS  73  17.384   3.130   3.219
  494    HG3  LYS  73           HG1      LYS  73  18.069   3.885   4.660
  495    HD2  LYS  73           HD2      LYS  73  15.214   4.219   3.754
  496    HD3  LYS  73           HD1      LYS  73  15.743   3.046   4.953
  497    HE2  LYS  73           HE2      LYS  73  16.067   6.036   5.166
  498    HE3  LYS  73           HE1      LYS  73  14.818   5.085   5.974
  499    HZ1  LYS  73           HZ1      LYS  73  16.891   5.696   7.291
  500    HZ2  LYS  73           HZ2      LYS  73  17.697   4.517   6.384
  501    HZ3  LYS  73           HZ3      LYS  73  16.380   4.084   7.362
  502    H    LYS  74           HN       LYS  74  18.185   5.772   0.128
  503    HA   LYS  74           HA       LYS  74  18.677   8.503  -0.023
  504    HB2  LYS  74           HB2      LYS  74  19.779   6.482  -1.229
  505    HB3  LYS  74           HB1      LYS  74  18.550   6.745  -2.458
  506    HG2  LYS  74           HG2      LYS  74  20.579   7.836  -3.099
  507    HG3  LYS  74           HG1      LYS  74  19.355   9.054  -2.724
  508    HD2  LYS  74           HD2      LYS  74  21.514   9.650  -1.784
  509    HD3  LYS  74           HD1      LYS  74  20.338   9.362  -0.510
  510    HE2  LYS  74           HE2      LYS  74  22.471   8.331   0.069
  511    HE3  LYS  74           HE1      LYS  74  21.242   7.098  -0.200
  512    HZ1  LYS  74           HZ1      LYS  74  22.152   6.600  -2.327
  513    HZ2  LYS  74           HZ2      LYS  74  23.448   6.622  -1.228
  514    HZ3  LYS  74           HZ3      LYS  74  23.202   7.937  -2.270
  515    H    GLU  75           HN       GLU  75  16.305   6.534  -1.669
  516    HA   GLU  75           HA       GLU  75  15.082   8.478  -3.255
  517    HB2  GLU  75           HB2      GLU  75  14.918   5.830  -3.098
  518    HB3  GLU  75           HB1      GLU  75  13.502   6.208  -2.133
  519    HG2  GLU  75           HG2      GLU  75  13.374   5.793  -4.728
  520    HG3  GLU  75           HG1      GLU  75  12.311   6.934  -3.919
  521    H    MET  76           HN       MET  76  14.031   7.192  -0.093
  522    HA   MET  76           HA       MET  76  11.941   9.126   0.128
  523    HB2  MET  76           HB2      MET  76  11.898   8.287   2.561
  524    HB3  MET  76           HB1      MET  76  11.486   7.155   1.281
  525    HG2  MET  76           HG2      MET  76  13.697   6.190   1.382
  526    HG3  MET  76           HG1      MET  76  14.183   7.365   2.599
  527    HE1  MET  76           HE1      MET  76  10.859   5.214   2.180
  528    HE2  MET  76           HE2      MET  76  11.260   3.857   3.233
  529    HE3  MET  76           HE3      MET  76  12.205   4.150   1.774
  530    H    VAL  77           HN       VAL  77  15.296   9.195   0.828
  531    HA   VAL  77           HA       VAL  77  15.236  11.416   2.627
  532    HB   VAL  77           HB       VAL  77  17.378  10.062   1.050
  533   HG11  VAL  77          HG11      VAL  77  19.041  11.747   1.669
  534   HG12  VAL  77          HG12      VAL  77  17.764  12.781   2.310
  535   HG13  VAL  77          HG13      VAL  77  17.824  12.421   0.584
  536   HG21  VAL  77          HG21      VAL  77  16.826   9.296   3.290
  537   HG22  VAL  77          HG22      VAL  77  17.138  10.909   3.935
  538   HG23  VAL  77          HG23      VAL  77  18.456   9.965   3.242
  539    H    LYS  78           HN       LYS  78  15.824  11.128  -0.878
  540    HA   LYS  78           HA       LYS  78  16.092  13.929  -1.299
  541    HB2  LYS  78           HB2      LYS  78  15.945  13.417  -3.665
  542    HB3  LYS  78           HB1      LYS  78  16.975  12.230  -2.870
  543    HG2  LYS  78           HG2      LYS  78  15.103  10.660  -2.816
  544    HG3  LYS  78           HG1      LYS  78  14.094  11.851  -3.637
  545    HD2  LYS  78           HD2      LYS  78  14.881  10.293  -5.257
  546    HD3  LYS  78           HD1      LYS  78  15.703  11.830  -5.509
  547    HE2  LYS  78           HE2      LYS  78  17.730  11.030  -4.794
  548    HE3  LYS  78           HE1      LYS  78  17.000   9.786  -3.782
  549    HZ1  LYS  78           HZ1      LYS  78  16.501   8.474  -5.663
  550    HZ2  LYS  78           HZ2      LYS  78  18.121   8.954  -5.839
  551    HZ3  LYS  78           HZ3      LYS  78  16.910   9.716  -6.741
  552    H    SER  79           HN       SER  79  13.443  11.890  -0.756
  553    HA   SER  79           HA       SER  79  11.355  13.449  -1.838
  554    HG   SER  79           HG       SER  79  11.917  10.729  -1.572
  555    HB2  SER  79           HB2      SER  79  11.418  11.624   0.570
  556    HB3  SER  79           HB1      SER  79   9.948  12.241  -0.183
  557    H    LYS  80           HN       LYS  80  13.605  14.422   0.353
  558    HA   LYS  80           HA       LYS  80  13.846  16.457   1.350
  559    HB2  LYS  80           HB2      LYS  80  10.950  16.910   0.609
  560    HB3  LYS  80           HB1      LYS  80  12.016  18.122   1.309
  561    HG2  LYS  80           HG2      LYS  80  13.441  18.032  -0.653
  562    HG3  LYS  80           HG1      LYS  80  12.420  16.770  -1.350
  563    HD2  LYS  80           HD2      LYS  80  10.524  18.314  -1.351
  564    HD3  LYS  80           HD1      LYS  80  11.551  19.575  -0.667
  565    HE2  LYS  80           HE2      LYS  80  12.989  19.444  -2.671
  566    HE3  LYS  80           HE1      LYS  80  11.894  18.237  -3.351
  567    HZ1  LYS  80           HZ1      LYS  80  10.104  19.885  -3.244
  568    HZ2  LYS  80           HZ2      LYS  80  11.384  20.412  -4.222
  569    HZ3  LYS  80           HZ3      LYS  80  11.196  21.043  -2.659
  570    H    LEU  81           HN       LEU  81  13.304  14.153   2.858
  571    HA   LEU  81           HA       LEU  81  11.509  15.171   4.969
  572    HG   LEU  81           HG       LEU  81  11.055  13.031   2.577
  573    HB2  LEU  81           HB2      LEU  81  12.333  12.313   4.582
  574    HB3  LEU  81           HB1      LEU  81  11.045  12.937   5.595
  575   HD11  LEU  81          HD11      LEU  81   9.344  11.284   2.712
  576   HD12  LEU  81          HD12      LEU  81   9.602  11.176   4.452
  577   HD13  LEU  81          HD13      LEU  81  10.898  10.737   3.340
  578   HD21  LEU  81          HD21      LEU  81   8.937  13.700   4.610
  579   HD22  LEU  81          HD22      LEU  81   8.653  13.577   2.874
  580   HD23  LEU  81          HD23      LEU  81   9.739  14.817   3.508
  581    HA   PRO  82           HA       PRO  82  14.962  14.688   7.814
  582    HB2  PRO  82           HB2      PRO  82  13.628  14.696  10.137
  583    HB3  PRO  82           HB1      PRO  82  13.733  16.166   9.131
  584    HG2  PRO  82           HG2      PRO  82  11.483  14.208   9.402
  585    HG3  PRO  82           HG1      PRO  82  11.424  15.971   9.308
  586    HD2  PRO  82           HD2      PRO  82  10.955  14.272   7.205
  587    HD3  PRO  82           HD1      PRO  82  11.463  15.966   7.036
  588    H    ASN  83           HN       ASN  83  15.700  13.152   9.469
  589    HA   ASN  83           HA       ASN  83  15.459  10.513   8.658
  590    HB2  ASN  83           HB2      ASN  83  16.487  11.708  11.217
  591    HB3  ASN  83           HB1      ASN  83  16.476   9.969  10.955
  592   HD21  ASN  83          HD21      ASN  83  17.019  10.243   8.079
  593   HD22  ASN  83          HD22      ASN  83  18.692  10.663   7.961
  594    H    THR  84           HN       THR  84  13.553  12.249  11.026
  595    HA   THR  84           HA       THR  84  12.354  10.101  12.348
  596    HB   THR  84           HB       THR  84  10.876  12.625  11.629
  597    HG1  THR  84           HG1      THR  84  12.527  12.534  13.908
  598   HG21  THR  84          HG21      THR  84  10.941  10.958  14.149
  599   HG22  THR  84          HG22      THR  84   9.681  10.889  12.916
  600   HG23  THR  84          HG23      THR  84   9.918  12.364  13.853
  601    H    VAL  85           HN       VAL  85  11.182  11.935   9.525
  602    HA   VAL  85           HA       VAL  85   8.971  10.247   8.983
  603    HB   VAL  85           HB       VAL  85  10.408  12.046   7.029
  604   HG11  VAL  85          HG11      VAL  85   7.540  11.118   7.129
  605   HG12  VAL  85          HG12      VAL  85   8.784  10.454   6.071
  606   HG13  VAL  85          HG13      VAL  85   8.274  12.131   5.885
  607   HG21  VAL  85          HG21      VAL  85   9.831  13.278   9.060
  608   HG22  VAL  85          HG22      VAL  85   8.165  12.708   8.935
  609   HG23  VAL  85          HG23      VAL  85   8.826  13.782   7.702
  610    H    LEU  86           HN       LEU  86  12.252  10.444   7.677
  611    HA   LEU  86           HA       LEU  86  12.282   8.421   5.822
  612    HG   LEU  86           HG       LEU  86  15.697   9.798   5.836
  613    HB2  LEU  86           HB2      LEU  86  14.253   9.516   7.746
  614    HB3  LEU  86           HB1      LEU  86  14.640   7.950   7.037
  615   HD11  LEU  86          HD11      LEU  86  15.052   9.149   3.607
  616   HD12  LEU  86          HD12      LEU  86  13.551   8.455   4.226
  617   HD13  LEU  86          HD13      LEU  86  15.106   7.744   4.670
  618   HD21  LEU  86          HD21      LEU  86  12.897  10.687   5.193
  619   HD22  LEU  86          HD22      LEU  86  14.379  11.349   4.502
  620   HD23  LEU  86          HD23      LEU  86  14.045  11.539   6.225
  621    H    GLY  87           HN       GLY  87  12.855   8.090   9.310
  622    HA2  GLY  87           HA2      GLY  87  13.267   5.315   9.278
  623    HA3  GLY  87           HA1      GLY  87  12.873   6.277  10.693
  624    H    LYS  88           HN       LYS  88  10.291   7.193   9.937
  625    HA   LYS  88           HA       LYS  88   8.946   4.744  10.625
  626    HB2  LYS  88           HB2      LYS  88   7.002   6.029  11.115
  627    HB3  LYS  88           HB1      LYS  88   8.396   6.858  11.782
  628    HG2  LYS  88           HG2      LYS  88   8.296   8.543  10.134
  629    HG3  LYS  88           HG1      LYS  88   7.168   7.604   9.150
  630    HD2  LYS  88           HD2      LYS  88   5.463   7.810  10.856
  631    HD3  LYS  88           HD1      LYS  88   6.584   8.668  11.911
  632    HE2  LYS  88           HE2      LYS  88   6.679  10.525  10.365
  633    HE3  LYS  88           HE1      LYS  88   5.673   9.654   9.205
  634    HZ1  LYS  88           HZ1      LYS  88   4.701  10.212  11.930
  635    HZ2  LYS  88           HZ2      LYS  88   3.805   9.887  10.542
  636    HZ3  LYS  88           HZ3      LYS  88   4.576  11.386  10.724
  637    H    ILE  89           HN       ILE  89   9.205   6.734   7.751
  638    HA   ILE  89           HA       ILE  89   7.093   5.417   6.362
  639    HB   ILE  89           HB       ILE  89   9.463   7.007   5.427
  640   HG12  ILE  89          HG12      ILE  89   6.474   7.428   5.386
  641   HG13  ILE  89          HG11      ILE  89   7.655   8.287   6.371
  642   HG21  ILE  89          HG21      ILE  89   9.134   5.295   3.740
  643   HG22  ILE  89          HG22      ILE  89   8.592   6.860   3.138
  644   HG23  ILE  89          HG23      ILE  89   7.411   5.663   3.669
  645   HD11  ILE  89          HD11      ILE  89   8.607   9.282   4.377
  646   HD12  ILE  89          HD12      ILE  89   6.884   9.633   4.500
  647   HD13  ILE  89          HD13      ILE  89   7.456   8.401   3.374
  648    H    TRP  90           HN       TRP  90  10.573   4.886   6.642
  649    HA   TRP  90           HA       TRP  90  10.848   2.687   4.973
  650    HD1  TRP  90           HD1      TRP  90  13.051   0.824   8.341
  651    HE1  TRP  90           HE1      TRP  90  14.418  -1.040   7.188
  652    HE3  TRP  90           HE3      TRP  90  13.153   2.708   3.602
  653    HZ2  TRP  90           HZ2      TRP  90  15.396  -1.614   4.616
  654    HZ3  TRP  90           HZ3      TRP  90  14.320   1.441   1.862
  655    HH2  TRP  90           HH2      TRP  90  15.424  -0.676   2.358
  656    HB2  TRP  90           HB2      TRP  90  12.759   3.783   6.063
  657    HB3  TRP  90           HB1      TRP  90  12.215   3.185   7.627
  658    H    LYS  91           HN       LYS  91  10.221   2.683   8.476
  659    HA   LYS  91           HA       LYS  91  10.015  -0.142   8.584
  660    HB2  LYS  91           HB2      LYS  91   9.469   0.143  10.899
  661    HB3  LYS  91           HB1      LYS  91  10.684   1.346  10.485
  662    HG2  LYS  91           HG2      LYS  91   8.953   3.054  10.325
  663    HG3  LYS  91           HG1      LYS  91   7.727   1.853  10.723
  664    HD2  LYS  91           HD2      LYS  91   8.098   2.854  12.773
  665    HD3  LYS  91           HD1      LYS  91   9.172   1.458  12.844
  666    HE2  LYS  91           HE2      LYS  91  10.077   4.191  11.968
  667    HE3  LYS  91           HE1      LYS  91  10.140   3.646  13.641
  668    HZ1  LYS  91           HZ1      LYS  91  11.615   1.863  12.983
  669    HZ2  LYS  91           HZ2      LYS  91  12.257   3.358  12.502
  670    HZ3  LYS  91           HZ3      LYS  91  11.532   2.344  11.359
  671    H    LEU  92           HN       LEU  92   7.765   2.282   7.715
  672    HA   LEU  92           HA       LEU  92   5.431   0.751   8.452
  673    HG   LEU  92           HG       LEU  92   3.250   2.054   6.975
  674    HB2  LEU  92           HB2      LEU  92   5.656   3.316   8.295
  675    HB3  LEU  92           HB1      LEU  92   5.456   3.093   6.558
  676   HD11  LEU  92          HD11      LEU  92   2.247   2.198   9.197
  677   HD12  LEU  92          HD12      LEU  92   3.761   2.829   9.848
  678   HD13  LEU  92          HD13      LEU  92   3.687   1.180   9.221
  679   HD21  LEU  92          HD21      LEU  92   3.614   4.771   8.240
  680   HD22  LEU  92          HD22      LEU  92   2.093   4.106   7.646
  681   HD23  LEU  92          HD23      LEU  92   3.404   4.447   6.517
  682    H    ALA  93           HN       ALA  93   7.312   1.402   5.512
  683    HA   ALA  93           HA       ALA  93   5.484  -0.271   3.978
  684    HB1  ALA  93           HB1      ALA  93   6.931   0.319   2.056
  685    HB2  ALA  93           HB2      ALA  93   7.938   1.267   3.154
  686    HB3  ALA  93           HB3      ALA  93   6.250   1.717   2.887
  687    H    ASP  94           HN       ASP  94   8.739  -0.425   5.336
  688    HA   ASP  94           HA       ASP  94   9.274  -3.001   4.114
  689    HB2  ASP  94           HB2      ASP  94  11.100  -1.407   4.488
  690    HB3  ASP  94           HB1      ASP  94  10.841  -1.462   6.202
  691    H    VAL  95           HN       VAL  95   7.458  -4.091   4.902
  692    HA   VAL  95           HA       VAL  95   6.820  -4.404   7.638
  693    HB   VAL  95           HB       VAL  95   6.129  -6.347   5.432
  694   HG11  VAL  95          HG11      VAL  95   4.704  -5.619   7.988
  695   HG12  VAL  95          HG12      VAL  95   5.601  -7.109   7.690
  696   HG13  VAL  95          HG13      VAL  95   4.131  -6.766   6.777
  697   HG21  VAL  95          HG21      VAL  95   4.741  -3.779   6.178
  698   HG22  VAL  95          HG22      VAL  95   4.109  -4.995   5.069
  699   HG23  VAL  95          HG23      VAL  95   5.584  -4.116   4.665
  700    H    ASP  96           HN       ASP  96   9.091  -5.936   5.551
  701    HA   ASP  96           HA       ASP  96   9.450  -8.216   7.310
  702    HB2  ASP  96           HB2      ASP  96  11.373  -8.580   5.511
  703    HB3  ASP  96           HB1      ASP  96   9.689  -9.001   5.261
  704    H    LYS  97           HN       LYS  97  11.031  -5.206   6.517
  705    HA   LYS  97           HA       LYS  97  12.400  -4.027   7.817
  706    HB2  LYS  97           HB2      LYS  97  12.449  -6.138   9.943
  707    HB3  LYS  97           HB1      LYS  97  12.465  -4.386  10.130
  708    HG2  LYS  97           HG2      LYS  97  10.124  -4.385   9.246
  709    HG3  LYS  97           HG1      LYS  97  10.158  -6.135   9.348
  710    HD2  LYS  97           HD2      LYS  97   9.076  -5.185  11.312
  711    HD3  LYS  97           HD1      LYS  97  10.560  -6.034  11.741
  712    HE2  LYS  97           HE2      LYS  97  11.746  -3.920  11.915
  713    HE3  LYS  97           HE1      LYS  97  10.301  -3.045  11.409
  714    HZ1  LYS  97           HZ1      LYS  97  10.528  -2.956  13.794
  715    HZ2  LYS  97           HZ2      LYS  97  10.607  -4.645  13.897
  716    HZ3  LYS  97           HZ3      LYS  97   9.168  -3.893  13.407
  717    H    ASP  98           HN       ASP  98  13.526  -5.371   5.875
  718    HA   ASP  98           HA       ASP  98  15.738  -6.945   6.959
  719    HB2  ASP  98           HB2      ASP  98  15.931  -7.805   4.580
  720    HB3  ASP  98           HB1      ASP  98  14.474  -8.272   5.461
  721    H    GLY  99           HN       GLY  99  15.201  -3.875   5.942
  722    HA2  GLY  99           HA2      GLY  99  16.806  -2.209   5.538
  723    HA3  GLY  99           HA1      GLY  99  18.040  -3.456   5.592
  724    H    LEU 100           HN       LEU 100  15.447  -4.087   3.480
  725    HA   LEU 100           HA       LEU 100  16.528  -2.614   1.243
  726    HG   LEU 100           HG       LEU 100  16.242  -6.160   2.304
  727    HB2  LEU 100           HB2      LEU 100  16.717  -4.601  -0.208
  728    HB3  LEU 100           HB1      LEU 100  17.899  -4.577   1.083
  729   HD11  LEU 100          HD11      LEU 100  14.940  -7.578   0.807
  730   HD12  LEU 100          HD12      LEU 100  15.357  -6.531  -0.551
  731   HD13  LEU 100          HD13      LEU 100  14.374  -5.910   0.777
  732   HD21  LEU 100          HD21      LEU 100  18.450  -6.793   1.565
  733   HD22  LEU 100          HD22      LEU 100  17.854  -7.039  -0.076
  734   HD23  LEU 100          HD23      LEU 100  17.299  -8.088   1.231
  735    H    LEU 101           HN       LEU 101  15.080  -3.303  -0.786
  736    HA   LEU 101           HA       LEU 101  12.329  -3.640   0.028
  737    HG   LEU 101           HG       LEU 101  13.476  -0.827   1.260
  738    HB2  LEU 101           HB2      LEU 101  13.369  -1.042  -1.127
  739    HB3  LEU 101           HB1      LEU 101  11.668  -1.472  -1.072
  740   HD11  LEU 101          HD11      LEU 101  10.955   0.458   0.234
  741   HD12  LEU 101          HD12      LEU 101  12.588   1.047  -0.067
  742   HD13  LEU 101          HD13      LEU 101  11.947   1.019   1.579
  743   HD21  LEU 101          HD21      LEU 101  11.966  -2.670   1.889
  744   HD22  LEU 101          HD22      LEU 101  10.594  -1.706   1.348
  745   HD23  LEU 101          HD23      LEU 101  11.561  -1.168   2.726
  746    H    ASP 102           HN       ASP 102  11.630  -5.003  -1.520
  747    HA   ASP 102           HA       ASP 102  12.981  -5.101  -4.056
  748    HB2  ASP 102           HB2      ASP 102  11.838  -7.043  -4.438
  749    HB3  ASP 102           HB1      ASP 102  11.854  -7.022  -2.680
  750    H    ASP 103           HN       ASP 103  11.081  -5.381  -6.001
  751    HA   ASP 103           HA       ASP 103  10.475  -2.689  -6.556
  752    HB2  ASP 103           HB2      ASP 103   9.154  -3.544  -8.477
  753    HB3  ASP 103           HB1      ASP 103  10.787  -4.222  -8.387
  754    H    GLU 104           HN       GLU 104   8.608  -5.230  -5.078
  755    HA   GLU 104           HA       GLU 104   6.108  -3.838  -5.096
  756    HB2  GLU 104           HB2      GLU 104   6.417  -6.314  -4.907
  757    HB3  GLU 104           HB1      GLU 104   7.037  -6.072  -3.285
  758    HG2  GLU 104           HG2      GLU 104   4.902  -5.168  -2.575
  759    HG3  GLU 104           HG1      GLU 104   4.274  -5.343  -4.229
  760    H    GLU 105           HN       GLU 105   8.751  -4.222  -2.803
  761    HA   GLU 105           HA       GLU 105   7.607  -2.762  -0.677
  762    HB2  GLU 105           HB2      GLU 105  10.210  -3.874  -1.395
  763    HB3  GLU 105           HB1      GLU 105  10.306  -2.448  -0.373
  764    HG2  GLU 105           HG2      GLU 105   9.061  -3.475   1.338
  765    HG3  GLU 105           HG1      GLU 105   8.560  -4.794   0.278
  766    H    PHE 106           HN       PHE 106   9.682  -1.771  -3.382
  767    HA   PHE 106           HA       PHE 106   9.939   0.935  -2.591
  768    HD1  PHE 106           HD2      PHE 106   9.071   2.740  -4.530
  769    HD2  PHE 106           HD1      PHE 106  12.731   1.037  -5.825
  770    HE1  PHE 106           HE2      PHE 106   9.799   4.928  -5.398
  771    HE2  PHE 106           HE1      PHE 106  13.438   3.191  -6.703
  772    HZ   PHE 106           HZ       PHE 106  11.985   5.152  -6.477
  773    HB2  PHE 106           HB2      PHE 106  11.351  -0.168  -4.338
  774    HB3  PHE 106           HB1      PHE 106   9.971  -0.180  -5.417
  775    H    ALA 107           HN       ALA 107   7.571  -0.843  -4.506
  776    HA   ALA 107           HA       ALA 107   5.939   1.198  -5.372
  777    HB1  ALA 107           HB1      ALA 107   4.094  -0.418  -5.308
  778    HB2  ALA 107           HB2      ALA 107   5.086  -1.497  -4.324
  779    HB3  ALA 107           HB3      ALA 107   5.565  -1.125  -5.979
  780    H    LEU 108           HN       LEU 108   5.818  -0.463  -2.212
  781    HA   LEU 108           HA       LEU 108   3.782   1.257  -1.199
  782    HG   LEU 108           HG       LEU 108   2.686  -0.166   0.621
  783    HB2  LEU 108           HB2      LEU 108   4.673  -1.097  -0.360
  784    HB3  LEU 108           HB1      LEU 108   5.700  -0.081   0.650
  785   HD11  LEU 108          HD11      LEU 108   4.725  -0.903   2.686
  786   HD12  LEU 108          HD12      LEU 108   3.694  -2.002   1.768
  787   HD13  LEU 108          HD13      LEU 108   2.979  -0.887   2.932
  788   HD21  LEU 108          HD21      LEU 108   4.455   1.579   2.312
  789   HD22  LEU 108          HD22      LEU 108   2.696   1.457   2.389
  790   HD23  LEU 108          HD23      LEU 108   3.472   2.133   0.956
  791    H    ALA 109           HN       ALA 109   7.310   1.106  -0.659
  792    HA   ALA 109           HA       ALA 109   7.684   3.162   1.091
  793    HB1  ALA 109           HB1      ALA 109   9.478   1.752   0.211
  794    HB2  ALA 109           HB2      ALA 109   9.898   3.464   0.144
  795    HB3  ALA 109           HB3      ALA 109   9.402   2.620  -1.324
  796    H    ASN 110           HN       ASN 110   7.601   3.592  -2.450
  797    HA   ASN 110           HA       ASN 110   7.823   6.428  -2.297
  798    HB2  ASN 110           HB2      ASN 110   8.529   4.906  -4.230
  799    HB3  ASN 110           HB1      ASN 110   6.829   4.875  -4.674
  800   HD21  ASN 110          HD21      ASN 110   8.521   7.641  -3.312
  801   HD22  ASN 110          HD22      ASN 110   8.396   8.634  -4.718
  802    H    HIS 111           HN       HIS 111   5.250   4.104  -2.220
  803    HA   HIS 111           HA       HIS 111   3.155   5.852  -3.028
  804    HD1  HIS 111           HD1      HIS 111   0.800   4.466  -4.111
  805    HD2  HIS 111           HD2      HIS 111   0.642   4.059   0.023
  806    HE1  HIS 111           HE1      HIS 111  -1.623   4.762  -3.477
  807    HE2  HIS 111           HE2      HIS 111  -1.631   4.822  -0.966
  808    HB2  HIS 111           HB2      HIS 111   2.927   3.364  -2.975
  809    HB3  HIS 111           HB1      HIS 111   2.989   3.429  -1.212
  810    H    LEU 112           HN       LEU 112   4.539   4.929   0.090
  811    HA   LEU 112           HA       LEU 112   2.854   6.529   1.689
  812    HG   LEU 112           HG       LEU 112   3.936   3.702   2.207
  813    HB2  LEU 112           HB2      LEU 112   5.634   5.453   2.105
  814    HB3  LEU 112           HB1      LEU 112   4.783   6.383   3.336
  815   HD11  LEU 112          HD11      LEU 112   5.830   3.600   3.744
  816   HD12  LEU 112          HD12      LEU 112   4.377   2.909   4.467
  817   HD13  LEU 112          HD13      LEU 112   4.919   4.520   4.941
  818   HD21  LEU 112          HD21      LEU 112   2.004   5.112   2.680
  819   HD22  LEU 112          HD22      LEU 112   2.620   5.427   4.303
  820   HD23  LEU 112          HD23      LEU 112   2.139   3.793   3.841
  821    H    ILE 113           HN       ILE 113   5.816   7.151  -0.065
  822    HA   ILE 113           HA       ILE 113   6.407   9.687   0.953
  823    HB   ILE 113           HB       ILE 113   6.923   8.543  -1.786
  824   HG12  ILE 113          HG12      ILE 113   7.969   7.362   0.089
  825   HG13  ILE 113          HG11      ILE 113   9.181   8.168  -0.902
  826   HG21  ILE 113          HG21      ILE 113   8.604  10.317  -2.049
  827   HG22  ILE 113          HG22      ILE 113   8.052  11.049  -0.542
  828   HG23  ILE 113          HG23      ILE 113   6.970  10.968  -1.932
  829   HD11  ILE 113          HD11      ILE 113   9.316   9.965   0.741
  830   HD12  ILE 113          HD12      ILE 113   9.670   8.397   1.466
  831   HD13  ILE 113          HD13      ILE 113   8.098   9.155   1.724
  832    H    LYS 114           HN       LYS 114   4.473   8.802  -1.935
  833    HA   LYS 114           HA       LYS 114   3.693  11.534  -2.330
  834    HB2  LYS 114           HB2      LYS 114   2.082  10.655  -3.989
  835    HB3  LYS 114           HB1      LYS 114   3.728  10.110  -4.255
  836    HG2  LYS 114           HG2      LYS 114   3.098   7.957  -3.147
  837    HG3  LYS 114           HG1      LYS 114   1.429   8.532  -3.138
  838    HD2  LYS 114           HD2      LYS 114   3.139   8.244  -5.604
  839    HD3  LYS 114           HD1      LYS 114   1.940   7.070  -5.065
  840    HE2  LYS 114           HE2      LYS 114   0.161   8.639  -5.377
  841    HE3  LYS 114           HE1      LYS 114   1.299   9.948  -5.682
  842    HZ1  LYS 114           HZ1      LYS 114   0.245   9.006  -7.705
  843    HZ2  LYS 114           HZ2      LYS 114   1.060   7.547  -7.421
  844    HZ3  LYS 114           HZ3      LYS 114   1.940   8.965  -7.732
  845    H    VAL 115           HN       VAL 115   2.435   8.912  -0.444
  846    HA   VAL 115           HA       VAL 115  -0.106   9.939   0.184
  847    HB   VAL 115           HB       VAL 115   1.807   8.175   1.695
  848   HG11  VAL 115          HG11      VAL 115   0.650   9.532   3.387
  849   HG12  VAL 115          HG12      VAL 115   0.127   7.847   3.430
  850   HG13  VAL 115          HG13      VAL 115  -0.898   9.072   2.682
  851   HG21  VAL 115          HG21      VAL 115   0.563   7.213  -0.166
  852   HG22  VAL 115          HG22      VAL 115  -0.951   7.759   0.554
  853   HG23  VAL 115          HG23      VAL 115   0.019   6.531   1.367
  854    H    LYS 116           HN       LYS 116   3.075  10.528   1.749
  855    HA   LYS 116           HA       LYS 116   1.852  12.565   3.405
  856    HB2  LYS 116           HB2      LYS 116   4.031  12.855   4.396
  857    HB3  LYS 116           HB1      LYS 116   3.568  11.162   4.369
  858    HG2  LYS 116           HG2      LYS 116   5.225  10.589   2.967
  859    HG3  LYS 116           HG1      LYS 116   5.161  12.125   2.090
  860    HD2  LYS 116           HD2      LYS 116   6.246  11.750   4.871
  861    HD3  LYS 116           HD1      LYS 116   7.218  11.882   3.410
  862    HE2  LYS 116           HE2      LYS 116   5.360  13.971   4.540
  863    HE3  LYS 116           HE1      LYS 116   7.120  14.024   4.537
  864    HZ1  LYS 116           HZ1      LYS 116   6.937  13.944   2.037
  865    HZ2  LYS 116           HZ2      LYS 116   6.428  15.381   2.767
  866    HZ3  LYS 116           HZ3      LYS 116   5.282  14.257   2.225
  867    H    LEU 117           HN       LEU 117   2.807  12.456   0.289
  868    HA   LEU 117           HA       LEU 117   3.768  15.166   0.082
  869    HG   LEU 117           HG       LEU 117   2.688  15.646  -2.744
  870    HB2  LEU 117           HB2      LEU 117   4.440  13.492  -1.566
  871    HB3  LEU 117           HB1      LEU 117   2.750  13.229  -2.007
  872   HD11  LEU 117          HD11      LEU 117   5.675  15.379  -2.416
  873   HD12  LEU 117          HD12      LEU 117   4.612  16.475  -1.530
  874   HD13  LEU 117          HD13      LEU 117   4.853  16.688  -3.264
  875   HD21  LEU 117          HD21      LEU 117   2.842  13.839  -4.337
  876   HD22  LEU 117          HD22      LEU 117   4.589  13.758  -4.123
  877   HD23  LEU 117          HD23      LEU 117   3.855  15.186  -4.857
  878    H    GLU 118           HN       GLU 118   0.735  13.464   0.054
  879    HA   GLU 118           HA       GLU 118  -0.909  15.435  -1.087
  880    HB2  GLU 118           HB2      GLU 118  -1.565  13.407   1.055
  881    HB3  GLU 118           HB1      GLU 118  -2.754  14.354   0.175
  882    HG2  GLU 118           HG2      GLU 118  -1.880  13.301  -1.932
  883    HG3  GLU 118           HG1      GLU 118  -0.931  12.221  -0.900
  884    H    GLY 119           HN       GLY 119   0.666  15.315   1.970
  885    HA2  GLY 119           HA2      GLY 119   0.896  17.460   3.111
  886    HA3  GLY 119           HA1      GLY 119  -0.798  17.750   2.754
  887    H    HIS 120           HN       HIS 120  -0.311  14.533   3.623
  888    HA   HIS 120           HA       HIS 120  -0.665  15.158   6.473
  889    HD1  HIS 120           HD1      HIS 120  -2.241  11.427   7.327
  890    HD2  HIS 120           HD2      HIS 120  -2.033  12.076   3.217
  891    HE1  HIS 120           HE1      HIS 120  -2.294   9.151   6.280
  892    HE2  HIS 120           HE2      HIS 120  -2.419   9.585   3.788
  893    HB2  HIS 120           HB2      HIS 120  -2.500  13.836   6.726
  894    HB3  HIS 120           HB1      HIS 120  -2.737  14.246   5.037
  895    H    GLU 121           HN       GLU 121   0.622  14.041   7.847
  896    HA   GLU 121           HA       GLU 121   2.692  12.427   6.675
  897    HB2  GLU 121           HB2      GLU 121   3.659  12.327   8.898
  898    HB3  GLU 121           HB1      GLU 121   3.221  13.979   8.496
  899    HG2  GLU 121           HG2      GLU 121   1.704  14.110  10.148
  900    HG3  GLU 121           HG1      GLU 121   1.169  12.442   9.931
  901    H    LEU 122           HN       LEU 122   3.313  10.319   7.618
  902    HA   LEU 122           HA       LEU 122   1.135   8.527   7.426
  903    HG   LEU 122           HG       LEU 122   4.008   6.744   6.016
  904    HB2  LEU 122           HB2      LEU 122   4.023   8.110   8.107
  905    HB3  LEU 122           HB1      LEU 122   2.864   6.789   8.098
  906   HD11  LEU 122          HD11      LEU 122   1.337   8.068   5.565
  907   HD12  LEU 122          HD12      LEU 122   1.566   6.368   5.969
  908   HD13  LEU 122          HD13      LEU 122   2.190   7.004   4.447
  909   HD21  LEU 122          HD21      LEU 122   4.864   9.030   6.050
  910   HD22  LEU 122          HD22      LEU 122   3.251   9.629   5.672
  911   HD23  LEU 122          HD23      LEU 122   4.118   8.633   4.504
  912    HA   PRO 123           HA       PRO 123  -0.285   8.249  11.491
  913    HB2  PRO 123           HB2      PRO 123  -1.608   5.939  11.340
  914    HB3  PRO 123           HB1      PRO 123  -2.075   7.306  10.316
  915    HG2  PRO 123           HG2      PRO 123  -0.272   4.988   9.627
  916    HG3  PRO 123           HG1      PRO 123  -1.705   5.555   8.748
  917    HD2  PRO 123           HD2      PRO 123   0.771   6.285   8.041
  918    HD3  PRO 123           HD1      PRO 123  -0.578   7.428   7.935
  919    H    ALA 124           HN       ALA 124   2.202   6.263  10.448
  920    HA   ALA 124           HA       ALA 124   3.574   4.692  11.356
  921    HB1  ALA 124           HB1      ALA 124   3.833   6.296  13.195
  922    HB2  ALA 124           HB2      ALA 124   3.882   4.629  13.773
  923    HB3  ALA 124           HB3      ALA 124   2.425   5.596  13.996
  924    H    ASP 125           HN       ASP 125   0.668   4.281  10.735
  925    HA   ASP 125           HA       ASP 125   0.297   1.693  12.084
  926    HB2  ASP 125           HB2      ASP 125  -1.458   3.392  12.659
  927    HB3  ASP 125           HB1      ASP 125  -1.852   3.492  10.943
  928    H    LEU 126           HN       LEU 126  -0.364  -0.002  10.759
  929    HA   LEU 126           HA       LEU 126   0.055   0.479   7.889
  930    HG   LEU 126           HG       LEU 126   2.399  -0.619   7.294
  931    HB2  LEU 126           HB2      LEU 126   1.644  -1.026   9.485
  932    HB3  LEU 126           HB1      LEU 126   0.498  -2.246   8.957
  933   HD11  LEU 126          HD11      LEU 126   1.962  -3.585   7.583
  934   HD12  LEU 126          HD12      LEU 126   3.257  -2.647   8.324
  935   HD13  LEU 126          HD13      LEU 126   3.179  -2.805   6.570
  936   HD21  LEU 126          HD21      LEU 126   1.393  -1.555   5.300
  937   HD22  LEU 126          HD22      LEU 126   0.220  -0.584   6.193
  938   HD23  LEU 126          HD23      LEU 126   0.151  -2.346   6.275
  939    HA   PRO 127           HA       PRO 127  -4.140  -1.151   7.977
  940    HB2  PRO 127           HB2      PRO 127  -4.760   0.321   5.648
  941    HB3  PRO 127           HB1      PRO 127  -5.102   0.789   7.316
  942    HG2  PRO 127           HG2      PRO 127  -3.332   2.062   5.566
  943    HG3  PRO 127           HG1      PRO 127  -3.406   2.296   7.326
  944    HD2  PRO 127           HD2      PRO 127  -1.559   0.603   5.700
  945    HD3  PRO 127           HD1      PRO 127  -1.235   1.516   7.189
  946    HA   PRO 128           HA       PRO 128  -3.713  -4.523   5.173
  947    HB2  PRO 128           HB2      PRO 128  -6.433  -4.795   4.530
  948    HB3  PRO 128           HB1      PRO 128  -5.562  -5.616   5.835
  949    HG2  PRO 128           HG2      PRO 128  -7.332  -3.243   5.932
  950    HG3  PRO 128           HG1      PRO 128  -7.016  -4.470   7.167
  951    HD2  PRO 128           HD2      PRO 128  -6.009  -1.958   7.290
  952    HD3  PRO 128           HD1      PRO 128  -5.171  -3.363   7.975
  953    H    HIS 129           HN       HIS 129  -5.628  -1.719   4.146
  954    HA   HIS 129           HA       HIS 129  -5.469  -2.473   1.359
  955    HD1  HIS 129           HD1      HIS 129  -7.092  -0.007   4.571
  956    HD2  HIS 129           HD2      HIS 129  -5.582   2.138   1.340
  957    HE1  HIS 129           HE1      HIS 129  -6.642   2.311   5.435
  958    HE2  HIS 129           HE2      HIS 129  -6.077   3.655   3.381
  959    HB2  HIS 129           HB2      HIS 129  -6.563  -0.370   0.849
  960    HB3  HIS 129           HB1      HIS 129  -7.402  -1.139   2.173
  961    H    LEU 130           HN       LEU 130  -2.964  -1.968   3.028
  962    HA   LEU 130           HA       LEU 130  -1.649  -0.484   0.899
  963    HG   LEU 130           HG       LEU 130   0.048   1.161   1.310
  964    HB2  LEU 130           HB2      LEU 130  -2.350   0.941   3.016
  965    HB3  LEU 130           HB1      LEU 130  -0.861   0.262   3.646
  966   HD11  LEU 130          HD11      LEU 130  -2.165   3.059   2.053
  967   HD12  LEU 130          HD12      LEU 130  -2.090   2.063   0.598
  968   HD13  LEU 130          HD13      LEU 130  -0.909   3.346   0.850
  969   HD21  LEU 130          HD21      LEU 130   0.784   3.163   2.514
  970   HD22  LEU 130          HD22      LEU 130   1.022   1.668   3.421
  971   HD23  LEU 130          HD23      LEU 130  -0.320   2.743   3.828
  972    H    VAL 131           HN       VAL 131  -1.733  -3.224   2.589
  973    HA   VAL 131           HA       VAL 131   1.136  -3.341   3.084
  974    HB   VAL 131           HB       VAL 131  -0.752  -4.360   4.633
  975   HG11  VAL 131          HG11      VAL 131  -1.724  -5.830   2.971
  976   HG12  VAL 131          HG12      VAL 131  -1.042  -6.752   4.313
  977   HG13  VAL 131          HG13      VAL 131  -0.171  -6.653   2.780
  978   HG21  VAL 131          HG21      VAL 131   1.869  -5.732   4.071
  979   HG22  VAL 131          HG22      VAL 131   0.904  -5.930   5.533
  980   HG23  VAL 131          HG23      VAL 131   1.609  -4.361   5.147
  981    HA   PRO 132           HA       PRO 132   1.944  -4.810  -0.964
  982    HB2  PRO 132           HB2      PRO 132   4.164  -6.352   0.230
  983    HB3  PRO 132           HB1      PRO 132   4.209  -5.119  -1.031
  984    HG2  PRO 132           HG2      PRO 132   5.059  -4.648   1.477
  985    HG3  PRO 132           HG1      PRO 132   4.300  -3.393   0.484
  986    HD2  PRO 132           HD2      PRO 132   3.205  -4.934   2.772
  987    HD3  PRO 132           HD1      PRO 132   2.860  -3.266   2.246
  988    HA   PRO 133           HA       PRO 133  -0.229  -8.574  -1.531
  989    HB2  PRO 133           HB2      PRO 133   1.845  -8.974  -3.647
  990    HB3  PRO 133           HB1      PRO 133   0.087  -9.174  -3.732
  991    HG2  PRO 133           HG2      PRO 133   1.213  -6.982  -4.710
  992    HG3  PRO 133           HG1      PRO 133  -0.309  -6.885  -3.786
  993    HD2  PRO 133           HD2      PRO 133   2.459  -6.127  -2.968
  994    HD3  PRO 133           HD1      PRO 133   0.892  -5.412  -2.502
  995    H    SER 134           HN       SER 134   3.265  -8.751  -1.052
  996    HA   SER 134           HA       SER 134   3.201 -11.626  -0.815
  997    HG   SER 134           HG       SER 134   5.254  -8.662  -1.027
  998    HB2  SER 134           HB2      SER 134   5.604 -11.284  -0.027
  999    HB3  SER 134           HB1      SER 134   5.228 -10.757  -1.668
 1000    H    LYS 135           HN       LYS 135   2.736  -8.971   1.368
 1001    HA   LYS 135           HA       LYS 135   3.045 -10.830   3.632
 1002    HB2  LYS 135           HB2      LYS 135   3.499  -8.712   5.013
 1003    HB3  LYS 135           HB1      LYS 135   4.775  -9.308   3.966
 1004    HG2  LYS 135           HG2      LYS 135   2.908  -7.211   2.960
 1005    HG3  LYS 135           HG1      LYS 135   4.228  -6.773   4.047
 1006    HD2  LYS 135           HD2      LYS 135   4.625  -8.365   1.523
 1007    HD3  LYS 135           HD1      LYS 135   4.730  -6.605   1.582
 1008    HE2  LYS 135           HE2      LYS 135   6.516  -6.732   3.183
 1009    HE3  LYS 135           HE1      LYS 135   6.385  -8.486   3.251
 1010    HZ1  LYS 135           HZ1      LYS 135   8.221  -7.742   1.830
 1011    HZ2  LYS 135           HZ2      LYS 135   7.122  -6.936   0.818
 1012    HZ3  LYS 135           HZ3      LYS 135   7.066  -8.621   0.956
 1013    H    ARG 136           HN       ARG 136   0.676  -9.808   1.942
 1014    HA   ARG 136           HA       ARG 136  -1.089  -8.705   3.915
 1015    HE   ARG 136           HE       ARG 136  -3.897 -11.289   0.004
 1016    HB2  ARG 136           HB2      ARG 136  -2.784  -9.886   2.137
 1017    HB3  ARG 136           HB1      ARG 136  -2.100  -8.280   1.931
 1018    HG2  ARG 136           HG2      ARG 136  -0.557  -8.984   0.382
 1019    HG3  ARG 136           HG1      ARG 136  -0.627 -10.660   0.912
 1020    HD2  ARG 136           HD2      ARG 136  -2.935  -9.274  -0.427
 1021    HD3  ARG 136           HD1      ARG 136  -1.687 -10.141  -1.318
 1022   HH11  ARG 136          HH11      ARG 136  -0.463 -11.841  -0.552
 1023   HH12  ARG 136          HH12      ARG 136  -0.584 -13.567  -0.360
 1024   HH21  ARG 136          HH21      ARG 136  -4.042 -13.571   0.216
 1025   HH22  ARG 136          HH22      ARG 136  -2.618 -14.543   0.027
 1026    H    ARG 137           HN       ARG 137  -0.364 -10.259   5.586
 1027    HA   ARG 137           HA       ARG 137  -2.259 -12.410   5.822
 1028    HE   ARG 137           HE       ARG 137   1.702 -15.409   6.373
 1029    HB2  ARG 137           HB2      ARG 137  -0.458 -14.129   6.257
 1030    HB3  ARG 137           HB1      ARG 137  -0.649 -13.638   4.581
 1031    HG2  ARG 137           HG2      ARG 137   1.268 -12.039   4.961
 1032    HG3  ARG 137           HG1      ARG 137   1.529 -12.861   6.494
 1033    HD2  ARG 137           HD2      ARG 137   1.638 -14.075   3.752
 1034    HD3  ARG 137           HD1      ARG 137   2.992 -13.796   4.839
 1035   HH11  ARG 137          HH11      ARG 137   1.892 -15.613   2.876
 1036   HH12  ARG 137          HH12      ARG 137   1.533 -17.315   2.832
 1037   HH21  ARG 137          HH21      ARG 137   1.222 -17.635   6.321
 1038   HH22  ARG 137          HH22      ARG 137   1.171 -18.468   4.785
 1039    H    HIS 138           HN       HIS 138  -3.014 -12.055   7.791
 1040    HA   HIS 138           HA       HIS 138  -1.228 -11.171   9.919
 1041    HD1  HIS 138           HD1      HIS 138  -5.320  -9.014  10.054
 1042    HD2  HIS 138           HD2      HIS 138  -1.161  -8.983   9.834
 1043    HE1  HIS 138           HE1      HIS 138  -4.664  -6.615   9.731
 1044    HE2  HIS 138           HE2      HIS 138  -2.152  -6.585   9.777
 1045    HB2  HIS 138           HB2      HIS 138  -4.215 -11.365   9.685
 1046    HB3  HIS 138           HB1      HIS 138  -3.440 -11.185  11.254
 1047    H    GLU 139           HN       GLU 139  -0.180 -12.698  10.983
 1048    HA   GLU 139           HA       GLU 139  -1.565 -15.221  11.558
 1049    HB2  GLU 139           HB2      GLU 139   1.293 -14.934  10.604
 1050    HB3  GLU 139           HB1      GLU 139   0.549 -16.437  11.136
 1051    HG2  GLU 139           HG2      GLU 139  -0.984 -16.399   9.297
 1052    HG3  GLU 139           HG1      GLU 139  -0.430 -14.798   8.808
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  47.806   5.852 -10.043
    2    H2   GLY   1           HT2      GLY   1  48.847   6.559  -8.911
    3    H3   GLY   1           HT3      GLY   1  48.676   7.248 -10.450
    4    HA2  GLY   1           HA1      GLY   1  46.577   7.084  -8.362
    5    HA3  GLY   1           HA2      GLY   1  47.466   8.531  -8.814
    6    HA   PRO   2           HA       PRO   2  43.852   9.345 -11.259
    7    HB2  PRO   2           HB2      PRO   2  45.549  11.443 -12.451
    8    HB3  PRO   2           HB1      PRO   2  44.008  11.592 -11.608
    9    HG2  PRO   2           HG2      PRO   2  46.293  12.381 -10.462
   10    HG3  PRO   2           HG1      PRO   2  45.007  11.609  -9.512
   11    HD2  PRO   2           HD2      PRO   2  47.554  10.445 -10.561
   12    HD3  PRO   2           HD1      PRO   2  46.771  10.204  -8.986
   13    H    LEU   3           HN       LEU   3  46.921   9.842 -13.024
   14    HA   LEU   3           HA       LEU   3  45.646   8.890 -15.450
   15    HG   LEU   3           HG       LEU   3  49.309   8.954 -14.826
   16    HB2  LEU   3           HB2      LEU   3  47.603   9.635 -16.618
   17    HB3  LEU   3           HB1      LEU   3  47.102  10.892 -15.507
   18   HD11  LEU   3          HD11      LEU   3  49.563  11.646 -16.159
   19   HD12  LEU   3          HD12      LEU   3  49.913  10.086 -16.903
   20   HD13  LEU   3          HD13      LEU   3  50.892  10.662 -15.553
   21   HD21  LEU   3          HD21      LEU   3  49.999  10.755 -13.305
   22   HD22  LEU   3          HD22      LEU   3  48.371  10.179 -12.948
   23   HD23  LEU   3          HD23      LEU   3  48.598  11.703 -13.806
   24    H    GLY   4           HN       GLY   4  46.285   7.092 -16.634
   25    HA2  GLY   4           HA2      GLY   4  47.909   5.323 -17.026
   26    HA3  GLY   4           HA1      GLY   4  48.178   5.264 -15.288
   27    H    SER   5           HN       SER   5  45.081   5.640 -15.164
   28    HA   SER   5           HA       SER   5  44.555   2.809 -14.973
   29    HG   SER   5           HG       SER   5  44.691   3.870 -12.894
   30    HB2  SER   5           HB2      SER   5  42.715   5.149 -14.424
   31    HB3  SER   5           HB1      SER   5  42.464   3.477 -13.928
   32    H    GLU   6           HN       GLU   6  44.288   1.873 -16.911
   33    HA   GLU   6           HA       GLU   6  42.981   2.996 -19.138
   34    HB2  GLU   6           HB2      GLU   6  43.347   0.073 -18.452
   35    HB3  GLU   6           HB1      GLU   6  43.002   0.723 -20.047
   36    HG2  GLU   6           HG2      GLU   6  45.489   1.329 -18.467
   37    HG3  GLU   6           HG1      GLU   6  45.369   0.072 -19.694
   38    H    SER   7           HN       SER   7  40.854   2.964 -19.783
   39    HA   SER   7           HA       SER   7  38.959   2.304 -17.676
   40    HG   SER   7           HG       SER   7  36.641   4.501 -19.136
   41    HB2  SER   7           HB2      SER   7  38.901   4.508 -18.873
   42    HB3  SER   7           HB1      SER   7  38.426   3.647 -20.336
   43    H    LEU   8           HN       LEU   8  38.125   0.350 -17.619
   44    HA   LEU   8           HA       LEU   8  37.248  -0.888 -20.138
   45    HG   LEU   8           HG       LEU   8  40.190  -1.362 -19.365
   46    HB2  LEU   8           HB2      LEU   8  38.536  -2.273 -17.780
   47    HB3  LEU   8           HB1      LEU   8  37.741  -3.107 -19.101
   48   HD11  LEU   8          HD11      LEU   8  40.649  -3.430 -18.156
   49   HD12  LEU   8          HD12      LEU   8  41.379  -3.458 -19.761
   50   HD13  LEU   8          HD13      LEU   8  39.898  -4.365 -19.450
   51   HD21  LEU   8          HD21      LEU   8  40.304  -2.263 -21.646
   52   HD22  LEU   8          HD22      LEU   8  38.827  -1.337 -21.378
   53   HD23  LEU   8          HD23      LEU   8  38.771  -3.099 -21.384
   54    H    MET   9           HN       MET   9  35.218  -1.797 -20.090
   55    HA   MET   9           HA       MET   9  33.595  -1.154 -17.775
   56    HB2  MET   9           HB2      MET   9  32.914  -2.296 -20.480
   57    HB3  MET   9           HB1      MET   9  31.722  -2.060 -19.209
   58    HG2  MET   9           HG2      MET   9  32.241   0.333 -19.179
   59    HG3  MET   9           HG1      MET   9  33.405   0.090 -20.477
   60    HE1  MET   9           HE1      MET   9  30.994   2.215 -20.513
   61    HE2  MET   9           HE2      MET   9  30.439   2.041 -22.176
   62    HE3  MET   9           HE3      MET   9  32.166   2.046 -21.818
   63    HA   PRO  10           HA       PRO  10  34.213  -4.844 -15.592
   64    HB2  PRO  10           HB2      PRO  10  31.334  -4.589 -14.858
   65    HB3  PRO  10           HB1      PRO  10  32.752  -4.778 -13.818
   66    HG2  PRO  10           HG2      PRO  10  31.575  -2.405 -14.064
   67    HG3  PRO  10           HG1      PRO  10  33.340  -2.537 -13.997
   68    HD2  PRO  10           HD2      PRO  10  31.569  -2.038 -16.344
   69    HD3  PRO  10           HD1      PRO  10  33.174  -1.378 -15.979
   70    H    SER  11           HN       SER  11  30.783  -5.108 -16.494
   71    HA   SER  11           HA       SER  11  31.318  -7.802 -17.456
   72    HG   SER  11           HG       SER  11  28.385  -5.557 -17.252
   73    HB2  SER  11           HB2      SER  11  28.704  -7.759 -17.606
   74    HB3  SER  11           HB1      SER  11  29.487  -7.880 -16.031
   75    H    GLN  12           HN       GLN  12  32.313  -7.380 -19.396
   76    HA   GLN  12           HA       GLN  12  30.697  -6.039 -21.448
   77    HB2  GLN  12           HB2      GLN  12  32.960  -5.151 -21.211
   78    HB3  GLN  12           HB1      GLN  12  33.636  -6.758 -21.434
   79    HG2  GLN  12           HG2      GLN  12  33.833  -5.381 -23.443
   80    HG3  GLN  12           HG1      GLN  12  32.842  -6.812 -23.716
   81   HE21  GLN  12          HE21      GLN  12  31.812  -5.899 -25.489
   82   HE22  GLN  12          HE22      GLN  12  30.633  -4.640 -25.315
   83    H    VAL  13           HN       VAL  13  29.298  -7.638 -22.001
   84    HA   VAL  13           HA       VAL  13  30.488 -10.057 -23.183
   85    HB   VAL  13           HB       VAL  13  29.213 -10.648 -21.181
   86   HG11  VAL  13          HG11      VAL  13  26.882  -9.306 -22.538
   87   HG12  VAL  13          HG12      VAL  13  27.687  -8.785 -21.058
   88   HG13  VAL  13          HG13      VAL  13  26.781 -10.296 -21.082
   89   HG21  VAL  13          HG21      VAL  13  27.815 -11.437 -23.729
   90   HG22  VAL  13          HG22      VAL  13  27.671 -12.270 -22.181
   91   HG23  VAL  13          HG23      VAL  13  29.223 -12.221 -23.016
   92    H    VAL  14           HN       VAL  14  29.869 -10.554 -25.256
   93    HA   VAL  14           HA       VAL  14  27.971  -8.679 -26.487
   94    HB   VAL  14           HB       VAL  14  30.158  -8.109 -27.260
   95   HG11  VAL  14          HG11      VAL  14  31.335 -10.172 -26.753
   96   HG12  VAL  14          HG12      VAL  14  31.628  -9.684 -28.422
   97   HG13  VAL  14          HG13      VAL  14  30.498 -10.992 -28.072
   98   HG21  VAL  14          HG21      VAL  14  28.415  -7.981 -28.922
   99   HG22  VAL  14          HG22      VAL  14  28.663  -9.671 -29.356
  100   HG23  VAL  14          HG23      VAL  14  29.925  -8.482 -29.685
  101    H    LYS  15           HN       LYS  15  26.162  -9.688 -26.933
  102    HA   LYS  15           HA       LYS  15  26.244 -12.438 -27.957
  103    HB2  LYS  15           HB2      LYS  15  23.846 -10.794 -27.106
  104    HB3  LYS  15           HB1      LYS  15  23.844 -12.499 -27.524
  105    HG2  LYS  15           HG2      LYS  15  25.170 -13.030 -25.588
  106    HG3  LYS  15           HG1      LYS  15  25.339 -11.320 -25.193
  107    HD2  LYS  15           HD2      LYS  15  22.865 -11.197 -24.937
  108    HD3  LYS  15           HD1      LYS  15  22.793 -12.942 -25.185
  109    HE2  LYS  15           HE2      LYS  15  24.317 -11.556 -22.979
  110    HE3  LYS  15           HE1      LYS  15  22.735 -12.317 -22.797
  111    HZ1  LYS  15           HZ1      LYS  15  25.150 -13.778 -23.709
  112    HZ2  LYS  15           HZ2      LYS  15  23.668 -14.442 -23.226
  113    HZ3  LYS  15           HZ3      LYS  15  24.679 -13.692 -22.084
  114    H    GLY  16           HN       GLY  16  27.139 -11.679 -29.978
  115    HA2  GLY  16           HA2      GLY  16  25.780  -9.671 -31.501
  116    HA3  GLY  16           HA1      GLY  16  27.126 -10.658 -32.042
  117    H    GLY  17           HN       GLY  17  23.781 -10.123 -32.191
  118    HA2  GLY  17           HA2      GLY  17  22.171 -10.980 -33.574
  119    HA3  GLY  17           HA1      GLY  17  23.464 -11.768 -34.462
  120    H    ALA  18           HN       ALA  18  22.979 -12.384 -31.082
  121    HA   ALA  18           HA       ALA  18  21.799 -14.996 -31.746
  122    HB1  ALA  18           HB1      ALA  18  24.188 -15.258 -31.224
  123    HB2  ALA  18           HB2      ALA  18  23.160 -16.044 -30.028
  124    HB3  ALA  18           HB3      ALA  18  23.917 -14.497 -29.655
  125    H    PHE  19           HN       PHE  19  19.943 -15.351 -30.746
  126    HA   PHE  19           HA       PHE  19  19.045 -13.522 -28.698
  127    HD1  PHE  19           HD2      PHE  19  16.596 -12.477 -28.842
  128    HD2  PHE  19           HD1      PHE  19  16.164 -16.683 -28.331
  129    HE1  PHE  19           HE2      PHE  19  14.730 -12.091 -27.288
  130    HE2  PHE  19           HE1      PHE  19  14.290 -16.301 -26.777
  131    HZ   PHE  19           HZ       PHE  19  13.575 -13.970 -26.260
  132    HB2  PHE  19           HB2      PHE  19  17.508 -14.218 -30.503
  133    HB3  PHE  19           HB1      PHE  19  17.618 -15.883 -29.944
  134    H    ASP  20           HN       ASP  20  19.852 -13.878 -26.740
  135    HA   ASP  20           HA       ASP  20  20.120 -16.590 -25.702
  136    HB2  ASP  20           HB2      ASP  20  21.825 -14.701 -25.341
  137    HB3  ASP  20           HB1      ASP  20  20.659 -14.016 -24.216
  138    H    GLY  21           HN       GLY  21  18.049 -17.328 -25.365
  139    HA2  GLY  21           HA2      GLY  21  16.221 -15.574 -23.858
  140    HA3  GLY  21           HA1      GLY  21  15.717 -16.850 -24.959
  141    H    THR  22           HN       THR  22  15.685 -16.086 -21.871
  142    HA   THR  22           HA       THR  22  15.484 -18.879 -21.099
  143    HB   THR  22           HB       THR  22  17.157 -16.925 -19.508
  144    HG1  THR  22           HG1      THR  22  17.763 -18.581 -21.568
  145   HG21  THR  22          HG21      THR  22  16.539 -19.853 -19.072
  146   HG22  THR  22          HG22      THR  22  15.978 -18.506 -18.080
  147   HG23  THR  22          HG23      THR  22  17.695 -18.910 -18.135
  148    H    MET  23           HN       MET  23  13.372 -18.858 -20.628
  149    HA   MET  23           HA       MET  23  12.523 -17.379 -18.304
  150    HB2  MET  23           HB2      MET  23  10.504 -16.436 -19.411
  151    HB3  MET  23           HB1      MET  23  12.010 -15.716 -19.956
  152    HG2  MET  23           HG2      MET  23  11.929 -17.086 -21.978
  153    HG3  MET  23           HG1      MET  23  10.412 -17.794 -21.433
  154    HE1  MET  23           HE1      MET  23   8.094 -14.605 -21.370
  155    HE2  MET  23           HE2      MET  23   9.061 -15.275 -20.059
  156    HE3  MET  23           HE3      MET  23   8.146 -16.349 -21.117
  157    H    ASN  24           HN       ASN  24  11.546 -18.809 -17.086
  158    HA   ASN  24           HA       ASN  24  10.028 -20.976 -18.372
  159    HB2  ASN  24           HB2      ASN  24  11.333 -20.883 -15.643
  160    HB3  ASN  24           HB1      ASN  24  10.324 -22.205 -16.215
  161   HD21  ASN  24          HD21      ASN  24  11.424 -21.928 -18.958
  162   HD22  ASN  24          HD22      ASN  24  12.995 -22.652 -18.891
  163    H    GLY  25           HN       GLY  25   7.902 -21.192 -17.939
  164    HA2  GLY  25           HA2      GLY  25   6.040 -20.934 -16.407
  165    HA3  GLY  25           HA1      GLY  25   6.760 -19.428 -15.880
  166    HA   PRO  26           HA       PRO  26   4.894 -17.519 -19.657
  167    HB2  PRO  26           HB2      PRO  26   5.401 -19.107 -22.054
  168    HB3  PRO  26           HB1      PRO  26   5.933 -17.468 -21.675
  169    HG2  PRO  26           HG2      PRO  26   7.641 -19.559 -21.813
  170    HG3  PRO  26           HG1      PRO  26   7.900 -18.183 -20.723
  171    HD2  PRO  26           HD2      PRO  26   6.778 -20.896 -20.122
  172    HD3  PRO  26           HD1      PRO  26   7.948 -19.935 -19.195
  173    H    PHE  27           HN       PHE  27   4.714 -20.878 -20.836
  174    HA   PHE  27           HA       PHE  27   1.801 -20.777 -20.439
  175    HD1  PHE  27           HD2      PHE  27   0.134 -20.131 -22.616
  176    HD2  PHE  27           HD1      PHE  27   4.205 -20.232 -23.864
  177    HE1  PHE  27           HE2      PHE  27  -0.223 -18.083 -23.934
  178    HE2  PHE  27           HE1      PHE  27   3.852 -18.184 -25.180
  179    HZ   PHE  27           HZ       PHE  27   1.632 -17.122 -25.241
  180    HB2  PHE  27           HB2      PHE  27   3.264 -22.080 -22.751
  181    HB3  PHE  27           HB1      PHE  27   1.535 -22.189 -22.452
  182    H    GLY  28           HN       GLY  28   0.894 -22.612 -19.575
  183    HA2  GLY  28           HA2      GLY  28   2.806 -24.673 -18.704
  184    HA3  GLY  28           HA1      GLY  28   1.325 -24.257 -17.853
  185    H    HIS  29           HN       HIS  29   1.794 -26.877 -18.403
  186    HA   HIS  29           HA       HIS  29   0.431 -27.603 -20.842
  187    HD1  HIS  29           HD1      HIS  29   3.777 -29.841 -18.655
  188    HD2  HIS  29           HD2      HIS  29   2.236 -28.647 -22.333
  189    HE1  HIS  29           HE1      HIS  29   5.726 -29.836 -20.243
  190    HE2  HIS  29           HE2      HIS  29   4.740 -29.299 -22.498
  191    HB2  HIS  29           HB2      HIS  29   1.377 -29.265 -18.501
  192    HB3  HIS  29           HB1      HIS  29   0.590 -29.939 -19.924
  193    H    GLY  30           HN       GLY  30  -1.502 -29.089 -20.719
  194    HA2  GLY  30           HA2      GLY  30  -3.640 -27.674 -19.611
  195    HA3  GLY  30           HA1      GLY  30  -3.731 -29.311 -20.240
  196    H    TYR  31           HN       TYR  31  -3.542 -27.333 -17.425
  197    HA   TYR  31           HA       TYR  31  -3.707 -29.703 -15.709
  198    HD1  TYR  31           HD1      TYR  31  -1.843 -26.197 -16.592
  199    HD2  TYR  31           HD2      TYR  31  -4.559 -26.151 -13.318
  200    HE1  TYR  31           HE1      TYR  31  -2.057 -23.756 -16.810
  201    HE2  TYR  31           HE2      TYR  31  -4.773 -23.715 -13.524
  202    HH   TYR  31           HH       TYR  31  -3.896 -22.011 -16.188
  203    HB2  TYR  31           HB2      TYR  31  -3.372 -28.126 -13.825
  204    HB3  TYR  31           HB1      TYR  31  -2.034 -28.122 -14.964
  205    H    GLY  32           HN       GLY  32  -5.246 -29.297 -13.736
  206    HA2  GLY  32           HA2      GLY  32  -7.846 -29.413 -14.804
  207    HA3  GLY  32           HA1      GLY  32  -7.447 -29.297 -13.098
  208    H    GLU  33           HN       GLU  33  -9.462 -27.998 -15.034
  209    HA   GLU  33           HA       GLU  33  -8.984 -25.236 -15.120
  210    HB2  GLU  33           HB2      GLU  33 -11.519 -25.093 -15.306
  211    HB3  GLU  33           HB1      GLU  33 -10.693 -26.066 -16.516
  212    HG2  GLU  33           HG2      GLU  33 -11.267 -28.090 -15.223
  213    HG3  GLU  33           HG1      GLU  33 -12.177 -27.081 -14.098
  214    H    GLY  34           HN       GLY  34  -9.256 -23.620 -13.677
  215    HA2  GLY  34           HA2      GLY  34  -9.796 -24.511 -10.926
  216    HA3  GLY  34           HA1      GLY  34  -8.739 -23.179 -11.364
  217    H    ALA  35           HN       ALA  35 -11.307 -23.620  -9.705
  218    HA   ALA  35           HA       ALA  35 -12.986 -21.529 -10.872
  219    HB1  ALA  35           HB1      ALA  35 -14.558 -22.082  -9.086
  220    HB2  ALA  35           HB2      ALA  35 -13.386 -23.203  -8.396
  221    HB3  ALA  35           HB3      ALA  35 -14.085 -23.527  -9.981
  222    H    GLY  36           HN       GLY  36 -13.689 -19.739  -9.451
  223    HA2  GLY  36           HA2      GLY  36 -11.445 -18.482  -8.195
  224    HA3  GLY  36           HA1      GLY  36 -13.073 -17.833  -8.305
  225    H    GLU  37           HN       GLU  37 -10.761 -19.327  -6.320
  226    HA   GLU  37           HA       GLU  37 -12.676 -19.936  -4.198
  227    HB2  GLU  37           HB2      GLU  37 -10.368 -21.173  -5.002
  228    HB3  GLU  37           HB1      GLU  37  -9.784 -20.188  -3.671
  229    HG2  GLU  37           HG2      GLU  37 -12.197 -21.895  -3.289
  230    HG3  GLU  37           HG1      GLU  37 -10.593 -22.625  -3.263
  231    H    GLY  38           HN       GLY  38 -11.536 -19.221  -1.901
  232    HA2  GLY  38           HA2      GLY  38 -11.696 -16.346  -1.992
  233    HA3  GLY  38           HA1      GLY  38 -11.472 -17.321  -0.550
  234    H    ILE  39           HN       ILE  39  -9.803 -16.366  -3.473
  235    HA   ILE  39           HA       ILE  39  -7.186 -16.489  -2.460
  236    HB   ILE  39           HB       ILE  39  -6.666 -14.862  -4.307
  237   HG12  ILE  39          HG12      ILE  39  -9.657 -15.077  -4.708
  238   HG13  ILE  39          HG11      ILE  39  -8.715 -13.618  -4.435
  239   HG21  ILE  39          HG21      ILE  39  -6.557 -17.279  -4.624
  240   HG22  ILE  39          HG22      ILE  39  -7.089 -16.466  -6.094
  241   HG23  ILE  39          HG23      ILE  39  -8.261 -17.304  -5.077
  242   HD11  ILE  39          HD11      ILE  39  -9.385 -13.755  -6.733
  243   HD12  ILE  39          HD12      ILE  39  -8.653 -15.350  -6.886
  244   HD13  ILE  39          HD13      ILE  39  -7.635 -13.933  -6.617
  245    H    ASP  40           HN       ASP  40  -5.816 -14.640  -1.880
  246    HA   ASP  40           HA       ASP  40  -7.159 -13.026   0.049
  247    HB2  ASP  40           HB2      ASP  40  -4.855 -12.012   0.372
  248    HB3  ASP  40           HB1      ASP  40  -4.972 -13.746   0.642
  249    H    ASP  41           HN       ASP  41  -8.642 -12.010  -1.306
  250    HA   ASP  41           HA       ASP  41  -8.047 -10.274  -3.415
  251    HB2  ASP  41           HB2      ASP  41 -10.333 -11.120  -2.630
  252    HB3  ASP  41           HB1      ASP  41 -10.283  -9.830  -1.434
  253    H    VAL  42           HN       VAL  42  -6.480  -8.781  -3.193
  254    HA   VAL  42           HA       VAL  42  -6.706  -6.934  -0.930
  255    HB   VAL  42           HB       VAL  42  -4.616  -8.082  -0.788
  256   HG11  VAL  42          HG11      VAL  42  -4.409  -8.873  -3.073
  257   HG12  VAL  42          HG12      VAL  42  -2.934  -8.046  -2.569
  258   HG13  VAL  42          HG13      VAL  42  -4.083  -7.230  -3.629
  259   HG21  VAL  42          HG21      VAL  42  -4.158  -5.316  -1.899
  260   HG22  VAL  42          HG22      VAL  42  -3.029  -6.226  -0.894
  261   HG23  VAL  42          HG23      VAL  42  -4.579  -5.708  -0.232
  262    H    GLU  43           HN       GLU  43  -7.900  -5.294  -1.650
  263    HA   GLU  43           HA       GLU  43  -7.344  -4.123  -4.260
  264    HB2  GLU  43           HB2      GLU  43  -9.698  -4.465  -3.594
  265    HB3  GLU  43           HB1      GLU  43  -9.458  -3.389  -2.224
  266    HG2  GLU  43           HG2      GLU  43  -9.124  -1.514  -3.665
  267    HG3  GLU  43           HG1      GLU  43  -9.079  -2.553  -5.088
  268    H    TRP  44           HN       TRP  44  -5.398  -3.148  -4.026
  269    HA   TRP  44           HA       TRP  44  -5.290  -0.908  -2.128
  270    HD1  TRP  44           HD1      TRP  44  -3.499   0.804  -1.850
  271    HE1  TRP  44           HE1      TRP  44  -1.242   1.741  -1.037
  272    HE3  TRP  44           HE3      TRP  44  -0.937  -3.539  -1.449
  273    HZ2  TRP  44           HZ2      TRP  44   1.311   0.717  -0.315
  274    HZ3  TRP  44           HZ3      TRP  44   1.395  -3.500  -0.730
  275    HH2  TRP  44           HH2      TRP  44   2.494  -1.418  -0.149
  276    HB2  TRP  44           HB2      TRP  44  -3.812  -2.692  -1.359
  277    HB3  TRP  44           HB1      TRP  44  -3.038  -2.755  -2.937
  278    H    VAL  45           HN       VAL  45  -4.547   0.964  -2.866
  279    HA   VAL  45           HA       VAL  45  -4.768   1.614  -5.570
  280    HB   VAL  45           HB       VAL  45  -3.303   3.228  -3.480
  281   HG11  VAL  45          HG11      VAL  45  -4.126   5.155  -4.740
  282   HG12  VAL  45          HG12      VAL  45  -4.918   4.076  -5.888
  283   HG13  VAL  45          HG13      VAL  45  -3.158   4.093  -5.763
  284   HG21  VAL  45          HG21      VAL  45  -6.278   2.986  -3.947
  285   HG22  VAL  45          HG22      VAL  45  -5.519   4.245  -2.976
  286   HG23  VAL  45          HG23      VAL  45  -5.391   2.559  -2.480
  287    H    VAL  46           HN       VAL  46  -2.099   0.173  -3.970
  288    HA   VAL  46           HA       VAL  46  -0.126   1.340  -5.722
  289    HB   VAL  46           HB       VAL  46  -0.011  -0.584  -3.424
  290   HG11  VAL  46          HG11      VAL  46   1.140  -1.836  -5.209
  291   HG12  VAL  46          HG12      VAL  46   2.229  -1.313  -3.923
  292   HG13  VAL  46          HG13      VAL  46   2.207  -0.455  -5.467
  293   HG21  VAL  46          HG21      VAL  46   0.424   1.784  -3.115
  294   HG22  VAL  46          HG22      VAL  46   1.675   1.746  -4.358
  295   HG23  VAL  46          HG23      VAL  46   1.905   0.864  -2.848
  296    H    GLY  47           HN       GLY  47  -2.334  -1.258  -5.937
  297    HA2  GLY  47           HA2      GLY  47  -0.877  -2.915  -7.716
  298    HA3  GLY  47           HA1      GLY  47  -2.635  -2.840  -7.586
  299    H    LYS  48           HN       LYS  48  -2.294   0.177  -8.110
  300    HA   LYS  48           HA       LYS  48  -2.096  -0.020 -11.025
  301    HB2  LYS  48           HB2      LYS  48  -3.269   2.205 -10.927
  302    HB3  LYS  48           HB1      LYS  48  -4.215   0.819 -10.418
  303    HG2  LYS  48           HG2      LYS  48  -3.923   1.425  -8.112
  304    HG3  LYS  48           HG1      LYS  48  -2.800   2.711  -8.557
  305    HD2  LYS  48           HD2      LYS  48  -5.699   2.593  -9.374
  306    HD3  LYS  48           HD1      LYS  48  -5.062   3.559  -8.039
  307    HE2  LYS  48           HE2      LYS  48  -3.645   4.787  -9.600
  308    HE3  LYS  48           HE1      LYS  48  -4.248   3.804 -10.935
  309    HZ1  LYS  48           HZ1      LYS  48  -5.388   5.894 -10.899
  310    HZ2  LYS  48           HZ2      LYS  48  -5.824   5.696  -9.272
  311    HZ3  LYS  48           HZ3      LYS  48  -6.484   4.675 -10.456
  312    H    ASP  49           HN       ASP  49  -0.755   1.568  -8.225
  313    HA   ASP  49           HA       ASP  49   0.599   3.586  -9.822
  314    HB2  ASP  49           HB2      ASP  49   0.616   3.030  -6.854
  315    HB3  ASP  49           HB1      ASP  49   1.475   4.360  -7.617
  316    H    LYS  50           HN       LYS  50   1.154   0.464  -8.865
  317    HA   LYS  50           HA       LYS  50   3.700   0.269  -7.916
  318    HB2  LYS  50           HB2      LYS  50   1.963  -1.574  -8.249
  319    HB3  LYS  50           HB1      LYS  50   2.574  -1.692  -9.897
  320    HG2  LYS  50           HG2      LYS  50   4.839  -2.098  -8.971
  321    HG3  LYS  50           HG1      LYS  50   4.123  -2.140  -7.359
  322    HD2  LYS  50           HD2      LYS  50   2.673  -3.993  -8.079
  323    HD3  LYS  50           HD1      LYS  50   3.459  -3.973  -9.659
  324    HE2  LYS  50           HE2      LYS  50   4.771  -4.536  -7.004
  325    HE3  LYS  50           HE1      LYS  50   4.413  -5.708  -8.270
  326    HZ1  LYS  50           HZ1      LYS  50   5.962  -4.592  -9.729
  327    HZ2  LYS  50           HZ2      LYS  50   6.740  -5.015  -8.286
  328    HZ3  LYS  50           HZ3      LYS  50   6.272  -3.409  -8.558
  329    HA   PRO  51           HA       PRO  51   5.268  -0.244 -12.600
  330    HB2  PRO  51           HB2      PRO  51   3.932   1.672 -14.162
  331    HB3  PRO  51           HB1      PRO  51   3.764  -0.083 -14.263
  332    HG2  PRO  51           HG2      PRO  51   2.056   1.911 -12.869
  333    HG3  PRO  51           HG1      PRO  51   1.594   0.412 -13.696
  334    HD2  PRO  51           HD2      PRO  51   1.649   0.554 -11.026
  335    HD3  PRO  51           HD1      PRO  51   2.179  -0.917 -11.876
  336    H    THR  52           HN       THR  52   4.074   2.828 -11.289
  337    HA   THR  52           HA       THR  52   6.155   4.389 -12.471
  338    HB   THR  52           HB       THR  52   4.298   5.008 -10.170
  339    HG1  THR  52           HG1      THR  52   4.165   5.584 -12.964
  340   HG21  THR  52          HG21      THR  52   4.812   7.351 -10.606
  341   HG22  THR  52          HG22      THR  52   5.942   6.884 -11.876
  342   HG23  THR  52          HG23      THR  52   6.283   6.469 -10.196
  343    H    TYR  53           HN       TYR  53   5.601   2.884  -9.347
  344    HA   TYR  53           HA       TYR  53   7.975   3.998  -8.157
  345    HD1  TYR  53           HD2      TYR  53   6.448   5.318  -7.176
  346    HD2  TYR  53           HD1      TYR  53   4.324   1.769  -6.214
  347    HE1  TYR  53           HE2      TYR  53   4.486   6.667  -6.561
  348    HE2  TYR  53           HE1      TYR  53   2.362   3.101  -5.606
  349    HH   TYR  53           HH       TYR  53   1.962   6.287  -6.413
  350    HB2  TYR  53           HB2      TYR  53   6.383   1.606  -7.267
  351    HB3  TYR  53           HB1      TYR  53   7.408   2.620  -6.272
  352    H    ASP  54           HN       ASP  54   7.068   1.264 -10.011
  353    HA   ASP  54           HA       ASP  54   9.404  -0.342  -9.442
  354    HB2  ASP  54           HB2      ASP  54   7.311  -1.423 -10.026
  355    HB3  ASP  54           HB1      ASP  54   7.184  -0.492 -11.513
  356    H    GLU  55           HN       GLU  55   8.418   1.965 -11.939
  357    HA   GLU  55           HA       GLU  55  10.641   1.455 -13.652
  358    HB2  GLU  55           HB2      GLU  55  10.039   3.485 -14.816
  359    HB3  GLU  55           HB1      GLU  55   8.577   2.589 -14.433
  360    HG2  GLU  55           HG2      GLU  55   8.172   4.078 -12.528
  361    HG3  GLU  55           HG1      GLU  55   9.619   5.002 -12.972
  362    H    ILE  56           HN       ILE  56  10.081   3.639 -10.928
  363    HA   ILE  56           HA       ILE  56  12.666   4.851 -11.134
  364    HB   ILE  56           HB       ILE  56  10.944   4.601  -8.654
  365   HG12  ILE  56          HG12      ILE  56  10.994   6.861 -10.667
  366   HG13  ILE  56          HG11      ILE  56   9.770   5.584 -10.663
  367   HG21  ILE  56          HG21      ILE  56  12.116   6.656  -7.965
  368   HG22  ILE  56          HG22      ILE  56  13.104   6.562  -9.422
  369   HG23  ILE  56          HG23      ILE  56  13.225   5.304  -8.195
  370   HD11  ILE  56          HD11      ILE  56   9.090   6.268  -8.418
  371   HD12  ILE  56          HD12      ILE  56   8.939   7.580  -9.586
  372   HD13  ILE  56          HD13      ILE  56  10.289   7.561  -8.453
  373    H    PHE  57           HN       PHE  57  11.355   1.973  -9.725
  374    HA   PHE  57           HA       PHE  57  13.427   1.200  -8.015
  375    HD1  PHE  57           HD2      PHE  57  13.087  -0.808  -6.300
  376    HD2  PHE  57           HD1      PHE  57  12.046  -2.511 -10.059
  377    HE1  PHE  57           HE2      PHE  57  13.975  -2.976  -5.562
  378    HE2  PHE  57           HE1      PHE  57  12.934  -4.684  -9.323
  379    HZ   PHE  57           HZ       PHE  57  13.896  -4.918  -7.074
  380    HB2  PHE  57           HB2      PHE  57  11.282   0.155  -7.899
  381    HB3  PHE  57           HB1      PHE  57  11.376  -0.365  -9.574
  382    H    TYR  58           HN       TYR  58  12.788   0.060 -11.356
  383    HA   TYR  58           HA       TYR  58  15.247  -1.303 -11.617
  384    HD1  TYR  58           HD2      TYR  58  11.657  -1.659 -12.226
  385    HD2  TYR  58           HD1      TYR  58  15.012  -3.346 -14.228
  386    HE1  TYR  58           HE2      TYR  58  10.652  -3.896 -12.017
  387    HE2  TYR  58           HE1      TYR  58  14.013  -5.585 -14.026
  388    HH   TYR  58           HH       TYR  58  10.761  -6.093 -13.001
  389    HB2  TYR  58           HB2      TYR  58  13.244  -0.269 -13.611
  390    HB3  TYR  58           HB1      TYR  58  14.763  -0.992 -14.147
  391    H    THR  59           HN       THR  59  14.441   2.015 -11.829
  392    HA   THR  59           HA       THR  59  16.614   2.877 -13.460
  393    HB   THR  59           HB       THR  59  14.662   4.292 -11.651
  394    HG1  THR  59           HG1      THR  59  13.666   3.833 -13.515
  395   HG21  THR  59          HG21      THR  59  15.487   6.413 -12.529
  396   HG22  THR  59          HG22      THR  59  16.803   5.569 -13.345
  397   HG23  THR  59          HG23      THR  59  16.722   5.586 -11.583
  398    H    LEU  60           HN       LEU  60  16.167   2.365 -10.010
  399    HA   LEU  60           HA       LEU  60  18.635   3.726  -9.336
  400    HG   LEU  60           HG       LEU  60  15.680   4.182  -8.265
  401    HB2  LEU  60           HB2      LEU  60  16.733   2.102  -7.654
  402    HB3  LEU  60           HB1      LEU  60  18.136   2.953  -7.024
  403   HD11  LEU  60          HD11      LEU  60  16.837   4.408  -5.494
  404   HD12  LEU  60          HD12      LEU  60  15.508   3.342  -5.940
  405   HD13  LEU  60          HD13      LEU  60  15.319   5.092  -6.069
  406   HD21  LEU  60          HD21      LEU  60  18.165   5.541  -7.230
  407   HD22  LEU  60          HD22      LEU  60  16.705   6.342  -7.806
  408   HD23  LEU  60          HD23      LEU  60  17.703   5.411  -8.926
  409    H    SER  61           HN       SER  61  18.022   0.885 -10.738
  410    HA   SER  61           HA       SER  61  19.272  -0.929 -11.235
  411    HG   SER  61           HG       SER  61  21.714  -1.515 -11.644
  412    HB2  SER  61           HB2      SER  61  21.224   0.604 -11.177
  413    HB3  SER  61           HB1      SER  61  21.415   0.266  -9.457
  414    HA   PRO  62           HA       PRO  62  18.004  -2.983  -7.368
  415    HB2  PRO  62           HB2      PRO  62  16.254  -4.684  -8.499
  416    HB3  PRO  62           HB1      PRO  62  15.826  -3.013  -8.112
  417    HG2  PRO  62           HG2      PRO  62  16.498  -4.242 -10.743
  418    HG3  PRO  62           HG1      PRO  62  15.328  -2.966 -10.359
  419    HD2  PRO  62           HD2      PRO  62  17.869  -2.560 -11.411
  420    HD3  PRO  62           HD1      PRO  62  16.883  -1.332 -10.595
  421    H    VAL  63           HN       VAL  63  19.328  -4.498  -6.619
  422    HA   VAL  63           HA       VAL  63  20.707  -6.271  -8.465
  423    HB   VAL  63           HB       VAL  63  21.018  -5.961  -5.472
  424   HG11  VAL  63          HG11      VAL  63  22.700  -7.473  -7.468
  425   HG12  VAL  63          HG12      VAL  63  21.721  -8.163  -6.171
  426   HG13  VAL  63          HG13      VAL  63  23.135  -7.185  -5.782
  427   HG21  VAL  63          HG21      VAL  63  22.626  -4.836  -7.757
  428   HG22  VAL  63          HG22      VAL  63  23.119  -4.791  -6.065
  429   HG23  VAL  63          HG23      VAL  63  21.666  -3.936  -6.582
  430    H    ASN  64           HN       ASN  64  19.621  -8.043  -9.053
  431    HA   ASN  64           HA       ASN  64  18.559 -10.054  -8.929
  432    HB2  ASN  64           HB2      ASN  64  19.479  -9.769  -6.092
  433    HB3  ASN  64           HB1      ASN  64  18.368 -11.069  -6.513
  434   HD21  ASN  64          HD21      ASN  64  20.722  -9.915  -8.802
  435   HD22  ASN  64          HD22      ASN  64  21.751 -11.299  -8.736
  436    H    GLY  65           HN       GLY  65  17.185  -7.389  -8.392
  437    HA2  GLY  65           HA2      GLY  65  14.881  -7.146  -8.844
  438    HA3  GLY  65           HA1      GLY  65  14.592  -8.707  -8.096
  439    H    LYS  66           HN       LYS  66  16.560  -6.351  -6.454
  440    HA   LYS  66           HA       LYS  66  14.399  -4.953  -5.243
  441    HB2  LYS  66           HB2      LYS  66  14.542  -5.695  -2.993
  442    HB3  LYS  66           HB1      LYS  66  14.364  -7.138  -3.969
  443    HG2  LYS  66           HG2      LYS  66  16.935  -6.118  -2.789
  444    HG3  LYS  66           HG1      LYS  66  15.948  -7.427  -2.141
  445    HD2  LYS  66           HD2      LYS  66  16.904  -7.578  -4.952
  446    HD3  LYS  66           HD1      LYS  66  18.032  -7.911  -3.651
  447    HE2  LYS  66           HE2      LYS  66  17.175 -10.003  -4.284
  448    HE3  LYS  66           HE1      LYS  66  16.349  -9.582  -2.797
  449    HZ1  LYS  66           HZ1      LYS  66  15.230  -9.312  -5.530
  450    HZ2  LYS  66           HZ2      LYS  66  14.422  -8.907  -4.099
  451    HZ3  LYS  66           HZ3      LYS  66  14.831 -10.517  -4.410
  452    H    ILE  67           HN       ILE  67  15.107  -3.135  -4.081
  453    HA   ILE  67           HA       ILE  67  17.850  -2.414  -4.753
  454    HB   ILE  67           HB       ILE  67  17.207  -0.157  -3.715
  455   HG12  ILE  67          HG12      ILE  67  14.507  -1.555  -3.759
  456   HG13  ILE  67          HG11      ILE  67  15.310  -0.789  -2.395
  457   HG21  ILE  67          HG21      ILE  67  17.330  -0.573  -6.134
  458   HG22  ILE  67          HG22      ILE  67  15.985   0.503  -5.759
  459   HG23  ILE  67          HG23      ILE  67  15.678  -1.192  -6.137
  460   HD11  ILE  67          HD11      ILE  67  13.466   0.553  -3.222
  461   HD12  ILE  67          HD12      ILE  67  14.215   0.617  -4.817
  462   HD13  ILE  67          HD13      ILE  67  15.003   1.390  -3.440
  463    H    THR  68           HN       THR  68  19.464  -2.230  -3.377
  464    HA   THR  68           HA       THR  68  19.382  -3.123  -0.730
  465    HB   THR  68           HB       THR  68  21.556  -1.763  -0.530
  466    HG1  THR  68           HG1      THR  68  22.327  -0.811  -2.374
  467   HG21  THR  68          HG21      THR  68  22.796  -3.314  -1.978
  468   HG22  THR  68          HG22      THR  68  21.285  -3.774  -2.764
  469   HG23  THR  68          HG23      THR  68  21.540  -4.143  -1.057
  470    H    GLY  69           HN       GLY  69  18.675  -2.116   1.080
  471    HA2  GLY  69           HA2      GLY  69  16.789  -0.161   0.864
  472    HA3  GLY  69           HA1      GLY  69  17.605  -0.542   2.357
  473    H    ALA  70           HN       ALA  70  20.209   0.341   1.454
  474    HA   ALA  70           HA       ALA  70  20.418   2.963   2.150
  475    HB1  ALA  70           HB1      ALA  70  22.002   1.651  -0.052
  476    HB2  ALA  70           HB2      ALA  70  22.316   1.486   1.676
  477    HB3  ALA  70           HB3      ALA  70  22.484   3.058   0.895
  478    H    ASN  71           HN       ASN  71  19.793   1.864  -1.235
  479    HA   ASN  71           HA       ASN  71  19.895   4.554  -2.199
  480    HB2  ASN  71           HB2      ASN  71  19.345   3.703  -4.366
  481    HB3  ASN  71           HB1      ASN  71  20.441   2.551  -3.618
  482   HD21  ASN  71          HD21      ASN  71  19.885   0.521  -3.412
  483   HD22  ASN  71          HD22      ASN  71  18.345  -0.112  -3.856
  484    H    ALA  72           HN       ALA  72  17.372   2.408  -1.106
  485    HA   ALA  72           HA       ALA  72  15.197   4.026  -2.001
  486    HB1  ALA  72           HB1      ALA  72  13.868   2.669  -0.436
  487    HB2  ALA  72           HB2      ALA  72  15.360   1.945   0.170
  488    HB3  ALA  72           HB3      ALA  72  14.871   1.685  -1.504
  489    H    LYS  73           HN       LYS  73  17.226   3.856   0.812
  490    HA   LYS  73           HA       LYS  73  15.793   5.737   2.392
  491    HB2  LYS  73           HB2      LYS  73  18.721   4.970   2.464
  492    HB3  LYS  73           HB1      LYS  73  17.916   5.967   3.670
  493    HG2  LYS  73           HG2      LYS  73  17.340   3.082   3.034
  494    HG3  LYS  73           HG1      LYS  73  18.099   3.721   4.495
  495    HD2  LYS  73           HD2      LYS  73  15.348   4.548   3.627
  496    HD3  LYS  73           HD1      LYS  73  15.623   3.119   4.624
  497    HE2  LYS  73           HE2      LYS  73  16.683   4.484   6.327
  498    HE3  LYS  73           HE1      LYS  73  16.485   5.929   5.324
  499    HZ1  LYS  73           HZ1      LYS  73  14.050   5.511   5.459
  500    HZ2  LYS  73           HZ2      LYS  73  14.772   5.894   6.939
  501    HZ3  LYS  73           HZ3      LYS  73  14.369   4.288   6.594
  502    H    LYS  74           HN       LYS  74  18.312   5.961  -0.031
  503    HA   LYS  74           HA       LYS  74  18.872   8.696   0.142
  504    HB2  LYS  74           HB2      LYS  74  18.707   7.149  -2.416
  505    HB3  LYS  74           HB1      LYS  74  19.681   8.552  -2.101
  506    HG2  LYS  74           HG2      LYS  74  20.102   5.728  -1.223
  507    HG3  LYS  74           HG1      LYS  74  21.197   6.794  -2.099
  508    HD2  LYS  74           HD2      LYS  74  20.373   7.404   0.719
  509    HD3  LYS  74           HD1      LYS  74  21.682   6.275   0.380
  510    HE2  LYS  74           HE2      LYS  74  21.537   9.162  -0.475
  511    HE3  LYS  74           HE1      LYS  74  22.544   8.487   0.806
  512    HZ1  LYS  74           HZ1      LYS  74  22.757   7.917  -2.108
  513    HZ2  LYS  74           HZ2      LYS  74  23.649   7.117  -0.909
  514    HZ3  LYS  74           HZ3      LYS  74  23.869   8.781  -1.154
  515    H    GLU  75           HN       GLU  75  16.535   6.942  -1.797
  516    HA   GLU  75           HA       GLU  75  15.259   9.058  -3.049
  517    HB2  GLU  75           HB2      GLU  75  14.169   6.396  -2.166
  518    HB3  GLU  75           HB1      GLU  75  13.201   7.545  -3.073
  519    HG2  GLU  75           HG2      GLU  75  15.564   5.950  -3.963
  520    HG3  GLU  75           HG1      GLU  75  13.986   6.152  -4.717
  521    H    MET  76           HN       MET  76  14.287   7.572   0.037
  522    HA   MET  76           HA       MET  76  12.208   9.471   0.408
  523    HB2  MET  76           HB2      MET  76  12.272   8.603   2.817
  524    HB3  MET  76           HB1      MET  76  11.888   7.458   1.544
  525    HG2  MET  76           HG2      MET  76  14.180   6.652   1.575
  526    HG3  MET  76           HG1      MET  76  14.567   7.799   2.851
  527    HE1  MET  76           HE1      MET  76  11.283   5.528   2.366
  528    HE2  MET  76           HE2      MET  76  11.823   4.108   3.265
  529    HE3  MET  76           HE3      MET  76  12.672   4.597   1.801
  530    H    VAL  77           HN       VAL  77  15.607   9.427   1.260
  531    HA   VAL  77           HA       VAL  77  15.604  11.623   3.043
  532    HB   VAL  77           HB       VAL  77  17.697  10.314   1.349
  533   HG11  VAL  77          HG11      VAL  77  18.210  12.670   1.079
  534   HG12  VAL  77          HG12      VAL  77  19.388  11.912   2.152
  535   HG13  VAL  77          HG13      VAL  77  18.103  12.918   2.822
  536   HG21  VAL  77          HG21      VAL  77  17.132   9.348   3.504
  537   HG22  VAL  77          HG22      VAL  77  17.445  10.890   4.302
  538   HG23  VAL  77          HG23      VAL  77  18.769  10.003   3.546
  539    H    LYS  78           HN       LYS  78  15.992  11.447  -0.503
  540    HA   LYS  78           HA       LYS  78  16.370  14.273  -0.792
  541    HB2  LYS  78           HB2      LYS  78  16.246  13.881  -3.173
  542    HB3  LYS  78           HB1      LYS  78  17.240  12.638  -2.425
  543    HG2  LYS  78           HG2      LYS  78  15.269  11.133  -2.466
  544    HG3  LYS  78           HG1      LYS  78  14.403  12.370  -3.383
  545    HD2  LYS  78           HD2      LYS  78  15.317  10.762  -4.916
  546    HD3  LYS  78           HD1      LYS  78  16.190  12.285  -5.074
  547    HE2  LYS  78           HE2      LYS  78  18.040  11.454  -3.833
  548    HE3  LYS  78           HE1      LYS  78  17.156   9.999  -3.378
  549    HZ1  LYS  78           HZ1      LYS  78  18.807   9.715  -5.202
  550    HZ2  LYS  78           HZ2      LYS  78  17.821  10.677  -6.188
  551    HZ3  LYS  78           HZ3      LYS  78  17.237   9.198  -5.579
  552    H    SER  79           HN       SER  79  13.661  12.247  -0.429
  553    HA   SER  79           HA       SER  79  11.642  14.002  -1.333
  554    HG   SER  79           HG       SER  79  12.099  11.230  -1.330
  555    HB2  SER  79           HB2      SER  79  11.559  11.959   0.864
  556    HB3  SER  79           HB1      SER  79  10.158  12.721   0.111
  557    H    LYS  80           HN       LYS  80  13.818  14.182   1.290
  558    HA   LYS  80           HA       LYS  80  14.458  16.031   2.418
  559    HB2  LYS  80           HB2      LYS  80  12.191  17.367   0.930
  560    HB3  LYS  80           HB1      LYS  80  13.338  18.213   1.967
  561    HG2  LYS  80           HG2      LYS  80  15.171  17.599   0.537
  562    HG3  LYS  80           HG1      LYS  80  14.113  16.589  -0.449
  563    HD2  LYS  80           HD2      LYS  80  12.815  18.634  -1.023
  564    HD3  LYS  80           HD1      LYS  80  14.028  19.587  -0.164
  565    HE2  LYS  80           HE2      LYS  80  15.754  18.822  -1.666
  566    HE3  LYS  80           HE1      LYS  80  14.622  17.740  -2.475
  567    HZ1  LYS  80           HZ1      LYS  80  14.846  19.645  -3.815
  568    HZ2  LYS  80           HZ2      LYS  80  14.640  20.706  -2.509
  569    HZ3  LYS  80           HZ3      LYS  80  13.328  19.783  -3.068
  570    H    LEU  81           HN       LEU  81  12.857  14.149   3.638
  571    HA   LEU  81           HA       LEU  81  11.013  15.709   5.303
  572    HG   LEU  81           HG       LEU  81   8.954  12.914   4.202
  573    HB2  LEU  81           HB2      LEU  81  11.380  12.716   5.219
  574    HB3  LEU  81           HB1      LEU  81  10.118  13.594   6.055
  575   HD11  LEU  81          HD11      LEU  81   8.696  14.669   2.604
  576   HD12  LEU  81          HD12      LEU  81  10.258  15.347   3.061
  577   HD13  LEU  81          HD13      LEU  81   8.922  15.359   4.212
  578   HD21  LEU  81          HD21      LEU  81   9.853  12.422   2.075
  579   HD22  LEU  81          HD22      LEU  81  10.870  11.694   3.321
  580   HD23  LEU  81          HD23      LEU  81  11.388  13.174   2.513
  581    HA   PRO  82           HA       PRO  82  13.701  15.334   8.853
  582    HB2  PRO  82           HB2      PRO  82  11.872  14.832  10.828
  583    HB3  PRO  82           HB1      PRO  82  12.190  16.451  10.174
  584    HG2  PRO  82           HG2      PRO  82   9.972  14.548   9.544
  585    HG3  PRO  82           HG1      PRO  82   9.923  16.307   9.730
  586    HD2  PRO  82           HD2      PRO  82   9.916  15.077   7.325
  587    HD3  PRO  82           HD1      PRO  82  10.662  16.667   7.587
  588    H    ASN  83           HN       ASN  83  14.582  13.743  10.178
  589    HA   ASN  83           HA       ASN  83  14.681  11.154   9.270
  590    HB2  ASN  83           HB2      ASN  83  15.391  12.416  11.879
  591    HB3  ASN  83           HB1      ASN  83  15.452  10.663  11.736
  592   HD21  ASN  83          HD21      ASN  83  16.165  12.711   8.994
  593   HD22  ASN  83          HD22      ASN  83  17.871  12.428   8.989
  594    H    THR  84           HN       THR  84  12.429  12.514  11.591
  595    HA   THR  84           HA       THR  84  11.387  10.146  12.671
  596    HB   THR  84           HB       THR  84   9.730  12.600  12.094
  597    HG1  THR  84           HG1      THR  84  10.649  13.564  13.902
  598   HG21  THR  84          HG21      THR  84   8.581  10.666  13.093
  599   HG22  THR  84          HG22      THR  84   8.657  12.032  14.208
  600   HG23  THR  84          HG23      THR  84   9.751  10.666  14.415
  601    H    VAL  85           HN       VAL  85  10.151  12.126   9.970
  602    HA   VAL  85           HA       VAL  85   8.112  10.362   9.175
  603    HB   VAL  85           HB       VAL  85   9.616  12.384   7.489
  604   HG11  VAL  85          HG11      VAL  85   7.714  12.336   5.992
  605   HG12  VAL  85          HG12      VAL  85   6.912  11.136   7.008
  606   HG13  VAL  85          HG13      VAL  85   8.391  10.714   6.146
  607   HG21  VAL  85          HG21      VAL  85   7.717  13.861   7.965
  608   HG22  VAL  85          HG22      VAL  85   8.568  13.399   9.437
  609   HG23  VAL  85          HG23      VAL  85   7.034  12.631   9.028
  610    H    LEU  86           HN       LEU  86  11.465  10.711   8.104
  611    HA   LEU  86           HA       LEU  86  11.438   8.840   6.015
  612    HG   LEU  86           HG       LEU  86  12.787  11.491   6.929
  613    HB2  LEU  86           HB2      LEU  86  13.704   9.365   7.912
  614    HB3  LEU  86           HB1      LEU  86  13.819   8.740   6.272
  615   HD11  LEU  86          HD11      LEU  86  15.059  11.131   7.731
  616   HD12  LEU  86          HD12      LEU  86  14.998  12.271   6.380
  617   HD13  LEU  86          HD13      LEU  86  15.536  10.610   6.116
  618   HD21  LEU  86          HD21      LEU  86  13.812  10.242   4.381
  619   HD22  LEU  86          HD22      LEU  86  13.256  11.905   4.572
  620   HD23  LEU  86          HD23      LEU  86  12.121  10.568   4.754
  621    H    GLY  87           HN       GLY  87  12.364   8.415   9.428
  622    HA2  GLY  87           HA2      GLY  87  13.066   5.723   9.326
  623    HA3  GLY  87           HA1      GLY  87  12.445   6.544  10.754
  624    H    LYS  88           HN       LYS  88   9.909   7.239   9.809
  625    HA   LYS  88           HA       LYS  88   8.745   4.599  10.016
  626    HB2  LYS  88           HB2      LYS  88   6.629   5.635  10.505
  627    HB3  LYS  88           HB1      LYS  88   7.893   6.269  11.537
  628    HG2  LYS  88           HG2      LYS  88   7.949   8.324  10.309
  629    HG3  LYS  88           HG1      LYS  88   6.824   7.671   9.111
  630    HD2  LYS  88           HD2      LYS  88   5.073   7.524  10.757
  631    HD3  LYS  88           HD1      LYS  88   6.192   7.963  12.047
  632    HE2  LYS  88           HE2      LYS  88   6.448  10.190  11.065
  633    HE3  LYS  88           HE1      LYS  88   5.338   9.746   9.765
  634    HZ1  LYS  88           HZ1      LYS  88   3.577   9.464  11.357
  635    HZ2  LYS  88           HZ2      LYS  88   4.247  11.005  11.566
  636    HZ3  LYS  88           HZ3      LYS  88   4.629   9.759  12.649
  637    H    ILE  89           HN       ILE  89   9.385   6.828   7.479
  638    HA   ILE  89           HA       ILE  89   7.371   5.764   5.722
  639    HB   ILE  89           HB       ILE  89   9.981   7.177   5.135
  640   HG12  ILE  89          HG12      ILE  89   7.075   7.936   4.768
  641   HG13  ILE  89          HG11      ILE  89   8.199   8.615   5.942
  642   HG21  ILE  89          HG21      ILE  89   9.629   5.555   3.357
  643   HG22  ILE  89          HG22      ILE  89   9.338   7.189   2.763
  644   HG23  ILE  89          HG23      ILE  89   7.977   6.131   3.138
  645   HD11  ILE  89          HD11      ILE  89   8.405   8.871   2.953
  646   HD12  ILE  89          HD12      ILE  89   9.527   9.556   4.127
  647   HD13  ILE  89          HD13      ILE  89   7.857  10.123   4.067
  648    H    TRP  90           HN       TRP  90  10.747   5.003   6.442
  649    HA   TRP  90           HA       TRP  90  11.059   2.881   4.645
  650    HD1  TRP  90           HD1      TRP  90  12.801   0.790   8.110
  651    HE1  TRP  90           HE1      TRP  90  14.035  -1.211   7.015
  652    HE3  TRP  90           HE3      TRP  90  13.403   2.691   3.394
  653    HZ2  TRP  90           HZ2      TRP  90  15.123  -1.870   4.488
  654    HZ3  TRP  90           HZ3      TRP  90  14.552   1.313   1.710
  655    HH2  TRP  90           HH2      TRP  90  15.387  -0.918   2.248
  656    HB2  TRP  90           HB2      TRP  90  12.972   3.775   5.823
  657    HB3  TRP  90           HB1      TRP  90  12.302   3.242   7.361
  658    H    LYS  91           HN       LYS  91  10.134   2.824   8.074
  659    HA   LYS  91           HA       LYS  91   9.997  -0.015   8.113
  660    HB2  LYS  91           HB2      LYS  91   9.005   1.960  10.114
  661    HB3  LYS  91           HB1      LYS  91   9.250   0.250  10.407
  662    HG2  LYS  91           HG2      LYS  91  11.643   0.583   9.905
  663    HG3  LYS  91           HG1      LYS  91  11.345   2.315   9.779
  664    HD2  LYS  91           HD2      LYS  91  10.398   2.201  12.114
  665    HD3  LYS  91           HD1      LYS  91  11.040   0.558  12.205
  666    HE2  LYS  91           HE2      LYS  91  12.627   3.077  11.724
  667    HE3  LYS  91           HE1      LYS  91  12.585   2.149  13.219
  668    HZ1  LYS  91           HZ1      LYS  91  13.694   1.268  10.610
  669    HZ2  LYS  91           HZ2      LYS  91  13.510   0.254  11.945
  670    HZ3  LYS  91           HZ3      LYS  91  14.562   1.585  12.029
  671    H    LEU  92           HN       LEU  92   7.709   2.465   7.414
  672    HA   LEU  92           HA       LEU  92   5.446   0.678   7.746
  673    HG   LEU  92           HG       LEU  92   3.203   1.807   6.980
  674    HB2  LEU  92           HB2      LEU  92   5.624   3.356   7.908
  675    HB3  LEU  92           HB1      LEU  92   5.173   3.200   6.209
  676   HD11  LEU  92          HD11      LEU  92   4.103   1.249   9.204
  677   HD12  LEU  92          HD12      LEU  92   2.524   2.027   9.311
  678   HD13  LEU  92          HD13      LEU  92   3.986   2.948   9.668
  679   HD21  LEU  92          HD21      LEU  92   3.383   4.674   7.905
  680   HD22  LEU  92          HD22      LEU  92   1.888   3.772   7.652
  681   HD23  LEU  92          HD23      LEU  92   2.949   4.124   6.287
  682    H    ALA  93           HN       ALA  93   7.759   1.507   5.340
  683    HA   ALA  93           HA       ALA  93   6.061   0.559   3.152
  684    HB1  ALA  93           HB1      ALA  93   8.904   1.554   3.079
  685    HB2  ALA  93           HB2      ALA  93   7.465   2.534   2.787
  686    HB3  ALA  93           HB3      ALA  93   7.876   1.215   1.688
  687    H    ASP  94           HN       ASP  94   9.126  -0.252   4.732
  688    HA   ASP  94           HA       ASP  94   9.126  -2.872   3.467
  689    HB2  ASP  94           HB2      ASP  94  11.262  -1.587   3.916
  690    HB3  ASP  94           HB1      ASP  94  10.991  -1.859   5.625
  691    H    VAL  95           HN       VAL  95   7.008  -3.281   4.370
  692    HA   VAL  95           HA       VAL  95   6.593  -3.599   7.165
  693    HB   VAL  95           HB       VAL  95   5.068  -4.980   4.944
  694   HG11  VAL  95          HG11      VAL  95   3.178  -4.837   6.508
  695   HG12  VAL  95          HG12      VAL  95   4.244  -4.127   7.721
  696   HG13  VAL  95          HG13      VAL  95   4.513  -5.781   7.167
  697   HG21  VAL  95          HG21      VAL  95   3.576  -3.035   4.933
  698   HG22  VAL  95          HG22      VAL  95   5.213  -2.612   4.427
  699   HG23  VAL  95          HG23      VAL  95   4.659  -2.205   6.051
  700    H    ASP  96           HN       ASP  96   8.410  -5.282   4.981
  701    HA   ASP  96           HA       ASP  96   8.240  -7.864   6.338
  702    HB2  ASP  96           HB2      ASP  96   8.366  -7.752   3.870
  703    HB3  ASP  96           HB1      ASP  96   9.922  -6.918   4.011
  704    H    LYS  97           HN       LYS  97  10.276  -5.047   5.999
  705    HA   LYS  97           HA       LYS  97  11.880  -4.167   7.307
  706    HB2  LYS  97           HB2      LYS  97  10.935  -6.194   9.336
  707    HB3  LYS  97           HB1      LYS  97  11.898  -4.758   9.675
  708    HG2  LYS  97           HG2      LYS  97  10.109  -3.340   8.895
  709    HG3  LYS  97           HG1      LYS  97   9.137  -4.745   8.486
  710    HD2  LYS  97           HD2      LYS  97   9.309  -5.409  10.925
  711    HD3  LYS  97           HD1      LYS  97   9.982  -3.807  11.222
  712    HE2  LYS  97           HE2      LYS  97   7.938  -2.804  10.266
  713    HE3  LYS  97           HE1      LYS  97   7.276  -4.421  10.042
  714    HZ1  LYS  97           HZ1      LYS  97   7.591  -4.711  12.512
  715    HZ2  LYS  97           HZ2      LYS  97   6.373  -3.629  12.043
  716    HZ3  LYS  97           HZ3      LYS  97   7.861  -3.038  12.593
  717    H    ASP  98           HN       ASP  98  13.353  -5.013   5.774
  718    HA   ASP  98           HA       ASP  98  15.007  -7.202   6.829
  719    HB2  ASP  98           HB2      ASP  98  15.310  -7.882   4.383
  720    HB3  ASP  98           HB1      ASP  98  13.725  -8.206   5.101
  721    H    GLY  99           HN       GLY  99  14.866  -4.104   5.273
  722    HA2  GLY  99           HA2      GLY  99  16.774  -2.609   5.497
  723    HA3  GLY  99           HA1      GLY  99  17.823  -4.014   5.395
  724    H    LEU 100           HN       LEU 100  15.393  -4.362   3.176
  725    HA   LEU 100           HA       LEU 100  16.575  -2.651   1.124
  726    HG   LEU 100           HG       LEU 100  16.076  -6.189   1.981
  727    HB2  LEU 100           HB2      LEU 100  16.499  -4.566  -0.502
  728    HB3  LEU 100           HB1      LEU 100  17.756  -4.666   0.712
  729   HD11  LEU 100          HD11      LEU 100  14.982  -6.326  -0.825
  730   HD12  LEU 100          HD12      LEU 100  14.122  -5.838   0.640
  731   HD13  LEU 100          HD13      LEU 100  14.650  -7.509   0.442
  732   HD21  LEU 100          HD21      LEU 100  17.495  -7.102  -0.514
  733   HD22  LEU 100          HD22      LEU 100  16.966  -8.138   0.810
  734   HD23  LEU 100          HD23      LEU 100  18.206  -6.916   1.089
  735    H    LEU 101           HN       LEU 101  15.015  -3.367  -1.027
  736    HA   LEU 101           HA       LEU 101  12.269  -3.487  -0.159
  737    HG   LEU 101           HG       LEU 101  13.339  -0.847   1.064
  738    HB2  LEU 101           HB2      LEU 101  13.429  -0.975  -1.379
  739    HB3  LEU 101           HB1      LEU 101  11.724  -1.356  -1.445
  740   HD11  LEU 101          HD11      LEU 101  12.864   1.137  -0.309
  741   HD12  LEU 101          HD12      LEU 101  12.012   1.170   1.233
  742   HD13  LEU 101          HD13      LEU 101  11.145   0.754  -0.246
  743   HD21  LEU 101          HD21      LEU 101  10.397  -1.435   0.722
  744   HD22  LEU 101          HD22      LEU 101  11.171  -0.919   2.216
  745   HD23  LEU 101          HD23      LEU 101  11.584  -2.478   1.504
  746    H    ASP 102           HN       ASP 102  11.596  -4.970  -1.609
  747    HA   ASP 102           HA       ASP 102  12.889  -5.158  -4.165
  748    HB2  ASP 102           HB2      ASP 102  11.502  -7.031  -4.570
  749    HB3  ASP 102           HB1      ASP 102  12.066  -7.132  -2.912
  750    H    ASP 103           HN       ASP 103  10.926  -5.599  -6.031
  751    HA   ASP 103           HA       ASP 103  10.454  -2.969  -6.850
  752    HB2  ASP 103           HB2      ASP 103   8.995  -3.983  -8.611
  753    HB3  ASP 103           HB1      ASP 103  10.597  -4.728  -8.484
  754    H    GLU 104           HN       GLU 104   8.425  -5.167  -5.035
  755    HA   GLU 104           HA       GLU 104   6.103  -3.442  -5.288
  756    HB2  GLU 104           HB2      GLU 104   5.968  -5.947  -5.208
  757    HB3  GLU 104           HB1      GLU 104   6.475  -5.862  -3.526
  758    HG2  GLU 104           HG2      GLU 104   4.493  -4.522  -3.006
  759    HG3  GLU 104           HG1      GLU 104   3.978  -4.668  -4.700
  760    H    GLU 105           HN       GLU 105   8.669  -4.105  -3.054
  761    HA   GLU 105           HA       GLU 105   7.485  -2.725  -0.853
  762    HB2  GLU 105           HB2      GLU 105   9.872  -4.256  -1.347
  763    HB3  GLU 105           HB1      GLU 105  10.271  -2.782  -0.486
  764    HG2  GLU 105           HG2      GLU 105   8.740  -3.301   1.273
  765    HG3  GLU 105           HG1      GLU 105   8.089  -4.668   0.373
  766    H    PHE 106           HN       PHE 106   9.699  -1.836  -3.451
  767    HA   PHE 106           HA       PHE 106  10.129   0.839  -2.604
  768    HD1  PHE 106           HD1      PHE 106   9.470   2.698  -4.268
  769    HD2  PHE 106           HD2      PHE 106  12.873   0.848  -6.009
  770    HE1  PHE 106           HE1      PHE 106  10.301   4.883  -4.950
  771    HE2  PHE 106           HE2      PHE 106  13.707   3.049  -6.707
  772    HZ   PHE 106           HZ       PHE 106  12.489   5.020  -6.256
  773    HB2  PHE 106           HB2      PHE 106  11.433  -0.370  -4.416
  774    HB3  PHE 106           HB1      PHE 106  10.038  -0.177  -5.459
  775    H    ALA 107           HN       ALA 107   7.690  -0.794  -4.593
  776    HA   ALA 107           HA       ALA 107   6.138   1.348  -5.369
  777    HB1  ALA 107           HB1      ALA 107   4.231  -0.199  -5.375
  778    HB2  ALA 107           HB2      ALA 107   5.188  -1.363  -4.457
  779    HB3  ALA 107           HB3      ALA 107   5.673  -0.920  -6.093
  780    H    LEU 108           HN       LEU 108   6.032  -0.407  -2.280
  781    HA   LEU 108           HA       LEU 108   3.996   1.198  -1.142
  782    HG   LEU 108           HG       LEU 108   3.015  -0.195   0.514
  783    HB2  LEU 108           HB2      LEU 108   5.139  -1.121  -0.434
  784    HB3  LEU 108           HB1      LEU 108   6.027  -0.035   0.632
  785   HD11  LEU 108          HD11      LEU 108   4.888  -1.465   2.491
  786   HD12  LEU 108          HD12      LEU 108   3.956  -2.313   1.257
  787   HD13  LEU 108          HD13      LEU 108   3.126  -1.467   2.562
  788   HD21  LEU 108          HD21      LEU 108   4.862   1.057   2.533
  789   HD22  LEU 108          HD22      LEU 108   3.106   0.963   2.652
  790   HD23  LEU 108          HD23      LEU 108   3.854   1.917   1.370
  791    H    ALA 109           HN       ALA 109   7.531   1.239  -0.816
  792    HA   ALA 109           HA       ALA 109   7.892   3.306   0.964
  793    HB1  ALA 109           HB1      ALA 109  10.075   3.617   0.017
  794    HB2  ALA 109           HB2      ALA 109   9.577   2.844  -1.489
  795    HB3  ALA 109           HB3      ALA 109   9.680   1.899  -0.002
  796    H    ASN 110           HN       ASN 110   7.754   3.683  -2.590
  797    HA   ASN 110           HA       ASN 110   8.003   6.511  -2.464
  798    HB2  ASN 110           HB2      ASN 110   8.665   4.977  -4.396
  799    HB3  ASN 110           HB1      ASN 110   6.953   4.940  -4.806
  800   HD21  ASN 110          HD21      ASN 110   9.851   6.818  -4.761
  801   HD22  ASN 110          HD22      ASN 110   9.253   8.162  -5.665
  802    H    HIS 111           HN       HIS 111   5.344   4.251  -2.478
  803    HA   HIS 111           HA       HIS 111   3.316   6.120  -3.194
  804    HD1  HIS 111           HD1      HIS 111   1.007   4.884  -4.524
  805    HD2  HIS 111           HD2      HIS 111   0.557   4.094  -0.461
  806    HE1  HIS 111           HE1      HIS 111  -1.450   5.113  -4.059
  807    HE2  HIS 111           HE2      HIS 111  -1.636   4.975  -1.547
  808    HB2  HIS 111           HB2      HIS 111   3.041   3.641  -3.357
  809    HB3  HIS 111           HB1      HIS 111   3.003   3.569  -1.591
  810    H    LEU 112           HN       LEU 112   4.722   5.035  -0.153
  811    HA   LEU 112           HA       LEU 112   2.971   6.549   1.500
  812    HG   LEU 112           HG       LEU 112   3.833   3.732   2.003
  813    HB2  LEU 112           HB2      LEU 112   5.689   5.346   1.935
  814    HB3  LEU 112           HB1      LEU 112   4.904   6.319   3.170
  815   HD11  LEU 112          HD11      LEU 112   4.283   2.849   4.237
  816   HD12  LEU 112          HD12      LEU 112   4.999   4.394   4.700
  817   HD13  LEU 112          HD13      LEU 112   5.759   3.411   3.449
  818   HD21  LEU 112          HD21      LEU 112   2.114   3.902   3.710
  819   HD22  LEU 112          HD22      LEU 112   2.045   5.297   2.632
  820   HD23  LEU 112          HD23      LEU 112   2.761   5.453   4.236
  821    H    ILE 113           HN       ILE 113   6.091   7.212  -0.029
  822    HA   ILE 113           HA       ILE 113   6.517   9.787   0.925
  823    HB   ILE 113           HB       ILE 113   7.120   8.631  -1.800
  824   HG12  ILE 113          HG12      ILE 113   8.859   9.044   0.649
  825   HG13  ILE 113          HG11      ILE 113   8.198   7.500   0.121
  826   HG21  ILE 113          HG21      ILE 113   7.104  11.064  -1.927
  827   HG22  ILE 113          HG22      ILE 113   8.751  10.445  -2.047
  828   HG23  ILE 113          HG23      ILE 113   8.183  11.156  -0.534
  829   HD11  ILE 113          HD11      ILE 113   9.518   7.637  -1.927
  830   HD12  ILE 113          HD12      ILE 113  10.539   7.723  -0.489
  831   HD13  ILE 113          HD13      ILE 113  10.172   9.188  -1.398
  832    H    LYS 114           HN       LYS 114   4.551   8.781  -1.950
  833    HA   LYS 114           HA       LYS 114   3.762  11.448  -2.492
  834    HB2  LYS 114           HB2      LYS 114   2.256  10.604  -4.064
  835    HB3  LYS 114           HB1      LYS 114   3.566   9.437  -4.048
  836    HG2  LYS 114           HG2      LYS 114   2.279   7.879  -2.798
  837    HG3  LYS 114           HG1      LYS 114   1.019   9.080  -2.495
  838    HD2  LYS 114           HD2      LYS 114   1.797   8.072  -5.220
  839    HD3  LYS 114           HD1      LYS 114   0.435   7.456  -4.278
  840    HE2  LYS 114           HE2      LYS 114   0.685  10.384  -4.837
  841    HE3  LYS 114           HE1      LYS 114   0.056   9.299  -6.064
  842    HZ1  LYS 114           HZ1      LYS 114  -1.048   9.622  -3.315
  843    HZ2  LYS 114           HZ2      LYS 114  -1.666   8.599  -4.524
  844    HZ3  LYS 114           HZ3      LYS 114  -1.717  10.280  -4.728
  845    H    VAL 115           HN       VAL 115   2.466   8.982  -0.348
  846    HA   VAL 115           HA       VAL 115   0.023  10.248   0.295
  847    HB   VAL 115           HB       VAL 115   1.770   8.318   1.814
  848   HG11  VAL 115          HG11      VAL 115   0.603   9.661   3.474
  849   HG12  VAL 115          HG12      VAL 115  -0.071   8.032   3.410
  850   HG13  VAL 115          HG13      VAL 115  -0.932   9.372   2.651
  851   HG21  VAL 115          HG21      VAL 115  -0.917   8.036   0.470
  852   HG22  VAL 115          HG22      VAL 115  -0.051   6.752   1.316
  853   HG23  VAL 115          HG23      VAL 115   0.627   7.450  -0.154
  854    H    LYS 116           HN       LYS 116   3.253  10.490   1.793
  855    HA   LYS 116           HA       LYS 116   2.412  12.529   3.616
  856    HB2  LYS 116           HB2      LYS 116   4.746  12.678   4.215
  857    HB3  LYS 116           HB1      LYS 116   4.255  10.992   4.111
  858    HG2  LYS 116           HG2      LYS 116   5.913  10.622   2.714
  859    HG3  LYS 116           HG1      LYS 116   5.168  11.736   1.561
  860    HD2  LYS 116           HD2      LYS 116   6.264  13.507   3.211
  861    HD3  LYS 116           HD1      LYS 116   7.360  12.153   3.470
  862    HE2  LYS 116           HE2      LYS 116   8.130  13.675   1.727
  863    HE3  LYS 116           HE1      LYS 116   7.867  12.045   1.125
  864    HZ1  LYS 116           HZ1      LYS 116   5.799  12.766   0.149
  865    HZ2  LYS 116           HZ2      LYS 116   7.043  13.792  -0.382
  866    HZ3  LYS 116           HZ3      LYS 116   5.974  14.313   0.821
  867    H    LEU 117           HN       LEU 117   3.019  12.493   0.338
  868    HA   LEU 117           HA       LEU 117   3.780  15.305   0.180
  869    HG   LEU 117           HG       LEU 117   2.786  15.571  -2.817
  870    HB2  LEU 117           HB2      LEU 117   4.753  13.741  -1.436
  871    HB3  LEU 117           HB1      LEU 117   3.138  13.271  -1.969
  872   HD11  LEU 117          HD11      LEU 117   4.678  17.092  -3.005
  873   HD12  LEU 117          HD12      LEU 117   5.693  15.959  -2.115
  874   HD13  LEU 117          HD13      LEU 117   4.326  16.733  -1.314
  875   HD21  LEU 117          HD21      LEU 117   3.535  13.830  -4.313
  876   HD22  LEU 117          HD22      LEU 117   5.213  14.120  -3.858
  877   HD23  LEU 117          HD23      LEU 117   4.309  15.357  -4.737
  878    H    GLU 118           HN       GLU 118   1.004  13.373   0.377
  879    HA   GLU 118           HA       GLU 118  -0.763  15.155  -1.035
  880    HB2  GLU 118           HB2      GLU 118  -1.240  12.683   0.632
  881    HB3  GLU 118           HB1      GLU 118  -2.543  13.624  -0.087
  882    HG2  GLU 118           HG2      GLU 118  -1.712  13.209  -2.300
  883    HG3  GLU 118           HG1      GLU 118  -0.275  12.410  -1.659
  884    H    GLY 119           HN       GLY 119   0.774  15.388   1.849
  885    HA2  GLY 119           HA2      GLY 119   0.503  17.560   2.863
  886    HA3  GLY 119           HA1      GLY 119  -1.230  17.392   2.633
  887    H    HIS 120           HN       HIS 120   0.021  14.473   3.658
  888    HA   HIS 120           HA       HIS 120  -0.172  15.198   6.470
  889    HD1  HIS 120           HD1      HIS 120  -1.789  11.442   7.406
  890    HD2  HIS 120           HD2      HIS 120  -2.009  12.317   3.343
  891    HE1  HIS 120           HE1      HIS 120  -2.115   9.241   6.269
  892    HE2  HIS 120           HE2      HIS 120  -2.534   9.833   3.855
  893    HB2  HIS 120           HB2      HIS 120  -1.951  13.863   7.003
  894    HB3  HIS 120           HB1      HIS 120  -2.430  14.398   5.404
  895    H    GLU 121           HN       GLU 121   1.118  14.105   7.752
  896    HA   GLU 121           HA       GLU 121   3.101  12.357   6.717
  897    HB2  GLU 121           HB2      GLU 121   3.769  12.134   9.116
  898    HB3  GLU 121           HB1      GLU 121   3.631  13.797   8.558
  899    HG2  GLU 121           HG2      GLU 121   2.305  14.211  10.276
  900    HG3  GLU 121           HG1      GLU 121   1.107  13.131   9.559
  901    H    LEU 122           HN       LEU 122   3.585  10.207   7.685
  902    HA   LEU 122           HA       LEU 122   1.358   8.466   7.266
  903    HG   LEU 122           HG       LEU 122   4.496   8.865   6.233
  904    HB2  LEU 122           HB2      LEU 122   4.089   7.758   8.343
  905    HB3  LEU 122           HB1      LEU 122   2.927   6.663   7.585
  906   HD11  LEU 122          HD11      LEU 122   5.762   6.837   6.712
  907   HD12  LEU 122          HD12      LEU 122   5.484   7.029   4.981
  908   HD13  LEU 122          HD13      LEU 122   4.528   5.872   5.905
  909   HD21  LEU 122          HD21      LEU 122   3.427   8.094   4.162
  910   HD22  LEU 122          HD22      LEU 122   2.261   8.780   5.292
  911   HD23  LEU 122          HD23      LEU 122   2.385   7.030   5.105
  912    HA   PRO 123           HA       PRO 123  -0.092   8.219  11.380
  913    HB2  PRO 123           HB2      PRO 123  -1.685   6.106  11.221
  914    HB3  PRO 123           HB1      PRO 123  -1.971   7.508  10.182
  915    HG2  PRO 123           HG2      PRO 123  -0.528   4.956   9.532
  916    HG3  PRO 123           HG1      PRO 123  -1.823   5.742   8.614
  917    HD2  PRO 123           HD2      PRO 123   0.816   6.054   8.014
  918    HD3  PRO 123           HD1      PRO 123  -0.385   7.334   7.733
  919    H    ALA 124           HN       ALA 124   2.240   6.112  10.354
  920    HA   ALA 124           HA       ALA 124   3.473   4.408  11.220
  921    HB1  ALA 124           HB1      ALA 124   2.277   5.284  13.847
  922    HB2  ALA 124           HB2      ALA 124   3.779   5.882  13.143
  923    HB3  ALA 124           HB3      ALA 124   3.651   4.197  13.652
  924    H    ASP 125           HN       ASP 125   0.584   4.201  10.486
  925    HA   ASP 125           HA       ASP 125  -0.016   1.623  11.756
  926    HB2  ASP 125           HB2      ASP 125  -1.698   3.362  12.275
  927    HB3  ASP 125           HB1      ASP 125  -1.952   3.619  10.550
  928    H    LEU 126           HN       LEU 126  -0.866   0.009  10.373
  929    HA   LEU 126           HA       LEU 126  -0.255   0.436   7.533
  930    HG   LEU 126           HG       LEU 126   2.050  -2.426   7.212
  931    HB2  LEU 126           HB2      LEU 126   1.481  -0.874   8.895
  932    HB3  LEU 126           HB1      LEU 126   0.283  -2.148   8.986
  933   HD11  LEU 126          HD11      LEU 126  -0.799  -2.324   6.245
  934   HD12  LEU 126          HD12      LEU 126  -0.048  -3.657   7.124
  935   HD13  LEU 126          HD13      LEU 126   0.523  -3.232   5.512
  936   HD21  LEU 126          HD21      LEU 126   2.194  -0.104   6.496
  937   HD22  LEU 126          HD22      LEU 126   0.538  -0.176   5.892
  938   HD23  LEU 126          HD23      LEU 126   1.795  -1.161   5.143
  939    HA   PRO 127           HA       PRO 127  -4.522  -0.941   7.690
  940    HB2  PRO 127           HB2      PRO 127  -4.774   0.169   5.031
  941    HB3  PRO 127           HB1      PRO 127  -5.465   0.759   6.547
  942    HG2  PRO 127           HG2      PRO 127  -3.518   2.058   5.139
  943    HG3  PRO 127           HG1      PRO 127  -3.751   2.229   6.890
  944    HD2  PRO 127           HD2      PRO 127  -1.761   0.575   5.389
  945    HD3  PRO 127           HD1      PRO 127  -1.548   1.514   6.882
  946    HA   PRO 128           HA       PRO 128  -4.418  -4.789   5.474
  947    HB2  PRO 128           HB2      PRO 128  -7.288  -4.230   4.961
  948    HB3  PRO 128           HB1      PRO 128  -6.520  -5.655   5.684
  949    HG2  PRO 128           HG2      PRO 128  -7.833  -3.842   7.156
  950    HG3  PRO 128           HG1      PRO 128  -6.410  -4.693   7.774
  951    HD2  PRO 128           HD2      PRO 128  -6.703  -1.884   6.865
  952    HD3  PRO 128           HD1      PRO 128  -5.605  -2.576   8.073
  953    H    HIS 129           HN       HIS 129  -6.104  -2.016   4.037
  954    HA   HIS 129           HA       HIS 129  -5.858  -3.154   1.394
  955    HD1  HIS 129           HD1      HIS 129  -7.783  -0.249   4.093
  956    HD2  HIS 129           HD2      HIS 129  -5.895   1.384   0.761
  957    HE1  HIS 129           HE1      HIS 129  -7.486   2.193   4.607
  958    HE2  HIS 129           HE2      HIS 129  -6.536   3.195   2.495
  959    HB2  HIS 129           HB2      HIS 129  -6.941  -1.172   0.545
  960    HB3  HIS 129           HB1      HIS 129  -7.825  -1.757   1.938
  961    H    LEU 130           HN       LEU 130  -3.509  -2.289   3.200
  962    HA   LEU 130           HA       LEU 130  -1.950  -1.282   0.908
  963    HG   LEU 130           HG       LEU 130  -1.130   0.941   0.912
  964    HB2  LEU 130           HB2      LEU 130  -2.257  -0.031   3.500
  965    HB3  LEU 130           HB1      LEU 130  -0.579  -0.288   3.092
  966   HD11  LEU 130          HD11      LEU 130  -2.975   2.515   1.021
  967   HD12  LEU 130          HD12      LEU 130  -3.470   1.843   2.574
  968   HD13  LEU 130          HD13      LEU 130  -3.559   0.853   1.116
  969   HD21  LEU 130          HD21      LEU 130   0.244   1.830   2.727
  970   HD22  LEU 130          HD22      LEU 130  -1.209   2.428   3.528
  971   HD23  LEU 130          HD23      LEU 130  -0.726   3.091   1.967
  972    H    VAL 131           HN       VAL 131  -2.422  -3.924   2.518
  973    HA   VAL 131           HA       VAL 131   0.195  -4.410   3.613
  974    HB   VAL 131           HB       VAL 131  -0.511  -6.722   3.975
  975   HG11  VAL 131          HG11      VAL 131  -1.138  -5.035   5.616
  976   HG12  VAL 131          HG12      VAL 131  -2.357  -6.304   5.513
  977   HG13  VAL 131          HG13      VAL 131  -2.648  -4.744   4.748
  978   HG21  VAL 131          HG21      VAL 131  -3.039  -5.957   2.522
  979   HG22  VAL 131          HG22      VAL 131  -2.785  -7.455   3.419
  980   HG23  VAL 131          HG23      VAL 131  -1.822  -7.116   1.980
  981    HA   PRO 132           HA       PRO 132   1.913  -5.315  -0.410
  982    HB2  PRO 132           HB2      PRO 132   4.412  -5.929   0.511
  983    HB3  PRO 132           HB1      PRO 132   3.842  -4.277   0.255
  984    HG2  PRO 132           HG2      PRO 132   3.998  -5.854   2.792
  985    HG3  PRO 132           HG1      PRO 132   4.412  -4.153   2.502
  986    HD2  PRO 132           HD2      PRO 132   2.088  -4.893   3.659
  987    HD3  PRO 132           HD1      PRO 132   2.209  -3.466   2.596
  988    HA   PRO 133           HA       PRO 133   1.048  -9.773  -0.127
  989    HB2  PRO 133           HB2      PRO 133   2.000  -9.457  -2.939
  990    HB3  PRO 133           HB1      PRO 133   0.586 -10.323  -2.318
  991    HG2  PRO 133           HG2      PRO 133   0.301  -7.968  -3.505
  992    HG3  PRO 133           HG1      PRO 133  -0.657  -8.377  -2.065
  993    HD2  PRO 133           HD2      PRO 133   1.729  -6.589  -2.322
  994    HD3  PRO 133           HD1      PRO 133   0.290  -6.416  -1.289
  995    H    SER 134           HN       SER 134   3.950  -8.143  -1.238
  996    HA   SER 134           HA       SER 134   5.687 -10.288  -1.532
  997    HG   SER 134           HG       SER 134   8.392  -7.995  -1.360
  998    HB2  SER 134           HB2      SER 134   6.176  -7.875  -2.042
  999    HB3  SER 134           HB1      SER 134   6.392  -7.606  -0.314
 1000    H    LYS 135           HN       LYS 135   4.494  -8.773   1.452
 1001    HA   LYS 135           HA       LYS 135   6.197 -10.626   2.968
 1002    HB2  LYS 135           HB2      LYS 135   5.632  -9.320   4.978
 1003    HB3  LYS 135           HB1      LYS 135   6.420  -8.373   3.734
 1004    HG2  LYS 135           HG2      LYS 135   4.778  -6.972   4.610
 1005    HG3  LYS 135           HG1      LYS 135   4.110  -7.557   3.083
 1006    HD2  LYS 135           HD2      LYS 135   2.490  -7.508   4.979
 1007    HD3  LYS 135           HD1      LYS 135   2.669  -9.081   4.212
 1008    HE2  LYS 135           HE2      LYS 135   2.602  -9.461   6.556
 1009    HE3  LYS 135           HE1      LYS 135   4.274  -9.693   6.054
 1010    HZ1  LYS 135           HZ1      LYS 135   4.822  -7.526   6.911
 1011    HZ2  LYS 135           HZ2      LYS 135   4.058  -8.429   8.124
 1012    HZ3  LYS 135           HZ3      LYS 135   3.199  -7.218   7.302
 1013    H    ARG 136           HN       ARG 136   3.363 -10.753   1.545
 1014    HA   ARG 136           HA       ARG 136   2.001 -12.133   3.733
 1015    HE   ARG 136           HE       ARG 136  -1.370 -10.983   4.524
 1016    HB2  ARG 136           HB2      ARG 136   1.017 -11.569   0.932
 1017    HB3  ARG 136           HB1      ARG 136   0.079 -12.316   2.216
 1018    HG2  ARG 136           HG2      ARG 136   1.050  -9.485   2.026
 1019    HG3  ARG 136           HG1      ARG 136  -0.608 -10.075   2.140
 1020    HD2  ARG 136           HD2      ARG 136   1.484 -10.257   4.305
 1021    HD3  ARG 136           HD1      ARG 136   0.158  -9.101   4.252
 1022   HH11  ARG 136          HH11      ARG 136   2.021 -11.549   5.262
 1023   HH12  ARG 136          HH12      ARG 136   1.702 -12.864   6.352
 1024   HH21  ARG 136          HH21      ARG 136  -1.794 -12.686   5.972
 1025   HH22  ARG 136          HH22      ARG 136  -0.485 -13.502   6.770
 1026    H    ARG 137           HN       ARG 137   3.861 -13.684   3.625
 1027    HA   ARG 137           HA       ARG 137   3.767 -15.614   1.476
 1028    HE   ARG 137           HE       ARG 137   7.488 -14.485   4.086
 1029    HB2  ARG 137           HB2      ARG 137   5.430 -15.289   3.938
 1030    HB3  ARG 137           HB1      ARG 137   5.306 -16.887   3.219
 1031    HG2  ARG 137           HG2      ARG 137   7.172 -16.095   2.196
 1032    HG3  ARG 137           HG1      ARG 137   5.949 -15.620   1.024
 1033    HD2  ARG 137           HD2      ARG 137   7.396 -13.753   1.326
 1034    HD3  ARG 137           HD1      ARG 137   5.883 -13.387   2.145
 1035   HH11  ARG 137          HH11      ARG 137   7.748 -11.733   1.908
 1036   HH12  ARG 137          HH12      ARG 137   8.748 -10.824   3.002
 1037   HH21  ARG 137          HH21      ARG 137   8.792 -13.243   5.510
 1038   HH22  ARG 137          HH22      ARG 137   9.293 -11.641   5.038
 1039    H    HIS 138           HN       HIS 138   1.858 -16.682   1.458
 1040    HA   HIS 138           HA       HIS 138   1.089 -18.064   3.926
 1041    HD1  HIS 138           HD1      HIS 138  -2.138 -17.802   4.513
 1042    HD2  HIS 138           HD2      HIS 138  -1.207 -20.646   1.619
 1043    HE1  HIS 138           HE1      HIS 138  -3.613 -19.781   5.003
 1044    HE2  HIS 138           HE2      HIS 138  -2.923 -21.541   3.336
 1045    HB2  HIS 138           HB2      HIS 138  -0.696 -16.896   2.634
 1046    HB3  HIS 138           HB1      HIS 138  -0.367 -17.948   1.264
 1047    H    GLU 139           HN       GLU 139   2.635 -19.639   4.071
 1048    HA   GLU 139           HA       GLU 139   2.735 -21.574   1.861
 1049    HB2  GLU 139           HB2      GLU 139   4.744 -21.206   4.089
 1050    HB3  GLU 139           HB1      GLU 139   4.909 -22.250   2.685
 1051    HG2  GLU 139           HG2      GLU 139   4.829 -19.239   2.669
 1052    HG3  GLU 139           HG1      GLU 139   6.246 -20.253   2.420
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1 -13.227 -10.207  64.564
    2    H2   GLY   1           HT2      GLY   1 -14.672 -10.038  63.693
    3    H3   GLY   1           HT3      GLY   1 -14.027  -8.711  64.527
    4    HA2  GLY   1           HA1      GLY   1 -13.641  -8.571  62.122
    5    HA3  GLY   1           HA2      GLY   1 -12.155  -8.595  63.060
    6    HA   PRO   2           HA       PRO   2 -12.106 -12.080  59.859
    7    HB2  PRO   2           HB2      PRO   2  -9.952 -10.547  58.586
    8    HB3  PRO   2           HB1      PRO   2 -11.399 -11.255  57.863
    9    HG2  PRO   2           HG2      PRO   2 -11.092  -8.588  58.135
   10    HG3  PRO   2           HG1      PRO   2 -12.674  -9.377  58.249
   11    HD2  PRO   2           HD2      PRO   2 -10.875  -8.411  60.442
   12    HD3  PRO   2           HD1      PRO   2 -12.641  -8.264  60.287
   13    H    LEU   3           HN       LEU   3 -11.084 -13.602  61.026
   14    HA   LEU   3           HA       LEU   3  -8.333 -13.039  61.937
   15    HG   LEU   3           HG       LEU   3  -8.934 -14.574  65.249
   16    HB2  LEU   3           HB2      LEU   3 -10.294 -13.497  63.605
   17    HB3  LEU   3           HB1      LEU   3 -10.086 -15.168  63.130
   18   HD11  LEU   3          HD11      LEU   3  -7.086 -15.385  63.009
   19   HD12  LEU   3          HD12      LEU   3  -8.131 -16.459  63.940
   20   HD13  LEU   3          HD13      LEU   3  -6.795 -15.625  64.733
   21   HD21  LEU   3          HD21      LEU   3  -8.340 -12.274  64.656
   22   HD22  LEU   3          HD22      LEU   3  -7.175 -12.883  63.478
   23   HD23  LEU   3          HD23      LEU   3  -6.941 -13.199  65.198
   24    H    GLY   4           HN       GLY   4  -6.976 -13.933  60.516
   25    HA2  GLY   4           HA2      GLY   4  -5.756 -15.834  59.821
   26    HA3  GLY   4           HA1      GLY   4  -7.191 -16.818  60.069
   27    H    SER   5           HN       SER   5  -8.064 -14.045  58.500
   28    HA   SER   5           HA       SER   5  -8.592 -15.437  56.060
   29    HG   SER   5           HG       SER   5 -10.612 -14.864  56.870
   30    HB2  SER   5           HB2      SER   5  -8.996 -12.542  56.847
   31    HB3  SER   5           HB1      SER   5  -9.586 -13.262  55.348
   32    H    GLU   6           HN       GLU   6  -7.500 -15.455  54.249
   33    HA   GLU   6           HA       GLU   6  -4.857 -14.445  54.134
   34    HB2  GLU   6           HB2      GLU   6  -6.665 -15.790  52.136
   35    HB3  GLU   6           HB1      GLU   6  -5.064 -15.211  51.687
   36    HG2  GLU   6           HG2      GLU   6  -5.524 -17.098  53.972
   37    HG3  GLU   6           HG1      GLU   6  -5.255 -17.645  52.315
   38    H    SER   7           HN       SER   7  -4.330 -12.412  53.801
   39    HA   SER   7           HA       SER   7  -6.065 -10.526  52.532
   40    HG   SER   7           HG       SER   7  -3.842 -10.620  55.127
   41    HB2  SER   7           HB2      SER   7  -3.127 -10.164  53.167
   42    HB3  SER   7           HB1      SER   7  -4.351  -8.907  52.985
   43    H    LEU   8           HN       LEU   8  -6.421 -10.689  50.427
   44    HA   LEU   8           HA       LEU   8  -4.370 -11.719  48.659
   45    HG   LEU   8           HG       LEU   8  -5.768 -10.758  46.032
   46    HB2  LEU   8           HB2      LEU   8  -6.703 -12.414  48.383
   47    HB3  LEU   8           HB1      LEU   8  -7.172 -10.753  48.090
   48   HD11  LEU   8          HD11      LEU   8  -5.011 -12.922  45.149
   49   HD12  LEU   8          HD12      LEU   8  -5.481 -13.692  46.667
   50   HD13  LEU   8          HD13      LEU   8  -4.188 -12.493  46.650
   51   HD21  LEU   8          HD21      LEU   8  -7.901 -12.883  46.204
   52   HD22  LEU   8          HD22      LEU   8  -7.294 -12.164  44.713
   53   HD23  LEU   8          HD23      LEU   8  -8.155 -11.167  45.884
   54    H    MET   9           HN       MET   9  -3.175 -10.572  47.256
   55    HA   MET   9           HA       MET   9  -3.474  -7.657  47.299
   56    HB2  MET   9           HB2      MET   9  -1.154  -9.404  46.454
   57    HB3  MET   9           HB1      MET   9  -1.173  -7.653  46.307
   58    HG2  MET   9           HG2      MET   9  -1.337  -7.422  48.710
   59    HG3  MET   9           HG1      MET   9  -1.430  -9.172  48.895
   60    HE1  MET   9           HE1      MET   9   2.144 -10.307  47.760
   61    HE2  MET   9           HE2      MET   9   0.710 -10.177  46.741
   62    HE3  MET   9           HE3      MET   9   0.573 -10.825  48.375
   63    HA   PRO  10           HA       PRO  10  -5.341  -7.978  43.226
   64    HB2  PRO  10           HB2      PRO  10  -5.026  -5.261  42.709
   65    HB3  PRO  10           HB1      PRO  10  -6.423  -5.997  43.495
   66    HG2  PRO  10           HG2      PRO  10  -4.067  -4.625  44.711
   67    HG3  PRO  10           HG1      PRO  10  -5.772  -4.580  45.201
   68    HD2  PRO  10           HD2      PRO  10  -3.972  -6.053  46.534
   69    HD3  PRO  10           HD1      PRO  10  -5.638  -6.621  46.296
   70    H    SER  11           HN       SER  11  -4.053  -8.914  41.775
   71    HA   SER  11           HA       SER  11  -1.353  -7.955  41.382
   72    HG   SER  11           HG       SER  11  -2.259 -10.089  42.492
   73    HB2  SER  11           HB2      SER  11  -2.805 -10.220  39.993
   74    HB3  SER  11           HB1      SER  11  -1.064  -9.930  40.000
   75    H    GLN  12           HN       GLN  12  -1.685  -5.930  40.449
   76    HA   GLN  12           HA       GLN  12  -2.998  -5.813  37.853
   77    HB2  GLN  12           HB2      GLN  12  -1.581  -3.628  39.390
   78    HB3  GLN  12           HB1      GLN  12  -2.557  -3.404  37.947
   79    HG2  GLN  12           HG2      GLN  12  -4.520  -4.232  39.205
   80    HG3  GLN  12           HG1      GLN  12  -3.518  -4.319  40.652
   81   HE21  GLN  12          HE21      GLN  12  -3.216  -1.807  38.246
   82   HE22  GLN  12          HE22      GLN  12  -3.806  -0.519  39.234
   83    H    VAL  13           HN       VAL  13  -1.759  -6.825  36.378
   84    HA   VAL  13           HA       VAL  13   1.123  -6.462  36.439
   85    HB   VAL  13           HB       VAL  13   1.144  -8.138  34.582
   86   HG11  VAL  13          HG11      VAL  13  -0.274  -8.982  37.100
   87   HG12  VAL  13          HG12      VAL  13   1.468  -8.800  36.904
   88   HG13  VAL  13          HG13      VAL  13   0.607 -10.046  36.002
   89   HG21  VAL  13          HG21      VAL  13  -1.811  -8.311  35.170
   90   HG22  VAL  13          HG22      VAL  13  -0.903  -9.440  34.161
   91   HG23  VAL  13          HG23      VAL  13  -1.077  -7.755  33.667
   92    H    VAL  14           HN       VAL  14   2.168  -5.041  35.222
   93    HA   VAL  14           HA       VAL  14   0.800  -3.647  33.094
   94    HB   VAL  14           HB       VAL  14   3.714  -3.491  33.911
   95   HG11  VAL  14          HG11      VAL  14   3.719  -1.363  32.692
   96   HG12  VAL  14          HG12      VAL  14   2.052  -1.647  32.194
   97   HG13  VAL  14          HG13      VAL  14   3.335  -2.716  31.626
   98   HG21  VAL  14          HG21      VAL  14   3.085  -1.441  35.079
   99   HG22  VAL  14          HG22      VAL  14   2.225  -2.838  35.729
  100   HG23  VAL  14          HG23      VAL  14   1.397  -1.714  34.653
  101    H    LYS  15           HN       LYS  15   0.362  -4.981  31.479
  102    HA   LYS  15           HA       LYS  15   2.453  -6.808  30.511
  103    HB2  LYS  15           HB2      LYS  15   0.461  -7.912  31.367
  104    HB3  LYS  15           HB1      LYS  15  -0.567  -6.928  30.342
  105    HG2  LYS  15           HG2      LYS  15   0.268  -8.023  28.367
  106    HG3  LYS  15           HG1      LYS  15   1.446  -8.920  29.328
  107    HD2  LYS  15           HD2      LYS  15  -0.460 -10.330  28.814
  108    HD3  LYS  15           HD1      LYS  15  -0.384 -10.010  30.548
  109    HE2  LYS  15           HE2      LYS  15  -2.659  -9.804  29.924
  110    HE3  LYS  15           HE1      LYS  15  -2.061  -8.163  30.156
  111    HZ1  LYS  15           HZ1      LYS  15  -1.797  -7.984  27.740
  112    HZ2  LYS  15           HZ2      LYS  15  -3.404  -8.301  28.174
  113    HZ3  LYS  15           HZ3      LYS  15  -2.431  -9.545  27.554
  114    H    GLY  16           HN       GLY  16   3.011  -6.824  28.349
  115    HA2  GLY  16           HA2      GLY  16   2.402  -4.563  26.737
  116    HA3  GLY  16           HA1      GLY  16   3.210  -6.032  26.193
  117    H    GLY  17           HN       GLY  17   0.769  -4.220  25.356
  118    HA2  GLY  17           HA2      GLY  17  -0.990  -4.804  23.906
  119    HA3  GLY  17           HA1      GLY  17  -0.839  -6.476  24.437
  120    H    ALA  18           HN       ALA  18  -0.975  -3.798  26.656
  121    HA   ALA  18           HA       ALA  18  -3.077  -4.894  28.171
  122    HB1  ALA  18           HB1      ALA  18  -1.430  -3.345  29.101
  123    HB2  ALA  18           HB2      ALA  18  -3.075  -2.777  29.379
  124    HB3  ALA  18           HB3      ALA  18  -2.090  -2.043  28.112
  125    H    PHE  19           HN       PHE  19  -5.194  -4.877  27.857
  126    HA   PHE  19           HA       PHE  19  -6.276  -3.383  25.620
  127    HD1  PHE  19           HD2      PHE  19  -7.543  -4.970  23.751
  128    HD2  PHE  19           HD1      PHE  19  -9.892  -4.653  27.281
  129    HE1  PHE  19           HE2      PHE  19  -9.557  -4.626  22.378
  130    HE2  PHE  19           HE1      PHE  19 -11.906  -4.304  25.918
  131    HZ   PHE  19           HZ       PHE  19 -11.741  -4.340  23.449
  132    HB2  PHE  19           HB2      PHE  19  -6.772  -5.817  25.983
  133    HB3  PHE  19           HB1      PHE  19  -7.673  -5.366  27.425
  134    H    ASP  20           HN       ASP  20  -7.483  -1.604  25.799
  135    HA   ASP  20           HA       ASP  20  -7.761  -0.337  28.337
  136    HB2  ASP  20           HB2      ASP  20  -7.344   1.027  26.380
  137    HB3  ASP  20           HB1      ASP  20  -8.810   0.435  25.610
  138    H    GLY  21           HN       GLY  21  -9.275  -0.783  29.766
  139    HA2  GLY  21           HA2      GLY  21 -11.883  -1.764  28.812
  140    HA3  GLY  21           HA1      GLY  21 -11.234  -2.023  30.427
  141    H    THR  22           HN       THR  22 -12.148   0.613  28.232
  142    HA   THR  22           HA       THR  22 -12.636   2.373  30.472
  143    HB   THR  22           HB       THR  22 -11.618   3.184  28.333
  144    HG1  THR  22           HG1      THR  22 -12.361   4.992  29.102
  145   HG21  THR  22          HG21      THR  22 -13.128   3.653  26.438
  146   HG22  THR  22          HG22      THR  22 -14.411   2.768  27.262
  147   HG23  THR  22          HG23      THR  22 -12.952   1.924  26.738
  148    H    MET  23           HN       MET  23 -14.643   3.384  30.912
  149    HA   MET  23           HA       MET  23 -16.970   1.787  30.089
  150    HB2  MET  23           HB2      MET  23 -18.056   2.501  32.157
  151    HB3  MET  23           HB1      MET  23 -16.529   1.709  32.505
  152    HG2  MET  23           HG2      MET  23 -16.901   4.694  32.425
  153    HG3  MET  23           HG1      MET  23 -17.003   3.719  33.887
  154    HE1  MET  23           HE1      MET  23 -15.056   6.217  33.621
  155    HE2  MET  23           HE2      MET  23 -13.605   5.563  34.378
  156    HE3  MET  23           HE3      MET  23 -15.191   5.207  35.064
  157    H    ASN  24           HN       ASN  24 -18.781   2.811  29.284
  158    HA   ASN  24           HA       ASN  24 -18.242   5.561  28.380
  159    HB2  ASN  24           HB2      ASN  24 -18.638   3.608  26.745
  160    HB3  ASN  24           HB1      ASN  24 -20.327   3.724  27.226
  161   HD21  ASN  24          HD21      ASN  24 -18.977   4.203  24.649
  162   HD22  ASN  24          HD22      ASN  24 -19.422   5.818  24.191
  163    H    GLY  25           HN       GLY  25 -19.724   7.193  28.661
  164    HA2  GLY  25           HA2      GLY  25 -22.001   7.862  29.208
  165    HA3  GLY  25           HA1      GLY  25 -22.043   6.540  30.354
  166    HA   PRO  26           HA       PRO  26 -19.894   9.344  33.264
  167    HB2  PRO  26           HB2      PRO  26 -17.189   9.971  32.526
  168    HB3  PRO  26           HB1      PRO  26 -17.748   8.801  33.720
  169    HG2  PRO  26           HG2      PRO  26 -16.475   8.139  31.377
  170    HG3  PRO  26           HG1      PRO  26 -17.552   7.053  32.270
  171    HD2  PRO  26           HD2      PRO  26 -18.135   8.747  29.870
  172    HD3  PRO  26           HD1      PRO  26 -18.641   7.080  30.221
  173    H    PHE  27           HN       PHE  27 -19.364  10.427  30.036
  174    HA   PHE  27           HA       PHE  27 -19.647  13.212  30.924
  175    HD1  PHE  27           HD1      PHE  27 -18.035  15.233  30.802
  176    HD2  PHE  27           HD2      PHE  27 -18.103  13.669  26.846
  177    HE1  PHE  27           HE1      PHE  27 -17.931  17.519  29.905
  178    HE2  PHE  27           HE2      PHE  27 -17.998  15.954  25.940
  179    HZ   PHE  27           HZ       PHE  27 -17.913  17.884  27.466
  180    HB2  PHE  27           HB2      PHE  27 -17.333  12.796  30.162
  181    HB3  PHE  27           HB1      PHE  27 -17.951  12.213  28.624
  182    H    GLY  28           HN       GLY  28 -20.815  14.583  29.448
  183    HA2  GLY  28           HA2      GLY  28 -23.014  13.297  28.186
  184    HA3  GLY  28           HA1      GLY  28 -22.624  15.013  28.092
  185    H    HIS  29           HN       HIS  29 -22.988  12.286  26.304
  186    HA   HIS  29           HA       HIS  29 -21.229  13.299  24.180
  187    HD1  HIS  29           HD1      HIS  29 -18.260  11.619  24.201
  188    HD2  HIS  29           HD2      HIS  29 -21.329  10.254  21.739
  189    HE1  HIS  29           HE1      HIS  29 -17.192  11.154  21.973
  190    HE2  HIS  29           HE2      HIS  29 -19.029  10.195  20.537
  191    HB2  HIS  29           HB2      HIS  29 -20.399  11.196  25.457
  192    HB3  HIS  29           HB1      HIS  29 -21.691  10.353  24.613
  193    H    GLY  30           HN       GLY  30 -21.958  12.907  22.063
  194    HA2  GLY  30           HA2      GLY  30 -24.724  13.024  21.609
  195    HA3  GLY  30           HA1      GLY  30 -23.496  12.737  20.387
  196    H    TYR  31           HN       TYR  31 -25.406  11.419  19.600
  197    HA   TYR  31           HA       TYR  31 -26.308   9.105  20.888
  198    HD1  TYR  31           HD1      TYR  31 -28.877   9.829  20.310
  199    HD2  TYR  31           HD2      TYR  31 -26.551  11.626  17.238
  200    HE1  TYR  31           HE1      TYR  31 -30.414  11.744  20.283
  201    HE2  TYR  31           HE2      TYR  31 -28.078  13.557  17.207
  202    HH   TYR  31           HH       TYR  31 -30.408  14.079  17.812
  203    HB2  TYR  31           HB2      TYR  31 -26.080   9.436  17.899
  204    HB3  TYR  31           HB1      TYR  31 -27.279   8.507  18.793
  205    H    GLY  32           HN       GLY  32 -25.974   6.853  20.001
  206    HA2  GLY  32           HA2      GLY  32 -23.353   6.010  20.441
  207    HA3  GLY  32           HA1      GLY  32 -24.615   5.037  19.699
  208    H    GLU  33           HN       GLU  33 -21.688   6.607  19.231
  209    HA   GLU  33           HA       GLU  33 -21.908   6.973  16.386
  210    HB2  GLU  33           HB2      GLU  33 -19.378   7.399  16.657
  211    HB3  GLU  33           HB1      GLU  33 -20.497   8.532  17.404
  212    HG2  GLU  33           HG2      GLU  33 -20.177   7.416  19.563
  213    HG3  GLU  33           HG1      GLU  33 -19.032   6.305  18.813
  214    H    GLY  34           HN       GLY  34 -21.785   5.386  14.994
  215    HA2  GLY  34           HA2      GLY  34 -20.723   2.807  15.790
  216    HA3  GLY  34           HA1      GLY  34 -21.565   3.182  14.293
  217    H    ALA  35           HN       ALA  35 -18.781   2.105  15.386
  218    HA   ALA  35           HA       ALA  35 -17.041   3.587  13.576
  219    HB1  ALA  35           HB1      ALA  35 -16.388   1.346  15.488
  220    HB2  ALA  35           HB2      ALA  35 -16.204   3.067  15.822
  221    HB3  ALA  35           HB3      ALA  35 -15.226   2.301  14.569
  222    H    GLY  36           HN       GLY  36 -15.634   2.330  12.103
  223    HA2  GLY  36           HA2      GLY  36 -17.131   0.061  10.957
  224    HA3  GLY  36           HA1      GLY  36 -16.133   1.168  10.026
  225    H    GLU  37           HN       GLU  37 -16.256  -1.833  11.367
  226    HA   GLU  37           HA       GLU  37 -13.472  -2.092  12.033
  227    HB2  GLU  37           HB2      GLU  37 -14.117  -4.569  12.135
  228    HB3  GLU  37           HB1      GLU  37 -14.850  -3.486  13.309
  229    HG2  GLU  37           HG2      GLU  37 -16.856  -3.376  11.823
  230    HG3  GLU  37           HG1      GLU  37 -16.113  -4.630  10.830
  231    H    GLY  38           HN       GLY  38 -12.529  -4.328  10.938
  232    HA2  GLY  38           HA2      GLY  38 -11.974  -3.310   8.288
  233    HA3  GLY  38           HA1      GLY  38 -11.136  -4.625   9.086
  234    H    ILE  39           HN       ILE  39 -14.309  -3.852   7.726
  235    HA   ILE  39           HA       ILE  39 -14.736  -6.515   6.815
  236    HB   ILE  39           HB       ILE  39 -16.355  -5.285   5.157
  237   HG12  ILE  39          HG12      ILE  39 -17.227  -3.156   6.140
  238   HG13  ILE  39          HG11      ILE  39 -15.839  -3.120   7.213
  239   HG21  ILE  39          HG21      ILE  39 -16.833  -5.345   8.128
  240   HG22  ILE  39          HG22      ILE  39 -17.054  -6.688   7.009
  241   HG23  ILE  39          HG23      ILE  39 -18.082  -5.260   6.888
  242   HD11  ILE  39          HD11      ILE  39 -15.586  -1.628   5.302
  243   HD12  ILE  39          HD12      ILE  39 -15.723  -3.006   4.209
  244   HD13  ILE  39          HD13      ILE  39 -14.352  -2.887   5.312
  245    H    ASP  40           HN       ASP  40 -14.707  -7.144   4.476
  246    HA   ASP  40           HA       ASP  40 -12.120  -6.405   3.495
  247    HB2  ASP  40           HB2      ASP  40 -12.609  -8.069   1.665
  248    HB3  ASP  40           HB1      ASP  40 -12.645  -8.707   3.302
  249    H    ASP  41           HN       ASP  41 -12.792  -4.151   3.281
  250    HA   ASP  41           HA       ASP  41 -13.720  -3.621   0.517
  251    HB2  ASP  41           HB2      ASP  41 -14.906  -2.401   2.376
  252    HB3  ASP  41           HB1      ASP  41 -13.375  -1.658   2.812
  253    H    VAL  42           HN       VAL  42 -11.708  -4.301  -0.372
  254    HA   VAL  42           HA       VAL  42  -9.365  -2.743   0.506
  255    HB   VAL  42           HB       VAL  42  -9.350  -5.594  -0.489
  256   HG11  VAL  42          HG11      VAL  42  -7.311  -4.382  -1.056
  257   HG12  VAL  42          HG12      VAL  42  -6.995  -5.587   0.193
  258   HG13  VAL  42          HG13      VAL  42  -7.127  -3.883   0.625
  259   HG21  VAL  42          HG21      VAL  42  -8.971  -4.529   2.307
  260   HG22  VAL  42          HG22      VAL  42  -8.780  -6.211   1.810
  261   HG23  VAL  42          HG23      VAL  42 -10.363  -5.440   1.723
  262    H    GLU  43           HN       GLU  43  -9.038  -1.289  -1.025
  263    HA   GLU  43           HA       GLU  43  -8.136  -2.370  -3.578
  264    HB2  GLU  43           HB2      GLU  43 -10.288  -1.357  -4.146
  265    HB3  GLU  43           HB1      GLU  43  -9.838   0.124  -3.306
  266    HG2  GLU  43           HG2      GLU  43  -8.006   0.463  -4.918
  267    HG3  GLU  43           HG1      GLU  43  -8.514  -0.991  -5.771
  268    H    TRP  44           HN       TRP  44  -5.997  -2.104  -3.223
  269    HA   TRP  44           HA       TRP  44  -5.106   0.312  -1.874
  270    HD1  TRP  44           HD1      TRP  44  -3.258   1.550  -1.666
  271    HE1  TRP  44           HE1      TRP  44  -0.881   2.108  -0.862
  272    HE3  TRP  44           HE3      TRP  44  -1.303  -3.136  -1.613
  273    HZ2  TRP  44           HZ2      TRP  44   1.518   0.726  -0.303
  274    HZ3  TRP  44           HZ3      TRP  44   1.040  -3.438  -0.980
  275    HH2  TRP  44           HH2      TRP  44   2.424  -1.551  -0.313
  276    HB2  TRP  44           HB2      TRP  44  -4.050  -1.910  -1.378
  277    HB3  TRP  44           HB1      TRP  44  -3.389  -1.891  -3.013
  278    H    VAL  45           HN       VAL  45  -4.196   1.968  -2.768
  279    HA   VAL  45           HA       VAL  45  -4.582   2.497  -5.518
  280    HB   VAL  45           HB       VAL  45  -2.951   4.113  -3.567
  281   HG11  VAL  45          HG11      VAL  45  -3.707   6.025  -4.896
  282   HG12  VAL  45          HG12      VAL  45  -4.601   4.936  -5.955
  283   HG13  VAL  45          HG13      VAL  45  -2.843   4.854  -5.894
  284   HG21  VAL  45          HG21      VAL  45  -5.949   4.056  -3.914
  285   HG22  VAL  45          HG22      VAL  45  -5.068   5.276  -2.997
  286   HG23  VAL  45          HG23      VAL  45  -5.045   3.592  -2.472
  287    H    VAL  46           HN       VAL  46  -2.098   0.834  -3.963
  288    HA   VAL  46           HA       VAL  46  -0.027   1.700  -5.779
  289    HB   VAL  46           HB       VAL  46  -0.101  -0.293  -3.515
  290   HG11  VAL  46          HG11      VAL  46   1.046  -1.486  -5.316
  291   HG12  VAL  46          HG12      VAL  46   2.160  -1.021  -4.030
  292   HG13  VAL  46          HG13      VAL  46   2.129  -0.111  -5.540
  293   HG21  VAL  46          HG21      VAL  46   1.779   1.956  -4.225
  294   HG22  VAL  46          HG22      VAL  46   1.753   1.036  -2.721
  295   HG23  VAL  46          HG23      VAL  46   0.401   2.088  -3.134
  296    H    GLY  47           HN       GLY  47  -2.386  -0.867  -5.672
  297    HA2  GLY  47           HA2      GLY  47  -1.155  -2.605  -7.507
  298    HA3  GLY  47           HA1      GLY  47  -2.900  -2.458  -7.263
  299    H    LYS  48           HN       LYS  48  -2.533   0.499  -7.970
  300    HA   LYS  48           HA       LYS  48  -2.647   0.127 -10.861
  301    HB2  LYS  48           HB2      LYS  48  -3.582   2.512 -10.718
  302    HB3  LYS  48           HB1      LYS  48  -4.596   1.188 -10.179
  303    HG2  LYS  48           HG2      LYS  48  -4.177   1.734  -7.887
  304    HG3  LYS  48           HG1      LYS  48  -2.946   2.907  -8.355
  305    HD2  LYS  48           HD2      LYS  48  -5.078   3.968  -7.734
  306    HD3  LYS  48           HD1      LYS  48  -4.607   4.307  -9.397
  307    HE2  LYS  48           HE2      LYS  48  -6.939   3.842  -9.420
  308    HE3  LYS  48           HE1      LYS  48  -6.130   2.437 -10.110
  309    HZ1  LYS  48           HZ1      LYS  48  -7.845   1.754  -8.582
  310    HZ2  LYS  48           HZ2      LYS  48  -7.167   2.680  -7.335
  311    HZ3  LYS  48           HZ3      LYS  48  -6.332   1.331  -7.945
  312    H    ASP  49           HN       ASP  49  -0.769   1.705  -8.387
  313    HA   ASP  49           HA       ASP  49   0.533   3.411 -10.400
  314    HB2  ASP  49           HB2      ASP  49  -0.622   4.366  -8.284
  315    HB3  ASP  49           HB1      ASP  49   0.778   3.755  -7.414
  316    H    LYS  50           HN       LYS  50   0.939   0.523  -9.189
  317    HA   LYS  50           HA       LYS  50   3.451   0.388  -8.006
  318    HB2  LYS  50           HB2      LYS  50   1.764  -1.449  -8.021
  319    HB3  LYS  50           HB1      LYS  50   2.130  -1.722  -9.722
  320    HG2  LYS  50           HG2      LYS  50   4.412  -2.316  -9.164
  321    HG3  LYS  50           HG1      LYS  50   4.103  -1.979  -7.459
  322    HD2  LYS  50           HD2      LYS  50   2.488  -3.781  -7.374
  323    HD3  LYS  50           HD1      LYS  50   2.679  -4.070  -9.107
  324    HE2  LYS  50           HE2      LYS  50   4.855  -4.347  -7.034
  325    HE3  LYS  50           HE1      LYS  50   3.942  -5.674  -7.743
  326    HZ1  LYS  50           HZ1      LYS  50   6.178  -5.245  -8.742
  327    HZ2  LYS  50           HZ2      LYS  50   5.558  -3.795  -9.362
  328    HZ3  LYS  50           HZ3      LYS  50   4.889  -5.268  -9.847
  329    HA   PRO  51           HA       PRO  51   5.208  -0.578 -12.472
  330    HB2  PRO  51           HB2      PRO  51   3.986   0.909 -14.450
  331    HB3  PRO  51           HB1      PRO  51   3.675  -0.803 -14.128
  332    HG2  PRO  51           HG2      PRO  51   2.112   1.596 -13.279
  333    HG3  PRO  51           HG1      PRO  51   1.534   0.021 -13.848
  334    HD2  PRO  51           HD2      PRO  51   1.528   0.668 -11.243
  335    HD3  PRO  51           HD1      PRO  51   1.870  -0.990 -11.792
  336    H    THR  52           HN       THR  52   3.917   2.468 -11.379
  337    HA   THR  52           HA       THR  52   5.926   4.064 -12.671
  338    HB   THR  52           HB       THR  52   3.922   4.757 -10.507
  339    HG1  THR  52           HG1      THR  52   3.994   4.953 -13.328
  340   HG21  THR  52          HG21      THR  52   5.903   6.238 -10.426
  341   HG22  THR  52          HG22      THR  52   4.447   7.089 -10.946
  342   HG23  THR  52          HG23      THR  52   5.663   6.616 -12.132
  343    H    TYR  53           HN       TYR  53   5.432   2.626  -9.485
  344    HA   TYR  53           HA       TYR  53   7.811   3.888  -8.434
  345    HD1  TYR  53           HD2      TYR  53   6.416   5.208  -6.977
  346    HD2  TYR  53           HD1      TYR  53   4.302   1.550  -6.494
  347    HE1  TYR  53           HE2      TYR  53   4.439   6.447  -6.194
  348    HE2  TYR  53           HE1      TYR  53   2.331   2.784  -5.723
  349    HH   TYR  53           HH       TYR  53   1.799   5.874  -6.236
  350    HB2  TYR  53           HB2      TYR  53   6.409   1.476  -7.331
  351    HB3  TYR  53           HB1      TYR  53   7.462   2.594  -6.506
  352    H    ASP  54           HN       ASP  54   6.908   1.006 -10.078
  353    HA   ASP  54           HA       ASP  54   9.286  -0.499  -9.490
  354    HB2  ASP  54           HB2      ASP  54   7.291  -1.703 -10.040
  355    HB3  ASP  54           HB1      ASP  54   7.041  -0.771 -11.506
  356    H    GLU  55           HN       GLU  55   8.215   1.644 -12.099
  357    HA   GLU  55           HA       GLU  55  10.458   1.261 -13.782
  358    HB2  GLU  55           HB2      GLU  55   9.780   3.265 -14.910
  359    HB3  GLU  55           HB1      GLU  55   8.326   2.381 -14.465
  360    HG2  GLU  55           HG2      GLU  55   8.057   3.852 -12.496
  361    HG3  GLU  55           HG1      GLU  55   9.476   4.763 -13.049
  362    H    ILE  56           HN       ILE  56   9.808   3.548 -11.129
  363    HA   ILE  56           HA       ILE  56  12.357   4.801 -11.289
  364    HB   ILE  56           HB       ILE  56  10.614   4.510  -8.832
  365   HG12  ILE  56          HG12      ILE  56  10.686   6.761 -10.855
  366   HG13  ILE  56          HG11      ILE  56   9.451   5.496 -10.828
  367   HG21  ILE  56          HG21      ILE  56  11.759   6.578  -8.100
  368   HG22  ILE  56          HG22      ILE  56  12.787   6.492  -9.532
  369   HG23  ILE  56          HG23      ILE  56  12.877   5.229  -8.306
  370   HD11  ILE  56          HD11      ILE  56   8.790   6.232  -8.587
  371   HD12  ILE  56          HD12      ILE  56   8.644   7.520  -9.782
  372   HD13  ILE  56          HD13      ILE  56  10.002   7.510  -8.654
  373    H    PHE  57           HN       PHE  57  11.126   1.942  -9.733
  374    HA   PHE  57           HA       PHE  57  13.194   1.269  -8.009
  375    HD1  PHE  57           HD2      PHE  57  12.895  -0.854  -6.287
  376    HD2  PHE  57           HD1      PHE  57  12.110  -2.464 -10.147
  377    HE1  PHE  57           HE2      PHE  57  13.892  -2.992  -5.599
  378    HE2  PHE  57           HE1      PHE  57  13.099  -4.605  -9.458
  379    HZ   PHE  57           HZ       PHE  57  13.993  -4.872  -7.188
  380    HB2  PHE  57           HB2      PHE  57  11.130   0.090  -7.913
  381    HB3  PHE  57           HB1      PHE  57  11.250  -0.404  -9.594
  382    H    TYR  58           HN       TYR  58  12.767   0.124 -11.392
  383    HA   TYR  58           HA       TYR  58  15.343  -1.091 -11.455
  384    HD1  TYR  58           HD1      TYR  58  11.727  -1.554 -12.302
  385    HD2  TYR  58           HD2      TYR  58  15.277  -3.410 -13.717
  386    HE1  TYR  58           HE1      TYR  58  10.718  -3.753 -11.925
  387    HE2  TYR  58           HE2      TYR  58  14.273  -5.625 -13.338
  388    HH   TYR  58           HH       TYR  58  10.896  -5.975 -12.538
  389    HB2  TYR  58           HB2      TYR  58  13.417  -0.316 -13.645
  390    HB3  TYR  58           HB1      TYR  58  14.979  -1.074 -13.981
  391    H    THR  59           HN       THR  59  14.205   2.096 -11.923
  392    HA   THR  59           HA       THR  59  16.389   3.109 -13.431
  393    HB   THR  59           HB       THR  59  14.285   4.438 -11.710
  394    HG1  THR  59           HG1      THR  59  13.406   3.663 -13.580
  395   HG21  THR  59          HG21      THR  59  14.926   6.558 -12.750
  396   HG22  THR  59          HG22      THR  59  16.324   5.769 -13.489
  397   HG23  THR  59          HG23      THR  59  16.213   5.908 -11.735
  398    H    LEU  60           HN       LEU  60  15.949   2.330 -10.087
  399    HA   LEU  60           HA       LEU  60  18.215   3.943  -9.232
  400    HG   LEU  60           HG       LEU  60  15.197   3.950  -8.078
  401    HB2  LEU  60           HB2      LEU  60  16.485   1.972  -7.741
  402    HB3  LEU  60           HB1      LEU  60  17.801   2.884  -7.015
  403   HD11  LEU  60          HD11      LEU  60  15.270   2.947  -5.814
  404   HD12  LEU  60          HD12      LEU  60  14.890   4.670  -5.802
  405   HD13  LEU  60          HD13      LEU  60  16.511   4.118  -5.375
  406   HD21  LEU  60          HD21      LEU  60  16.032   6.177  -7.465
  407   HD22  LEU  60          HD22      LEU  60  16.980   5.467  -8.772
  408   HD23  LEU  60          HD23      LEU  60  17.618   5.484  -7.129
  409    H    SER  61           HN       SER  61  17.945   1.152 -10.867
  410    HA   SER  61           HA       SER  61  19.288  -0.612 -11.324
  411    HG   SER  61           HG       SER  61  22.180  -1.157 -10.029
  412    HB2  SER  61           HB2      SER  61  21.097   1.094 -11.331
  413    HB3  SER  61           HB1      SER  61  21.351   0.804  -9.612
  414    HA   PRO  62           HA       PRO  62  18.375  -2.634  -7.310
  415    HB2  PRO  62           HB2      PRO  62  16.624  -4.447  -8.270
  416    HB3  PRO  62           HB1      PRO  62  16.141  -2.799  -7.840
  417    HG2  PRO  62           HG2      PRO  62  16.603  -4.001 -10.524
  418    HG3  PRO  62           HG1      PRO  62  15.433  -2.768 -10.028
  419    HD2  PRO  62           HD2      PRO  62  17.846  -2.279 -11.327
  420    HD3  PRO  62           HD1      PRO  62  16.885  -1.080 -10.439
  421    H    VAL  63           HN       VAL  63  18.709  -4.984  -6.729
  422    HA   VAL  63           HA       VAL  63  20.330  -6.382  -8.692
  423    HB   VAL  63           HB       VAL  63  21.873  -6.987  -6.720
  424   HG11  VAL  63          HG11      VAL  63  22.606  -5.699  -8.654
  425   HG12  VAL  63          HG12      VAL  63  23.326  -5.070  -7.172
  426   HG13  VAL  63          HG13      VAL  63  21.970  -4.225  -7.918
  427   HG21  VAL  63          HG21      VAL  63  20.773  -4.370  -5.701
  428   HG22  VAL  63          HG22      VAL  63  22.112  -5.285  -5.004
  429   HG23  VAL  63          HG23      VAL  63  20.480  -5.952  -4.976
  430    H    ASN  64           HN       ASN  64  19.575  -8.320  -8.970
  431    HA   ASN  64           HA       ASN  64  18.694 -10.375  -8.551
  432    HB2  ASN  64           HB2      ASN  64  20.371 -10.530  -6.786
  433    HB3  ASN  64           HB1      ASN  64  19.333  -9.635  -5.677
  434   HD21  ASN  64          HD21      ASN  64  17.677 -10.650  -4.688
  435   HD22  ASN  64          HD22      ASN  64  17.485 -12.373  -4.672
  436    H    GLY  65           HN       GLY  65  17.186  -7.725  -8.375
  437    HA2  GLY  65           HA2      GLY  65  14.879  -7.611  -8.774
  438    HA3  GLY  65           HA1      GLY  65  14.654  -9.083  -7.855
  439    H    LYS  66           HN       LYS  66  16.526  -6.472  -6.485
  440    HA   LYS  66           HA       LYS  66  14.325  -5.063  -5.370
  441    HB2  LYS  66           HB2      LYS  66  14.311  -5.716  -3.137
  442    HB3  LYS  66           HB1      LYS  66  14.466  -7.241  -3.985
  443    HG2  LYS  66           HG2      LYS  66  16.643  -5.722  -2.576
  444    HG3  LYS  66           HG1      LYS  66  15.906  -7.245  -2.077
  445    HD2  LYS  66           HD2      LYS  66  16.808  -8.304  -4.129
  446    HD3  LYS  66           HD1      LYS  66  17.549  -6.773  -4.547
  447    HE2  LYS  66           HE2      LYS  66  19.007  -6.851  -2.691
  448    HE3  LYS  66           HE1      LYS  66  18.127  -8.198  -1.965
  449    HZ1  LYS  66           HZ1      LYS  66  19.278  -8.527  -4.636
  450    HZ2  LYS  66           HZ2      LYS  66  19.030  -9.687  -3.415
  451    HZ3  LYS  66           HZ3      LYS  66  20.321  -8.594  -3.297
  452    H    ILE  67           HN       ILE  67  15.012  -3.218  -4.058
  453    HA   ILE  67           HA       ILE  67  17.755  -2.463  -4.706
  454    HB   ILE  67           HB       ILE  67  17.032  -0.252  -3.563
  455   HG12  ILE  67          HG12      ILE  67  14.374  -1.585  -4.083
  456   HG13  ILE  67          HG11      ILE  67  14.992  -0.983  -2.548
  457   HG21  ILE  67          HG21      ILE  67  16.061   0.551  -5.687
  458   HG22  ILE  67          HG22      ILE  67  15.901  -1.120  -6.230
  459   HG23  ILE  67          HG23      ILE  67  17.500  -0.436  -5.936
  460   HD11  ILE  67          HD11      ILE  67  14.240   0.680  -4.939
  461   HD12  ILE  67          HD12      ILE  67  14.870   1.297  -3.410
  462   HD13  ILE  67          HD13      ILE  67  13.304   0.491  -3.455
  463    H    THR  68           HN       THR  68  19.373  -2.464  -3.330
  464    HA   THR  68           HA       THR  68  19.010  -3.523  -0.726
  465    HB   THR  68           HB       THR  68  21.523  -2.499  -0.661
  466    HG1  THR  68           HG1      THR  68  22.258  -2.966  -2.921
  467   HG21  THR  68          HG21      THR  68  22.286  -4.708  -1.365
  468   HG22  THR  68          HG22      THR  68  20.704  -5.052  -2.065
  469   HG23  THR  68          HG23      THR  68  20.873  -4.856  -0.320
  470    H    GLY  69           HN       GLY  69  17.483  -1.976  -0.020
  471    HA2  GLY  69           HA2      GLY  69  16.840  -0.406   1.458
  472    HA3  GLY  69           HA1      GLY  69  18.357  -0.788   2.253
  473    H    ALA  70           HN       ALA  70  20.257   0.491   1.437
  474    HA   ALA  70           HA       ALA  70  19.957   3.149   2.016
  475    HB1  ALA  70           HB1      ALA  70  22.049   1.936   0.228
  476    HB2  ALA  70           HB2      ALA  70  22.096   2.001   1.989
  477    HB3  ALA  70           HB3      ALA  70  22.169   3.492   1.050
  478    H    ASN  71           HN       ASN  71  19.461   1.663  -1.118
  479    HA   ASN  71           HA       ASN  71  19.523   4.087  -2.630
  480    HB2  ASN  71           HB2      ASN  71  18.036   1.576  -3.416
  481    HB3  ASN  71           HB1      ASN  71  18.731   2.808  -4.476
  482   HD21  ASN  71          HD21      ASN  71  19.279  -0.036  -2.659
  483   HD22  ASN  71          HD22      ASN  71  20.925  -0.279  -3.097
  484    H    ALA  72           HN       ALA  72  16.961   2.142  -1.156
  485    HA   ALA  72           HA       ALA  72  14.836   3.855  -2.020
  486    HB1  ALA  72           HB1      ALA  72  14.912   1.837   0.217
  487    HB2  ALA  72           HB2      ALA  72  14.426   1.519  -1.448
  488    HB3  ALA  72           HB3      ALA  72  13.463   2.599  -0.437
  489    H    LYS  73           HN       LYS  73  16.885   3.597   0.799
  490    HA   LYS  73           HA       LYS  73  15.636   5.566   2.376
  491    HB2  LYS  73           HB2      LYS  73  18.537   4.726   2.266
  492    HB3  LYS  73           HB1      LYS  73  17.825   5.728   3.529
  493    HG2  LYS  73           HG2      LYS  73  17.088   2.878   2.883
  494    HG3  LYS  73           HG1      LYS  73  18.031   3.431   4.267
  495    HD2  LYS  73           HD2      LYS  73  15.252   4.433   3.744
  496    HD3  LYS  73           HD1      LYS  73  15.550   2.947   4.647
  497    HE2  LYS  73           HE2      LYS  73  16.763   4.110   6.319
  498    HE3  LYS  73           HE1      LYS  73  16.788   5.599   5.367
  499    HZ1  LYS  73           HZ1      LYS  73  14.521   4.345   6.795
  500    HZ2  LYS  73           HZ2      LYS  73  14.271   5.507   5.587
  501    HZ3  LYS  73           HZ3      LYS  73  15.150   5.906   6.976
  502    H    LYS  74           HN       LYS  74  18.110   5.665  -0.106
  503    HA   LYS  74           HA       LYS  74  18.822   8.341  -0.090
  504    HB2  LYS  74           HB2      LYS  74  19.541   6.291  -1.579
  505    HB3  LYS  74           HB1      LYS  74  18.311   6.916  -2.669
  506    HG2  LYS  74           HG2      LYS  74  20.333   7.840  -3.391
  507    HG3  LYS  74           HG1      LYS  74  19.514   9.138  -2.514
  508    HD2  LYS  74           HD2      LYS  74  21.846   9.033  -1.887
  509    HD3  LYS  74           HD1      LYS  74  20.833   8.612  -0.517
  510    HE2  LYS  74           HE2      LYS  74  22.763   7.122  -0.688
  511    HE3  LYS  74           HE1      LYS  74  21.252   6.246  -0.921
  512    HZ1  LYS  74           HZ1      LYS  74  21.646   6.423  -3.353
  513    HZ2  LYS  74           HZ2      LYS  74  22.815   5.505  -2.540
  514    HZ3  LYS  74           HZ3      LYS  74  23.172   7.091  -3.022
  515    H    GLU  75           HN       GLU  75  16.209   6.715  -1.751
  516    HA   GLU  75           HA       GLU  75  15.092   8.939  -3.007
  517    HB2  GLU  75           HB2      GLU  75  13.670   6.443  -2.118
  518    HB3  GLU  75           HB1      GLU  75  13.046   7.614  -3.268
  519    HG2  GLU  75           HG2      GLU  75  15.287   5.662  -3.598
  520    HG3  GLU  75           HG1      GLU  75  13.867   5.923  -4.609
  521    H    MET  76           HN       MET  76  14.185   7.489   0.103
  522    HA   MET  76           HA       MET  76  12.202   9.475   0.613
  523    HB2  MET  76           HB2      MET  76  12.314   8.572   2.986
  524    HB3  MET  76           HB1      MET  76  11.887   7.425   1.727
  525    HG2  MET  76           HG2      MET  76  14.139   6.558   1.724
  526    HG3  MET  76           HG1      MET  76  14.615   7.741   2.932
  527    HE1  MET  76           HE1      MET  76  11.341   5.476   2.606
  528    HE2  MET  76           HE2      MET  76  11.824   4.130   3.637
  529    HE3  MET  76           HE3      MET  76  12.707   4.459   2.146
  530    H    VAL  77           HN       VAL  77  15.613   9.472   0.891
  531    HA   VAL  77           HA       VAL  77  15.810  11.689   2.709
  532    HB   VAL  77           HB       VAL  77  17.782  10.601   0.688
  533   HG11  VAL  77          HG11      VAL  77  18.264  12.948   0.924
  534   HG12  VAL  77          HG12      VAL  77  19.471  12.033   1.829
  535   HG13  VAL  77          HG13      VAL  77  18.156  12.842   2.681
  536   HG21  VAL  77          HG21      VAL  77  17.734  10.498   3.707
  537   HG22  VAL  77          HG22      VAL  77  18.997   9.833   2.668
  538   HG23  VAL  77          HG23      VAL  77  17.368   9.162   2.614
  539    H    LYS  78           HN       LYS  78  15.977  11.357  -0.836
  540    HA   LYS  78           HA       LYS  78  16.308  14.144  -1.321
  541    HB2  LYS  78           HB2      LYS  78  16.121  13.624  -3.631
  542    HB3  LYS  78           HB1      LYS  78  16.939  12.257  -2.895
  543    HG2  LYS  78           HG2      LYS  78  14.343  11.487  -2.726
  544    HG3  LYS  78           HG1      LYS  78  14.350  12.407  -4.229
  545    HD2  LYS  78           HD2      LYS  78  16.299  10.211  -3.588
  546    HD3  LYS  78           HD1      LYS  78  14.808   9.970  -4.496
  547    HE2  LYS  78           HE2      LYS  78  15.656  11.704  -6.113
  548    HE3  LYS  78           HE1      LYS  78  17.195  11.627  -5.248
  549    HZ1  LYS  78           HZ1      LYS  78  17.519   9.415  -5.881
  550    HZ2  LYS  78           HZ2      LYS  78  16.937  10.158  -7.292
  551    HZ3  LYS  78           HZ3      LYS  78  15.901   9.198  -6.345
  552    H    SER  79           HN       SER  79  13.628  12.262  -0.465
  553    HA   SER  79           HA       SER  79  11.550  13.867  -1.536
  554    HG   SER  79           HG       SER  79   9.777  13.810   0.334
  555    HB2  SER  79           HB2      SER  79  11.136  11.604  -0.670
  556    HB3  SER  79           HB1      SER  79  11.578  12.140   0.955
  557    H    LYS  80           HN       LYS  80  13.919  14.513   0.728
  558    HA   LYS  80           HA       LYS  80  14.414  16.321   1.985
  559    HB2  LYS  80           HB2      LYS  80  11.919  17.537   0.782
  560    HB3  LYS  80           HB1      LYS  80  13.185  18.411   1.642
  561    HG2  LYS  80           HG2      LYS  80  14.770  17.965  -0.058
  562    HG3  LYS  80           HG1      LYS  80  13.688  16.817  -0.850
  563    HD2  LYS  80           HD2      LYS  80  12.124  18.677  -1.302
  564    HD3  LYS  80           HD1      LYS  80  13.296  19.797  -0.598
  565    HE2  LYS  80           HE2      LYS  80  13.372  19.690  -3.082
  566    HE3  LYS  80           HE1      LYS  80  14.898  19.279  -2.307
  567    HZ1  LYS  80           HZ1      LYS  80  14.117  17.798  -4.204
  568    HZ2  LYS  80           HZ2      LYS  80  12.972  17.189  -3.116
  569    HZ3  LYS  80           HZ3      LYS  80  14.624  17.025  -2.782
  570    H    LEU  81           HN       LEU  81  13.836  14.706   3.643
  571    HA   LEU  81           HA       LEU  81  11.560  15.618   5.270
  572    HG   LEU  81           HG       LEU  81  11.374  13.523   2.881
  573    HB2  LEU  81           HB2      LEU  81  12.455  12.758   5.012
  574    HB3  LEU  81           HB1      LEU  81  11.054  13.350   5.877
  575   HD11  LEU  81          HD11      LEU  81   9.839  11.502   4.503
  576   HD12  LEU  81          HD12      LEU  81  11.321  11.190   3.602
  577   HD13  LEU  81          HD13      LEU  81   9.846  11.642   2.747
  578   HD21  LEU  81          HD21      LEU  81   8.952  13.920   2.919
  579   HD22  LEU  81          HD22      LEU  81   9.840  15.166   3.796
  580   HD23  LEU  81          HD23      LEU  81   8.982  13.904   4.682
  581    HA   PRO  82           HA       PRO  82  14.516  15.234   8.652
  582    HB2  PRO  82           HB2      PRO  82  12.814  14.842  10.717
  583    HB3  PRO  82           HB1      PRO  82  13.015  16.430   9.951
  584    HG2  PRO  82           HG2      PRO  82  10.863  14.385   9.544
  585    HG3  PRO  82           HG1      PRO  82  10.723  16.143   9.684
  586    HD2  PRO  82           HD2      PRO  82  10.675  14.817   7.317
  587    HD3  PRO  82           HD1      PRO  82  11.261  16.491   7.488
  588    H    ASN  83           HN       ASN  83  15.149  13.607  10.284
  589    HA   ASN  83           HA       ASN  83  15.178  11.020   9.140
  590    HB2  ASN  83           HB2      ASN  83  16.002  11.996  11.877
  591    HB3  ASN  83           HB1      ASN  83  16.271  10.353  11.311
  592   HD21  ASN  83          HD21      ASN  83  16.853  11.108   8.589
  593   HD22  ASN  83          HD22      ASN  83  18.422  11.837   8.603
  594    H    THR  84           HN       THR  84  13.117  12.509  11.492
  595    HA   THR  84           HA       THR  84  11.980  10.249  12.684
  596    HB   THR  84           HB       THR  84  10.197  12.542  12.111
  597    HG1  THR  84           HG1      THR  84  11.981  13.264  14.031
  598   HG21  THR  84          HG21      THR  84  11.095  11.139  14.634
  599   HG22  THR  84          HG22      THR  84   9.584  10.871  13.764
  600   HG23  THR  84          HG23      THR  84   9.878  12.415  14.561
  601    H    VAL  85           HN       VAL  85  10.849  12.176   9.915
  602    HA   VAL  85           HA       VAL  85   8.683  10.504   9.210
  603    HB   VAL  85           HB       VAL  85  10.238  12.430   7.477
  604   HG11  VAL  85          HG11      VAL  85   8.923  10.794   6.193
  605   HG12  VAL  85          HG12      VAL  85   8.289  12.433   6.042
  606   HG13  VAL  85          HG13      VAL  85   7.483  11.270   7.093
  607   HG21  VAL  85          HG21      VAL  85   9.240  13.446   9.498
  608   HG22  VAL  85          HG22      VAL  85   7.665  12.820   9.011
  609   HG23  VAL  85          HG23      VAL  85   8.484  14.021   8.012
  610    H    LEU  86           HN       LEU  86  11.999  10.748   7.955
  611    HA   LEU  86           HA       LEU  86  11.922   8.783   6.012
  612    HG   LEU  86           HG       LEU  86  13.490   9.539   4.824
  613    HB2  LEU  86           HB2      LEU  86  13.959  10.054   7.645
  614    HB3  LEU  86           HB1      LEU  86  14.388   8.410   7.183
  615   HD11  LEU  86          HD11      LEU  86  15.184  11.545   6.305
  616   HD12  LEU  86          HD12      LEU  86  13.503  11.762   5.812
  617   HD13  LEU  86          HD13      LEU  86  14.767  11.606   4.592
  618   HD21  LEU  86          HD21      LEU  86  16.273   9.238   5.920
  619   HD22  LEU  86          HD22      LEU  86  15.857   9.405   4.211
  620   HD23  LEU  86          HD23      LEU  86  15.316   7.992   5.121
  621    H    GLY  87           HN       GLY  87  12.781   8.397   9.444
  622    HA2  GLY  87           HA2      GLY  87  13.303   5.643   9.323
  623    HA3  GLY  87           HA1      GLY  87  12.895   6.540  10.775
  624    H    LYS  88           HN       LYS  88  10.276   7.394   9.752
  625    HA   LYS  88           HA       LYS  88   8.993   4.885  10.490
  626    HB2  LYS  88           HB2      LYS  88   7.052   6.057  11.106
  627    HB3  LYS  88           HB1      LYS  88   8.414   6.957  11.736
  628    HG2  LYS  88           HG2      LYS  88   8.144   8.669  10.129
  629    HG3  LYS  88           HG1      LYS  88   6.994   7.696   9.201
  630    HD2  LYS  88           HD2      LYS  88   5.388   7.770  10.988
  631    HD3  LYS  88           HD1      LYS  88   6.550   8.551  12.056
  632    HE2  LYS  88           HE2      LYS  88   6.525  10.535  10.620
  633    HE3  LYS  88           HE1      LYS  88   5.357   9.746   9.558
  634    HZ1  LYS  88           HZ1      LYS  88   3.743   9.732  11.283
  635    HZ2  LYS  88           HZ2      LYS  88   4.364  11.309  11.227
  636    HZ3  LYS  88           HZ3      LYS  88   4.867  10.240  12.443
  637    H    ILE  89           HN       ILE  89   9.363   6.907   7.717
  638    HA   ILE  89           HA       ILE  89   7.313   5.682   6.182
  639    HB   ILE  89           HB       ILE  89   9.847   7.108   5.395
  640   HG12  ILE  89          HG12      ILE  89   6.904   7.758   5.151
  641   HG13  ILE  89          HG11      ILE  89   8.076   8.539   6.207
  642   HG21  ILE  89          HG21      ILE  89   9.124   6.986   3.054
  643   HG22  ILE  89          HG22      ILE  89   7.810   5.908   3.525
  644   HG23  ILE  89          HG23      ILE  89   9.484   5.392   3.714
  645   HD11  ILE  89          HD11      ILE  89   9.246   9.420   4.262
  646   HD12  ILE  89          HD12      ILE  89   7.554   9.919   4.280
  647   HD13  ILE  89          HD13      ILE  89   8.082   8.628   3.201
  648    H    TRP  90           HN       TRP  90  10.767   5.005   6.680
  649    HA   TRP  90           HA       TRP  90  10.976   2.748   5.042
  650    HD1  TRP  90           HD1      TRP  90  13.125   0.868   8.406
  651    HE1  TRP  90           HE1      TRP  90  14.382  -1.083   7.250
  652    HE3  TRP  90           HE3      TRP  90  13.135   2.623   3.605
  653    HZ2  TRP  90           HZ2      TRP  90  15.262  -1.766   4.664
  654    HZ3  TRP  90           HZ3      TRP  90  14.204   1.268   1.853
  655    HH2  TRP  90           HH2      TRP  90  15.239  -0.882   2.375
  656    HB2  TRP  90           HB2      TRP  90  12.929   3.789   6.089
  657    HB3  TRP  90           HB1      TRP  90  12.374   3.232   7.666
  658    H    LYS  91           HN       LYS  91  10.215   2.913   8.519
  659    HA   LYS  91           HA       LYS  91   9.960   0.089   8.745
  660    HB2  LYS  91           HB2      LYS  91   9.332   0.480  11.027
  661    HB3  LYS  91           HB1      LYS  91  10.646   1.569  10.613
  662    HG2  LYS  91           HG2      LYS  91   9.135   3.417  10.408
  663    HG3  LYS  91           HG1      LYS  91   7.745   2.356  10.645
  664    HD2  LYS  91           HD2      LYS  91   7.934   3.071  12.787
  665    HD3  LYS  91           HD1      LYS  91   9.130   1.778  12.859
  666    HE2  LYS  91           HE2      LYS  91   9.787   4.656  12.249
  667    HE3  LYS  91           HE1      LYS  91   9.899   3.934  13.848
  668    HZ1  LYS  91           HZ1      LYS  91  11.493   2.327  12.929
  669    HZ2  LYS  91           HZ2      LYS  91  12.045   3.932  12.823
  670    HZ3  LYS  91           HZ3      LYS  91  11.445   3.149  11.446
  671    H    LEU  92           HN       LEU  92   7.783   2.518   7.712
  672    HA   LEU  92           HA       LEU  92   5.464   0.837   8.261
  673    HG   LEU  92           HG       LEU  92   3.312   2.066   6.915
  674    HB2  LEU  92           HB2      LEU  92   5.513   3.391   8.503
  675    HB3  LEU  92           HB1      LEU  92   5.461   3.436   6.740
  676   HD11  LEU  92          HD11      LEU  92   3.476   2.987   9.779
  677   HD12  LEU  92          HD12      LEU  92   3.596   1.315   9.227
  678   HD13  LEU  92          HD13      LEU  92   2.091   2.213   9.012
  679   HD21  LEU  92          HD21      LEU  92   3.267   4.824   8.127
  680   HD22  LEU  92          HD22      LEU  92   1.946   4.014   7.284
  681   HD23  LEU  92          HD23      LEU  92   3.401   4.486   6.402
  682    H    ALA  93           HN       ALA  93   7.655   1.653   5.694
  683    HA   ALA  93           HA       ALA  93   5.937   0.760   3.566
  684    HB1  ALA  93           HB1      ALA  93   7.854   1.130   2.129
  685    HB2  ALA  93           HB2      ALA  93   8.900   1.315   3.539
  686    HB3  ALA  93           HB3      ALA  93   7.637   2.501   3.215
  687    H    ASP  94           HN       ASP  94   8.755  -0.489   5.312
  688    HA   ASP  94           HA       ASP  94   8.252  -3.085   4.051
  689    HB2  ASP  94           HB2      ASP  94  10.623  -2.196   4.052
  690    HB3  ASP  94           HB1      ASP  94  10.622  -2.390   5.805
  691    H    VAL  95           HN       VAL  95   6.946  -4.336   5.065
  692    HA   VAL  95           HA       VAL  95   6.218  -4.023   7.805
  693    HB   VAL  95           HB       VAL  95   5.553  -6.360   6.024
  694   HG11  VAL  95          HG11      VAL  95   5.058  -6.672   8.398
  695   HG12  VAL  95          HG12      VAL  95   3.579  -6.554   7.444
  696   HG13  VAL  95          HG13      VAL  95   4.124  -5.178   8.398
  697   HG21  VAL  95          HG21      VAL  95   4.952  -4.303   4.870
  698   HG22  VAL  95          HG22      VAL  95   4.101  -3.732   6.304
  699   HG23  VAL  95          HG23      VAL  95   3.506  -5.143   5.429
  700    H    ASP  96           HN       ASP  96   8.636  -5.854   6.172
  701    HA   ASP  96           HA       ASP  96   8.884  -7.687   8.467
  702    HB2  ASP  96           HB2      ASP  96   9.699  -9.294   7.041
  703    HB3  ASP  96           HB1      ASP  96   8.704  -8.365   5.918
  704    H    LYS  97           HN       LYS  97  10.489  -5.241   6.597
  705    HA   LYS  97           HA       LYS  97  12.139  -3.792   7.128
  706    HB2  LYS  97           HB2      LYS  97  12.117  -4.841   9.944
  707    HB3  LYS  97           HB1      LYS  97  12.439  -3.202   9.371
  708    HG2  LYS  97           HG2      LYS  97  10.077  -3.067   8.627
  709    HG3  LYS  97           HG1      LYS  97   9.797  -4.632   9.367
  710    HD2  LYS  97           HD2      LYS  97  10.637  -3.646  11.530
  711    HD3  LYS  97           HD1      LYS  97  10.585  -2.071  10.737
  712    HE2  LYS  97           HE2      LYS  97   8.195  -2.302  10.370
  713    HE3  LYS  97           HE1      LYS  97   8.222  -3.928  11.052
  714    HZ1  LYS  97           HZ1      LYS  97   7.434  -2.399  12.706
  715    HZ2  LYS  97           HZ2      LYS  97   8.773  -1.389  12.492
  716    HZ3  LYS  97           HZ3      LYS  97   8.979  -2.920  13.173
  717    H    ASP  98           HN       ASP  98  13.372  -5.184   5.773
  718    HA   ASP  98           HA       ASP  98  15.197  -7.032   7.127
  719    HB2  ASP  98           HB2      ASP  98  15.598  -7.779   4.690
  720    HB3  ASP  98           HB1      ASP  98  14.021  -8.138   5.411
  721    H    GLY  99           HN       GLY  99  15.134  -4.003   5.480
  722    HA2  GLY  99           HA2      GLY  99  17.071  -2.541   5.604
  723    HA3  GLY  99           HA1      GLY  99  18.091  -3.967   5.464
  724    H    LEU 100           HN       LEU 100  15.474  -4.221   3.426
  725    HA   LEU 100           HA       LEU 100  16.555  -2.636   1.249
  726    HG   LEU 100           HG       LEU 100  16.159  -6.139   2.278
  727    HB2  LEU 100           HB2      LEU 100  16.450  -4.615  -0.286
  728    HB3  LEU 100           HB1      LEU 100  17.760  -4.647   0.874
  729   HD11  LEU 100          HD11      LEU 100  14.946  -6.369  -0.469
  730   HD12  LEU 100          HD12      LEU 100  14.141  -5.872   1.025
  731   HD13  LEU 100          HD13      LEU 100  14.694  -7.536   0.830
  732   HD21  LEU 100          HD21      LEU 100  18.243  -6.899   1.309
  733   HD22  LEU 100          HD22      LEU 100  17.451  -7.139  -0.249
  734   HD23  LEU 100          HD23      LEU 100  16.990  -8.127   1.138
  735    H    LEU 101           HN       LEU 101  15.012  -3.108  -0.754
  736    HA   LEU 101           HA       LEU 101  12.284  -3.688   0.083
  737    HG   LEU 101           HG       LEU 101  13.180  -0.991   1.333
  738    HB2  LEU 101           HB2      LEU 101  13.140  -1.054  -1.136
  739    HB3  LEU 101           HB1      LEU 101  11.475  -1.603  -1.098
  740   HD11  LEU 101          HD11      LEU 101  12.543   0.996   0.035
  741   HD12  LEU 101          HD12      LEU 101  11.751   0.939   1.611
  742   HD13  LEU 101          HD13      LEU 101  10.851   0.515   0.152
  743   HD21  LEU 101          HD21      LEU 101  11.571  -2.704   1.852
  744   HD22  LEU 101          HD22      LEU 101  10.285  -1.772   1.088
  745   HD23  LEU 101          HD23      LEU 101  11.051  -1.173   2.560
  746    H    ASP 102           HN       ASP 102  11.489  -5.067  -1.441
  747    HA   ASP 102           HA       ASP 102  12.766  -5.312  -4.003
  748    HB2  ASP 102           HB2      ASP 102  11.500  -7.188  -4.353
  749    HB3  ASP 102           HB1      ASP 102  11.440  -7.104  -2.598
  750    H    ASP 103           HN       ASP 103  10.810  -5.600  -5.879
  751    HA   ASP 103           HA       ASP 103  10.445  -2.933  -6.712
  752    HB2  ASP 103           HB2      ASP 103   9.270  -3.849  -8.598
  753    HB3  ASP 103           HB1      ASP 103  10.614  -4.920  -8.182
  754    H    GLU 104           HN       GLU 104   8.317  -5.142  -5.008
  755    HA   GLU 104           HA       GLU 104   6.087  -3.297  -5.204
  756    HB2  GLU 104           HB2      GLU 104   5.890  -5.842  -5.175
  757    HB3  GLU 104           HB1      GLU 104   6.208  -5.733  -3.449
  758    HG2  GLU 104           HG2      GLU 104   4.269  -4.199  -3.242
  759    HG3  GLU 104           HG1      GLU 104   3.914  -4.509  -4.954
  760    H    GLU 105           HN       GLU 105   8.449  -4.328  -2.806
  761    HA   GLU 105           HA       GLU 105   7.454  -2.885  -0.613
  762    HB2  GLU 105           HB2      GLU 105   9.899  -4.242  -1.353
  763    HB3  GLU 105           HB1      GLU 105  10.230  -2.794  -0.419
  764    HG2  GLU 105           HG2      GLU 105   9.017  -3.568   1.431
  765    HG3  GLU 105           HG1      GLU 105   8.218  -4.827   0.491
  766    H    PHE 106           HN       PHE 106   9.604  -1.923  -3.259
  767    HA   PHE 106           HA       PHE 106  10.036   0.753  -2.480
  768    HD1  PHE 106           HD2      PHE 106   9.178   2.589  -4.365
  769    HD2  PHE 106           HD1      PHE 106  12.659   0.691  -5.878
  770    HE1  PHE 106           HE2      PHE 106   9.973   4.747  -5.236
  771    HE2  PHE 106           HE1      PHE 106  13.451   2.834  -6.753
  772    HZ   PHE 106           HZ       PHE 106  12.122   4.867  -6.425
  773    HB2  PHE 106           HB2      PHE 106  11.287  -0.435  -4.297
  774    HB3  PHE 106           HB1      PHE 106   9.854  -0.356  -5.301
  775    H    ALA 107           HN       ALA 107   7.553  -0.832  -4.434
  776    HA   ALA 107           HA       ALA 107   6.035   1.330  -5.210
  777    HB1  ALA 107           HB1      ALA 107   5.587  -0.962  -5.930
  778    HB2  ALA 107           HB2      ALA 107   4.133  -0.190  -5.297
  779    HB3  ALA 107           HB3      ALA 107   5.011  -1.360  -4.310
  780    H    LEU 108           HN       LEU 108   5.819  -0.459  -2.134
  781    HA   LEU 108           HA       LEU 108   3.781   1.169  -1.023
  782    HG   LEU 108           HG       LEU 108   2.777  -0.111   0.770
  783    HB2  LEU 108           HB2      LEU 108   4.777  -1.173  -0.295
  784    HB3  LEU 108           HB1      LEU 108   5.801  -0.165   0.719
  785   HD11  LEU 108          HD11      LEU 108   2.931  -1.369   2.823
  786   HD12  LEU 108          HD12      LEU 108   4.685  -1.468   2.655
  787   HD13  LEU 108          HD13      LEU 108   3.640  -2.274   1.485
  788   HD21  LEU 108          HD21      LEU 108   4.820   1.047   2.652
  789   HD22  LEU 108          HD22      LEU 108   3.073   1.043   2.898
  790   HD23  LEU 108          HD23      LEU 108   3.773   1.952   1.556
  791    H    ALA 109           HN       ALA 109   7.316   1.122  -0.559
  792    HA   ALA 109           HA       ALA 109   7.628   3.205   1.211
  793    HB1  ALA 109           HB1      ALA 109   9.444   1.778   0.405
  794    HB2  ALA 109           HB2      ALA 109   9.861   3.491   0.350
  795    HB3  ALA 109           HB3      ALA 109   9.428   2.643  -1.133
  796    H    ASN 110           HN       ASN 110   7.706   3.583  -2.344
  797    HA   ASN 110           HA       ASN 110   7.995   6.397  -2.296
  798    HB2  ASN 110           HB2      ASN 110   8.541   4.727  -4.192
  799    HB3  ASN 110           HB1      ASN 110   6.835   4.834  -4.594
  800   HD21  ASN 110          HD21      ASN 110   6.689   7.702  -3.875
  801   HD22  ASN 110          HD22      ASN 110   7.481   8.539  -5.169
  802    H    HIS 111           HN       HIS 111   5.291   4.212  -2.236
  803    HA   HIS 111           HA       HIS 111   3.301   6.094  -2.983
  804    HD1  HIS 111           HD1      HIS 111   0.981   4.855  -4.239
  805    HD2  HIS 111           HD2      HIS 111   0.517   4.331  -0.137
  806    HE1  HIS 111           HE1      HIS 111  -1.465   5.229  -3.784
  807    HE2  HIS 111           HE2      HIS 111  -1.615   5.299  -1.265
  808    HB2  HIS 111           HB2      HIS 111   2.971   3.618  -3.023
  809    HB3  HIS 111           HB1      HIS 111   2.943   3.633  -1.257
  810    H    LEU 112           HN       LEU 112   4.586   4.976   0.110
  811    HA   LEU 112           HA       LEU 112   2.952   6.579   1.763
  812    HG   LEU 112           HG       LEU 112   3.863   3.706   2.220
  813    HB2  LEU 112           HB2      LEU 112   5.666   5.335   2.143
  814    HB3  LEU 112           HB1      LEU 112   4.894   6.293   3.401
  815   HD11  LEU 112          HD11      LEU 112   4.231   2.849   4.480
  816   HD12  LEU 112          HD12      LEU 112   4.906   4.407   4.962
  817   HD13  LEU 112          HD13      LEU 112   5.729   3.426   3.750
  818   HD21  LEU 112          HD21      LEU 112   1.988   5.139   2.706
  819   HD22  LEU 112          HD22      LEU 112   2.649   5.532   4.291
  820   HD23  LEU 112          HD23      LEU 112   2.099   3.892   3.947
  821    H    ILE 113           HN       ILE 113   6.001   7.172   0.120
  822    HA   ILE 113           HA       ILE 113   6.570   9.698   1.206
  823    HB   ILE 113           HB       ILE 113   7.190   8.546  -1.514
  824   HG12  ILE 113          HG12      ILE 113   8.945   9.018   0.898
  825   HG13  ILE 113          HG11      ILE 113   8.184   7.477   0.514
  826   HG21  ILE 113          HG21      ILE 113   7.176  10.990  -1.653
  827   HG22  ILE 113          HG22      ILE 113   8.811  10.345  -1.794
  828   HG23  ILE 113          HG23      ILE 113   8.280  11.074  -0.280
  829   HD11  ILE 113          HD11      ILE 113  10.539   7.561  -0.156
  830   HD12  ILE 113          HD12      ILE 113  10.179   8.923  -1.218
  831   HD13  ILE 113          HD13      ILE 113   9.472   7.340  -1.542
  832    H    LYS 114           HN       LYS 114   4.693   8.828  -1.746
  833    HA   LYS 114           HA       LYS 114   3.937  11.567  -2.119
  834    HB2  LYS 114           HB2      LYS 114   2.389  10.832  -3.842
  835    HB3  LYS 114           HB1      LYS 114   3.970  10.108  -4.057
  836    HG2  LYS 114           HG2      LYS 114   3.210   7.993  -3.380
  837    HG3  LYS 114           HG1      LYS 114   1.702   8.649  -2.736
  838    HD2  LYS 114           HD2      LYS 114   1.440   7.508  -4.934
  839    HD3  LYS 114           HD1      LYS 114   0.942   9.201  -4.963
  840    HE2  LYS 114           HE2      LYS 114   3.150   9.790  -5.917
  841    HE3  LYS 114           HE1      LYS 114   3.559   8.077  -5.954
  842    HZ1  LYS 114           HZ1      LYS 114   2.747   9.006  -8.095
  843    HZ2  LYS 114           HZ2      LYS 114   1.223   9.231  -7.383
  844    HZ3  LYS 114           HZ3      LYS 114   1.866   7.666  -7.550
  845    H    VAL 115           HN       VAL 115   2.671   8.999  -0.195
  846    HA   VAL 115           HA       VAL 115   0.127  10.036   0.384
  847    HB   VAL 115           HB       VAL 115   2.057   8.389   2.004
  848   HG11  VAL 115          HG11      VAL 115  -0.690   9.253   2.911
  849   HG12  VAL 115          HG12      VAL 115   0.841   9.778   3.615
  850   HG13  VAL 115          HG13      VAL 115   0.357   8.088   3.721
  851   HG21  VAL 115          HG21      VAL 115   0.890   7.306   0.164
  852   HG22  VAL 115          HG22      VAL 115  -0.660   7.801   0.848
  853   HG23  VAL 115          HG23      VAL 115   0.368   6.664   1.723
  854    H    LYS 116           HN       LYS 116   3.295  10.712   1.947
  855    HA   LYS 116           HA       LYS 116   2.048  12.805   3.509
  856    HB2  LYS 116           HB2      LYS 116   4.194  13.138   4.503
  857    HB3  LYS 116           HB1      LYS 116   3.822  11.420   4.477
  858    HG2  LYS 116           HG2      LYS 116   5.421  10.961   2.905
  859    HG3  LYS 116           HG1      LYS 116   5.405  12.610   2.263
  860    HD2  LYS 116           HD2      LYS 116   6.481  11.728   4.923
  861    HD3  LYS 116           HD1      LYS 116   7.420  12.237   3.528
  862    HE2  LYS 116           HE2      LYS 116   5.497  13.923   5.114
  863    HE3  LYS 116           HE1      LYS 116   7.248  14.046   5.125
  864    HZ1  LYS 116           HZ1      LYS 116   5.475  14.622   2.815
  865    HZ2  LYS 116           HZ2      LYS 116   7.166  14.683   2.775
  866    HZ3  LYS 116           HZ3      LYS 116   6.304  15.765   3.755
  867    H    LEU 117           HN       LEU 117   3.056  12.520   0.415
  868    HA   LEU 117           HA       LEU 117   3.966  15.254   0.074
  869    HG   LEU 117           HG       LEU 117   3.307  15.562  -2.853
  870    HB2  LEU 117           HB2      LEU 117   4.795  13.391  -1.371
  871    HB3  LEU 117           HB1      LEU 117   3.157  13.208  -2.007
  872   HD11  LEU 117          HD11      LEU 117   5.045  16.358  -1.342
  873   HD12  LEU 117          HD12      LEU 117   5.519  16.573  -3.027
  874   HD13  LEU 117          HD13      LEU 117   6.204  15.251  -2.081
  875   HD21  LEU 117          HD21      LEU 117   3.678  13.652  -4.312
  876   HD22  LEU 117          HD22      LEU 117   5.380  13.614  -3.850
  877   HD23  LEU 117          HD23      LEU 117   4.742  14.988  -4.751
  878    H    GLU 118           HN       GLU 118   1.043  13.436   0.122
  879    HA   GLU 118           HA       GLU 118  -0.653  15.274  -1.210
  880    HB2  GLU 118           HB2      GLU 118  -1.268  13.269   0.973
  881    HB3  GLU 118           HB1      GLU 118  -2.482  14.133   0.038
  882    HG2  GLU 118           HG2      GLU 118  -1.706  13.073  -2.004
  883    HG3  GLU 118           HG1      GLU 118  -0.426  12.247  -1.111
  884    H    GLY 119           HN       GLY 119   0.966  15.317   1.786
  885    HA2  GLY 119           HA2      GLY 119   1.253  17.585   2.686
  886    HA3  GLY 119           HA1      GLY 119  -0.481  17.789   2.486
  887    H    HIS 120           HN       HIS 120  -0.743  14.896   3.416
  888    HA   HIS 120           HA       HIS 120  -0.699  15.553   6.266
  889    HD1  HIS 120           HD1      HIS 120  -2.440  11.716   6.969
  890    HD2  HIS 120           HD2      HIS 120  -1.927  12.646   2.948
  891    HE1  HIS 120           HE1      HIS 120  -2.407   9.511   5.771
  892    HE2  HIS 120           HE2      HIS 120  -2.359  10.125   3.312
  893    HB2  HIS 120           HB2      HIS 120  -2.496  14.142   6.579
  894    HB3  HIS 120           HB1      HIS 120  -2.796  14.678   4.932
  895    H    GLU 121           HN       GLU 121   0.433  14.385   7.722
  896    HA   GLU 121           HA       GLU 121   2.633  12.839   6.766
  897    HB2  GLU 121           HB2      GLU 121   3.377  12.728   9.013
  898    HB3  GLU 121           HB1      GLU 121   2.656  14.319   8.817
  899    HG2  GLU 121           HG2      GLU 121   0.733  13.714  10.034
  900    HG3  GLU 121           HG1      GLU 121   1.131  11.998   9.951
  901    H    LEU 122           HN       LEU 122   3.194  10.702   7.639
  902    HA   LEU 122           HA       LEU 122   1.111   8.818   7.152
  903    HG   LEU 122           HG       LEU 122   2.941   8.466   5.425
  904    HB2  LEU 122           HB2      LEU 122   3.873   8.336   8.269
  905    HB3  LEU 122           HB1      LEU 122   2.787   7.115   7.638
  906   HD11  LEU 122          HD11      LEU 122   5.097   9.579   5.098
  907   HD12  LEU 122          HD12      LEU 122   5.464   9.370   6.810
  908   HD13  LEU 122          HD13      LEU 122   4.122  10.401   6.316
  909   HD21  LEU 122          HD21      LEU 122   3.749   6.209   5.734
  910   HD22  LEU 122          HD22      LEU 122   5.221   6.814   6.497
  911   HD23  LEU 122          HD23      LEU 122   4.912   7.144   4.793
  912    HA   PRO 123           HA       PRO 123  -0.294   8.513  11.281
  913    HB2  PRO 123           HB2      PRO 123  -2.060   6.526  10.954
  914    HB3  PRO 123           HB1      PRO 123  -2.274   8.098  10.176
  915    HG2  PRO 123           HG2      PRO 123  -1.414   5.510   9.010
  916    HG3  PRO 123           HG1      PRO 123  -2.300   6.840   8.253
  917    HD2  PRO 123           HD2      PRO 123   0.462   6.283   8.030
  918    HD3  PRO 123           HD1      PRO 123  -0.382   7.730   7.445
  919    H    ALA 124           HN       ALA 124   1.807   6.251  10.061
  920    HA   ALA 124           HA       ALA 124   3.012   4.531  10.933
  921    HB1  ALA 124           HB1      ALA 124   3.310   4.453  13.372
  922    HB2  ALA 124           HB2      ALA 124   1.996   5.616  13.560
  923    HB3  ALA 124           HB3      ALA 124   3.483   6.088  12.738
  924    H    ASP 125           HN       ASP 125   0.181   4.203  10.210
  925    HA   ASP 125           HA       ASP 125  -0.269   1.653  11.603
  926    HB2  ASP 125           HB2      ASP 125  -1.918   3.380  12.342
  927    HB3  ASP 125           HB1      ASP 125  -2.442   3.551  10.668
  928    H    LEU 126           HN       LEU 126  -0.369  -0.020  10.246
  929    HA   LEU 126           HA       LEU 126  -0.519   0.569   7.371
  930    HG   LEU 126           HG       LEU 126   1.996  -2.065   6.655
  931    HB2  LEU 126           HB2      LEU 126   1.472  -0.669   8.527
  932    HB3  LEU 126           HB1      LEU 126   0.392  -2.046   8.547
  933   HD11  LEU 126          HD11      LEU 126   0.389  -2.598   4.899
  934   HD12  LEU 126          HD12      LEU 126  -0.893  -1.826   5.831
  935   HD13  LEU 126          HD13      LEU 126  -0.104  -3.277   6.451
  936   HD21  LEU 126          HD21      LEU 126   1.615  -0.512   4.780
  937   HD22  LEU 126          HD22      LEU 126   2.177   0.298   6.245
  938   HD23  LEU 126          HD23      LEU 126   0.476   0.385   5.787
  939    HA   PRO 127           HA       PRO 127  -4.527  -1.402   7.994
  940    HB2  PRO 127           HB2      PRO 127  -5.606   0.037   5.829
  941    HB3  PRO 127           HB1      PRO 127  -5.687   0.482   7.538
  942    HG2  PRO 127           HG2      PRO 127  -4.295   1.837   5.496
  943    HG3  PRO 127           HG1      PRO 127  -4.164   2.127   7.241
  944    HD2  PRO 127           HD2      PRO 127  -2.378   0.586   5.434
  945    HD3  PRO 127           HD1      PRO 127  -1.990   1.497   6.906
  946    HA   PRO 128           HA       PRO 128  -4.760  -4.686   5.063
  947    HB2  PRO 128           HB2      PRO 128  -7.441  -4.584   4.312
  948    HB3  PRO 128           HB1      PRO 128  -6.802  -5.408   5.749
  949    HG2  PRO 128           HG2      PRO 128  -8.043  -2.699   5.504
  950    HG3  PRO 128           HG1      PRO 128  -8.234  -3.910   6.785
  951    HD2  PRO 128           HD2      PRO 128  -6.674  -1.777   7.146
  952    HD3  PRO 128           HD1      PRO 128  -6.192  -3.370   7.767
  953    H    HIS 129           HN       HIS 129  -6.040  -1.578   4.013
  954    HA   HIS 129           HA       HIS 129  -5.921  -2.393   1.233
  955    HD1  HIS 129           HD1      HIS 129  -8.567   0.062   3.789
  956    HD2  HIS 129           HD2      HIS 129  -5.086   1.908   2.440
  957    HE1  HIS 129           HE1      HIS 129  -8.201   2.026   5.319
  958    HE2  HIS 129           HE2      HIS 129  -6.263   3.278   4.294
  959    HB2  HIS 129           HB2      HIS 129  -6.529   0.024   0.764
  960    HB3  HIS 129           HB1      HIS 129  -7.725  -0.913   1.630
  961    H    LEU 130           HN       LEU 130  -3.479  -2.193   3.021
  962    HA   LEU 130           HA       LEU 130  -1.834  -0.984   0.938
  963    HG   LEU 130           HG       LEU 130  -0.868   1.032   1.022
  964    HB2  LEU 130           HB2      LEU 130  -2.256   0.192   3.502
  965    HB3  LEU 130           HB1      LEU 130  -0.570  -0.244   3.332
  966   HD11  LEU 130          HD11      LEU 130  -2.914   2.333   2.802
  967   HD12  LEU 130          HD12      LEU 130  -3.225   1.500   1.278
  968   HD13  LEU 130          HD13      LEU 130  -2.296   3.001   1.290
  969   HD21  LEU 130          HD21      LEU 130  -0.516   2.448   3.653
  970   HD22  LEU 130          HD22      LEU 130   0.035   3.010   2.077
  971   HD23  LEU 130          HD23      LEU 130   0.739   1.560   2.793
  972    H    VAL 131           HN       VAL 131  -2.474  -3.681   2.382
  973    HA   VAL 131           HA       VAL 131   0.099  -4.342   3.506
  974    HB   VAL 131           HB       VAL 131  -1.818  -5.315   4.595
  975   HG11  VAL 131          HG11      VAL 131  -3.253  -6.980   3.526
  976   HG12  VAL 131          HG12      VAL 131  -2.426  -6.704   1.992
  977   HG13  VAL 131          HG13      VAL 131  -3.368  -5.410   2.730
  978   HG21  VAL 131          HG21      VAL 131  -0.239  -7.429   3.140
  979   HG22  VAL 131          HG22      VAL 131  -1.170  -7.672   4.619
  980   HG23  VAL 131          HG23      VAL 131   0.238  -6.611   4.627
  981    HA   PRO 132           HA       PRO 132   1.687  -5.282  -0.556
  982    HB2  PRO 132           HB2      PRO 132   4.141  -6.111   0.355
  983    HB3  PRO 132           HB1      PRO 132   3.706  -4.427   0.052
  984    HG2  PRO 132           HG2      PRO 132   3.779  -5.939   2.628
  985    HG3  PRO 132           HG1      PRO 132   4.267  -4.267   2.294
  986    HD2  PRO 132           HD2      PRO 132   1.932  -4.870   3.499
  987    HD3  PRO 132           HD1      PRO 132   2.098  -3.481   2.397
  988    HA   PRO 133           HA       PRO 133   0.959  -9.771  -0.562
  989    HB2  PRO 133           HB2      PRO 133   1.482  -9.248  -3.438
  990    HB3  PRO 133           HB1      PRO 133   0.143 -10.117  -2.672
  991    HG2  PRO 133           HG2      PRO 133  -0.228  -7.684  -3.706
  992    HG3  PRO 133           HG1      PRO 133  -1.024  -8.165  -2.188
  993    HD2  PRO 133           HD2      PRO 133   1.400  -6.446  -2.605
  994    HD3  PRO 133           HD1      PRO 133   0.042  -6.239  -1.467
  995    H    SER 134           HN       SER 134   3.660  -7.861  -1.101
  996    HA   SER 134           HA       SER 134   5.440  -9.905  -2.014
  997    HG   SER 134           HG       SER 134   8.046  -7.522  -1.851
  998    HB2  SER 134           HB2      SER 134   5.849  -7.480  -2.376
  999    HB3  SER 134           HB1      SER 134   6.068  -7.275  -0.640
 1000    H    LYS 135           HN       LYS 135   4.344  -8.788   1.156
 1001    HA   LYS 135           HA       LYS 135   6.600 -10.074   2.450
 1002    HB2  LYS 135           HB2      LYS 135   5.597  -9.144   4.591
 1003    HB3  LYS 135           HB1      LYS 135   6.109  -7.973   3.396
 1004    HG2  LYS 135           HG2      LYS 135   4.051  -7.258   4.395
 1005    HG3  LYS 135           HG1      LYS 135   3.771  -7.666   2.704
 1006    HD2  LYS 135           HD2      LYS 135   1.963  -8.433   4.180
 1007    HD3  LYS 135           HD1      LYS 135   2.758  -9.767   3.346
 1008    HE2  LYS 135           HE2      LYS 135   2.302 -10.300   5.696
 1009    HE3  LYS 135           HE1      LYS 135   4.029 -10.284   5.357
 1010    HZ1  LYS 135           HZ1      LYS 135   4.126  -8.043   6.304
 1011    HZ2  LYS 135           HZ2      LYS 135   3.587  -9.186   7.431
 1012    HZ3  LYS 135           HZ3      LYS 135   2.478  -8.129   6.697
 1013    H    ARG 136           HN       ARG 136   3.834 -11.311   1.306
 1014    HA   ARG 136           HA       ARG 136   3.098 -12.925   3.576
 1015    HE   ARG 136           HE       ARG 136   2.329 -15.450  -0.589
 1016    HB2  ARG 136           HB2      ARG 136   1.821 -14.199   1.626
 1017    HB3  ARG 136           HB1      ARG 136   1.228 -12.684   2.295
 1018    HG2  ARG 136           HG2      ARG 136   1.417 -11.660   0.343
 1019    HG3  ARG 136           HG1      ARG 136   3.082 -12.199   0.149
 1020    HD2  ARG 136           HD2      ARG 136   0.671 -13.892  -0.472
 1021    HD3  ARG 136           HD1      ARG 136   1.532 -12.922  -1.661
 1022   HH11  ARG 136          HH11      ARG 136   3.567 -12.452  -1.945
 1023   HH12  ARG 136          HH12      ARG 136   5.028 -13.189  -2.533
 1024   HH21  ARG 136          HH21      ARG 136   4.223 -16.414  -1.396
 1025   HH22  ARG 136          HH22      ARG 136   5.387 -15.434  -2.246
 1026    H    ARG 137           HN       ARG 137   5.408 -13.607   3.827
 1027    HA   ARG 137           HA       ARG 137   5.732 -16.164   2.439
 1028    HE   ARG 137           HE       ARG 137  10.817 -14.543   2.602
 1029    HB2  ARG 137           HB2      ARG 137   8.204 -15.790   2.397
 1030    HB3  ARG 137           HB1      ARG 137   7.289 -14.753   1.314
 1031    HG2  ARG 137           HG2      ARG 137   7.418 -12.981   3.102
 1032    HG3  ARG 137           HG1      ARG 137   8.582 -14.021   3.917
 1033    HD2  ARG 137           HD2      ARG 137   8.835 -12.908   1.143
 1034    HD3  ARG 137           HD1      ARG 137   9.709 -12.349   2.564
 1035   HH11  ARG 137          HH11      ARG 137   9.206 -13.568  -0.352
 1036   HH12  ARG 137          HH12      ARG 137  10.184 -14.573  -1.380
 1037   HH21  ARG 137          HH21      ARG 137  12.128 -15.846   1.268
 1038   HH22  ARG 137          HH22      ARG 137  11.877 -15.848  -0.451
 1039    H    HIS 138           HN       HIS 138   5.411 -17.607   3.951
 1040    HA   HIS 138           HA       HIS 138   6.435 -17.075   6.652
 1041    HD1  HIS 138           HD1      HIS 138   2.036 -17.829   5.730
 1042    HD2  HIS 138           HD2      HIS 138   4.813 -15.746   8.014
 1043    HE1  HIS 138           HE1      HIS 138   0.877 -15.724   6.463
 1044    HE2  HIS 138           HE2      HIS 138   2.524 -14.534   7.952
 1045    HB2  HIS 138           HB2      HIS 138   4.241 -18.914   5.724
 1046    HB3  HIS 138           HB1      HIS 138   4.835 -18.855   7.379
 1047    H    GLU 139           HN       GLU 139   7.834 -18.433   7.619
 1048    HA   GLU 139           HA       GLU 139   8.134 -21.150   6.835
 1049    HB2  GLU 139           HB2      GLU 139   9.490 -19.923   5.083
 1050    HB3  GLU 139           HB1      GLU 139  10.547 -19.387   6.380
 1051    HG2  GLU 139           HG2      GLU 139  11.467 -21.322   5.223
 1052    HG3  GLU 139           HG1      GLU 139  11.099 -21.690   6.911